smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name COc1cccc(CNc2cc[nH+]c3cc(Cl)ccc23)c1 ZINC000007982748 170311788 /nfs/dbraw/zinc/31/17/88/170311788.db2.gz LSXLJYRGVUQIOK-UHFFFAOYSA-N 1 1 298.773 4.509 20 0 CJADMO COc1ccc(CNc2cc[nH+]c3cc(Cl)ccc23)cc1 ZINC000008148610 170321491 /nfs/dbraw/zinc/32/14/91/170321491.db2.gz PUMJHRGCFRCJCO-UHFFFAOYSA-N 1 1 298.773 4.509 20 0 CJADMO COc1ccccc1CNc1cc[nH+]c2cc(Cl)ccc12 ZINC000008149692 170321600 /nfs/dbraw/zinc/32/16/00/170321600.db2.gz GWUAVDDZFLJHLC-UHFFFAOYSA-N 1 1 298.773 4.509 20 0 CJADMO Fc1ccc(CNc2cc[nH+]c3cc(Cl)ccc23)cc1 ZINC000008177928 170322653 /nfs/dbraw/zinc/32/26/53/170322653.db2.gz WJCBBYWXTNMZCY-UHFFFAOYSA-N 1 1 286.737 4.639 20 0 CJADMO CCOc1ccccc1[C@@H](C)[NH2+]Cc1ccccc1Cl ZINC000019908316 262176938 /nfs/dbraw/zinc/17/69/38/262176938.db2.gz JKHQPFOUHFLXTM-CYBMUJFWSA-N 1 1 289.806 4.590 20 0 CJADMO CCOc1ccccc1[C@H](C)[NH2+]Cc1ccccc1Cl ZINC000019908317 262176965 /nfs/dbraw/zinc/17/69/65/262176965.db2.gz JKHQPFOUHFLXTM-ZDUSSCGKSA-N 1 1 289.806 4.590 20 0 CJADMO C[C@@H]([NH2+]Cc1ccccc1Cl)c1cc2ccccc2o1 ZINC000019908371 170920233 /nfs/dbraw/zinc/92/02/33/170920233.db2.gz MXRGVNYFNFTTBC-GFCCVEGCSA-N 1 1 285.774 4.937 20 0 CJADMO C[C@@H]([NH2+][C@@H](C)c1ccc(Cl)cc1Cl)c1ccccn1 ZINC000019917704 170926687 /nfs/dbraw/zinc/92/66/87/170926687.db2.gz WKAOESVPKLAUFO-WDEREUQCSA-N 1 1 295.213 4.800 20 0 CJADMO C[C@@H]([NH2+][C@@H](C)c1ccco1)c1ccc(Cl)cc1Cl ZINC000019917742 170926594 /nfs/dbraw/zinc/92/65/94/170926594.db2.gz PHMLABCWWJBXHH-ZJUUUORDSA-N 1 1 284.186 4.998 20 0 CJADMO Cc1ccccc1[C@@H](C)[NH2+][C@H](C)c1c(F)cccc1F ZINC000020015785 170969841 /nfs/dbraw/zinc/96/98/41/170969841.db2.gz ITRBOQYZAFVLEE-CHWSQXEVSA-N 1 1 275.342 4.685 20 0 CJADMO Cc1nc([C@H](C)[NH2+][C@H](C)c2ccc(Cl)cc2)c(C)s1 ZINC000020122035 171001815 /nfs/dbraw/zinc/00/18/15/171001815.db2.gz OGMSBXMALNCDHW-ZJUUUORDSA-N 1 1 294.851 4.825 20 0 CJADMO Cc1nc([C@H](C)[NH2+][C@@H](C)c2ccc(Cl)cc2)c(C)s1 ZINC000020122036 171001791 /nfs/dbraw/zinc/00/17/91/171001791.db2.gz OGMSBXMALNCDHW-UWVGGRQHSA-N 1 1 294.851 4.825 20 0 CJADMO Cc1nc([C@@H](C)[NH2+][C@H](C)c2ccc(Cl)cc2)c(C)s1 ZINC000020122037 171002004 /nfs/dbraw/zinc/00/20/04/171002004.db2.gz OGMSBXMALNCDHW-NXEZZACHSA-N 1 1 294.851 4.825 20 0 CJADMO Cc1nc([C@@H](C)[NH2+][C@@H](C)c2ccc(Cl)cc2)c(C)s1 ZINC000020122038 171002312 /nfs/dbraw/zinc/00/23/12/171002312.db2.gz OGMSBXMALNCDHW-VHSXEESVSA-N 1 1 294.851 4.825 20 0 CJADMO C[C@@H]([NH2+][C@@H](C)c1cc(Cl)ccc1Cl)c1ccccn1 ZINC000020123417 171003911 /nfs/dbraw/zinc/00/39/11/171003911.db2.gz TYRMCPVBGOBTRT-WDEREUQCSA-N 1 1 295.213 4.800 20 0 CJADMO C[C@H]([NH2+][C@@H](C)c1cc(Cl)ccc1Cl)c1ccccn1 ZINC000020123418 171004276 /nfs/dbraw/zinc/00/42/76/171004276.db2.gz TYRMCPVBGOBTRT-QWRGUYRKSA-N 1 1 295.213 4.800 20 0 CJADMO C[C@@H]([NH2+][C@H](C)c1cc(Cl)ccc1Cl)c1ccccn1 ZINC000020123419 171003984 /nfs/dbraw/zinc/00/39/84/171003984.db2.gz TYRMCPVBGOBTRT-GHMZBOCLSA-N 1 1 295.213 4.800 20 0 CJADMO C[C@@H]([NH2+][C@@H](C)c1ccccn1)c1cc(Cl)ccc1Cl ZINC000020123420 171004398 /nfs/dbraw/zinc/00/43/98/171004398.db2.gz TYRMCPVBGOBTRT-MNOVXSKESA-N 1 1 295.213 4.800 20 0 CJADMO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccccc2Cl)o1 ZINC000020124070 171005897 /nfs/dbraw/zinc/00/58/97/171005897.db2.gz NVCQEWXFDTYRSG-NWDGAFQWSA-N 1 1 263.768 4.653 20 0 CJADMO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2ccccc2Cl)o1 ZINC000020124071 171005738 /nfs/dbraw/zinc/00/57/38/171005738.db2.gz NVCQEWXFDTYRSG-RYUDHWBXSA-N 1 1 263.768 4.653 20 0 CJADMO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2ccccc2Cl)o1 ZINC000020124072 171005867 /nfs/dbraw/zinc/00/58/67/171005867.db2.gz NVCQEWXFDTYRSG-VXGBXAGGSA-N 1 1 263.768 4.653 20 0 CJADMO Cc1ccc([C@H](C)[NH2+][C@H](C)c2ccccc2Cl)o1 ZINC000020124073 171005530 /nfs/dbraw/zinc/00/55/30/171005530.db2.gz NVCQEWXFDTYRSG-NEPJUHHUSA-N 1 1 263.768 4.653 20 0 CJADMO Cc1nc([C@H](C)[NH2+][C@H](C)c2cccc(Cl)c2)c(C)s1 ZINC000020124330 171006640 /nfs/dbraw/zinc/00/66/40/171006640.db2.gz RYYOPNMDLWYBHJ-ZJUUUORDSA-N 1 1 294.851 4.825 20 0 CJADMO Cc1nc([C@@H](C)[NH2+][C@H](C)c2cccc(Cl)c2)c(C)s1 ZINC000020124332 171006785 /nfs/dbraw/zinc/00/67/85/171006785.db2.gz RYYOPNMDLWYBHJ-NXEZZACHSA-N 1 1 294.851 4.825 20 0 CJADMO C[C@@H]([NH2+][C@@H](C)c1cc(Cl)ccc1Cl)c1cccnc1 ZINC000020127639 171012788 /nfs/dbraw/zinc/01/27/88/171012788.db2.gz KDPHXGLBBHOICR-MNOVXSKESA-N 1 1 295.213 4.800 20 0 CJADMO C[C@H]([NH2+][C@@H](C)c1cc(Cl)ccc1Cl)c1cccnc1 ZINC000020127640 171012948 /nfs/dbraw/zinc/01/29/48/171012948.db2.gz KDPHXGLBBHOICR-QWRGUYRKSA-N 1 1 295.213 4.800 20 0 CJADMO C[C@@H]([NH2+][C@H](C)c1cc(Cl)ccc1Cl)c1cccnc1 ZINC000020127641 171013304 /nfs/dbraw/zinc/01/33/04/171013304.db2.gz KDPHXGLBBHOICR-GHMZBOCLSA-N 1 1 295.213 4.800 20 0 CJADMO C[C@@H]([NH2+][C@@H](C)c1cccnc1)c1cc(Cl)ccc1Cl ZINC000020127642 171012732 /nfs/dbraw/zinc/01/27/32/171012732.db2.gz KDPHXGLBBHOICR-WDEREUQCSA-N 1 1 295.213 4.800 20 0 CJADMO C[C@@H]([NH2+][C@@H](C)c1c(F)cccc1F)c1cccc(F)c1 ZINC000020147848 171034962 /nfs/dbraw/zinc/03/49/62/171034962.db2.gz DRFLUGNVRDRLDP-MNOVXSKESA-N 1 1 279.305 4.516 20 0 CJADMO C[C@H]([NH2+][C@@H](C)c1c(F)cccc1F)c1cccc(F)c1 ZINC000020147849 171035328 /nfs/dbraw/zinc/03/53/28/171035328.db2.gz DRFLUGNVRDRLDP-QWRGUYRKSA-N 1 1 279.305 4.516 20 0 CJADMO C[C@@H]([NH2+][C@H](C)c1c(F)cccc1F)c1cccc(F)c1 ZINC000020147850 171035529 /nfs/dbraw/zinc/03/55/29/171035529.db2.gz DRFLUGNVRDRLDP-GHMZBOCLSA-N 1 1 279.305 4.516 20 0 CJADMO C[C@@H]([NH2+][C@@H](C)c1cccc(F)c1)c1c(F)cccc1F ZINC000020147851 171035506 /nfs/dbraw/zinc/03/55/06/171035506.db2.gz DRFLUGNVRDRLDP-WDEREUQCSA-N 1 1 279.305 4.516 20 0 CJADMO C[C@@H]([NH2+][C@@H](c1ccccc1)c1ccccn1)c1cccs1 ZINC000020148263 171036423 /nfs/dbraw/zinc/03/64/23/171036423.db2.gz ZHSAIMOIRDNGKL-KDOFPFPSSA-N 1 1 294.423 4.583 20 0 CJADMO C[C@H]([NH2+][C@@H](c1ccccc1)c1ccccn1)c1cccs1 ZINC000020148264 171036248 /nfs/dbraw/zinc/03/62/48/171036248.db2.gz ZHSAIMOIRDNGKL-KSSFIOAISA-N 1 1 294.423 4.583 20 0 CJADMO C[C@@H]([NH2+][C@H](c1ccccc1)c1ccccn1)c1cccs1 ZINC000020148265 171035950 /nfs/dbraw/zinc/03/59/50/171035950.db2.gz ZHSAIMOIRDNGKL-RDTXWAMCSA-N 1 1 294.423 4.583 20 0 CJADMO C[C@H]([NH2+][C@H](c1ccccc1)c1ccccn1)c1cccs1 ZINC000020148266 171035829 /nfs/dbraw/zinc/03/58/29/171035829.db2.gz ZHSAIMOIRDNGKL-KBXCAEBGSA-N 1 1 294.423 4.583 20 0 CJADMO C[C@@H]([NH2+][C@H](c1ccco1)c1ccccc1)c1cccs1 ZINC000020148446 171037033 /nfs/dbraw/zinc/03/70/33/171037033.db2.gz VZZFKXXDKRMMSG-DYVFJYSZSA-N 1 1 283.396 4.781 20 0 CJADMO C[C@H]([NH2+][C@H](c1ccco1)c1ccccc1)c1cccs1 ZINC000020148447 171036858 /nfs/dbraw/zinc/03/68/58/171036858.db2.gz VZZFKXXDKRMMSG-GUYCJALGSA-N 1 1 283.396 4.781 20 0 CJADMO C[C@@H]([NH2+][C@@H](c1ccco1)c1ccccc1)c1cccs1 ZINC000020148448 171037202 /nfs/dbraw/zinc/03/72/02/171037202.db2.gz VZZFKXXDKRMMSG-CXAGYDPISA-N 1 1 283.396 4.781 20 0 CJADMO C[C@H]([NH2+][C@@H](c1ccco1)c1ccccc1)c1cccs1 ZINC000020148449 171037102 /nfs/dbraw/zinc/03/71/02/171037102.db2.gz VZZFKXXDKRMMSG-SUMWQHHRSA-N 1 1 283.396 4.781 20 0 CJADMO Clc1ccc(C[NH2+][C@H](c2ccco2)c2ccccc2)cc1 ZINC000020209827 171073498 /nfs/dbraw/zinc/07/34/98/171073498.db2.gz DJUHKUPSPBQLPT-SFHVURJKSA-N 1 1 297.785 4.812 20 0 CJADMO Clc1ccc(C[NH2+][C@@H](c2ccco2)c2ccccc2)cc1 ZINC000020209829 171073390 /nfs/dbraw/zinc/07/33/90/171073390.db2.gz DJUHKUPSPBQLPT-GOSISDBHSA-N 1 1 297.785 4.812 20 0 CJADMO Fc1cccc(CNc2cc[nH+]c3cc(Cl)ccc23)c1 ZINC000020473688 262241070 /nfs/dbraw/zinc/24/10/70/262241070.db2.gz BTCDPKINDJIPFR-UHFFFAOYSA-N 1 1 286.737 4.639 20 0 CJADMO C[C@@H]([NH2+][C@@H](c1ccccc1)c1ccccn1)c1ccccc1 ZINC000020542203 171242106 /nfs/dbraw/zinc/24/21/06/171242106.db2.gz ODZFGOKUXYMPRI-UZLBHIALSA-N 1 1 288.394 4.522 20 0 CJADMO C[C@H]([NH2+][C@@H](c1ccccc1)c1ccccn1)c1ccccc1 ZINC000020542206 171242192 /nfs/dbraw/zinc/24/21/92/171242192.db2.gz ODZFGOKUXYMPRI-JXFKEZNVSA-N 1 1 288.394 4.522 20 0 CJADMO C[C@@H]([NH2+][C@H](c1ccccc1)c1ccccn1)c1ccccc1 ZINC000020542209 171242044 /nfs/dbraw/zinc/24/20/44/171242044.db2.gz ODZFGOKUXYMPRI-OXQOHEQNSA-N 1 1 288.394 4.522 20 0 CJADMO C[C@H]([NH2+][C@H](c1ccccc1)c1ccccn1)c1ccccc1 ZINC000020542211 171242286 /nfs/dbraw/zinc/24/22/86/171242286.db2.gz ODZFGOKUXYMPRI-OXJNMPFZSA-N 1 1 288.394 4.522 20 0 CJADMO Clc1cccc(Cl)c1C[NH2+][C@@H]1CCCc2occc21 ZINC000020553438 171248827 /nfs/dbraw/zinc/24/88/27/171248827.db2.gz WINCAVSHMSJHCB-CQSZACIVSA-N 1 1 296.197 4.754 20 0 CJADMO Clc1cccc(Cl)c1C[NH2+][C@H]1CCCc2occc21 ZINC000020553439 171248556 /nfs/dbraw/zinc/24/85/56/171248556.db2.gz WINCAVSHMSJHCB-AWEZNQCLSA-N 1 1 296.197 4.754 20 0 CJADMO C[C@H]([NH2+]Cc1ccc([C@H]2C[C@H]2C)o1)c1ccccc1Cl ZINC000020558906 262250681 /nfs/dbraw/zinc/25/06/81/262250681.db2.gz QLGUKCAGXXHIDV-XUJVJEKNSA-N 1 1 289.806 4.907 20 0 CJADMO C[C@H]([NH2+]Cc1ccc([C@H]2C[C@@H]2C)o1)c1ccccc1Cl ZINC000020558908 262250873 /nfs/dbraw/zinc/25/08/73/262250873.db2.gz QLGUKCAGXXHIDV-HUBLWGQQSA-N 1 1 289.806 4.907 20 0 CJADMO C[C@H]([NH2+]Cc1ccc([C@@H]2C[C@H]2C)o1)c1ccccc1Cl ZINC000020558910 262250885 /nfs/dbraw/zinc/25/08/85/262250885.db2.gz QLGUKCAGXXHIDV-TYNCELHUSA-N 1 1 289.806 4.907 20 0 CJADMO C[C@H]([NH2+]Cc1ccc([C@@H]2C[C@@H]2C)o1)c1ccccc1Cl ZINC000020558912 262250850 /nfs/dbraw/zinc/25/08/50/262250850.db2.gz QLGUKCAGXXHIDV-SLEUVZQESA-N 1 1 289.806 4.907 20 0 CJADMO Fc1ccccc1CNc1cc[nH+]c2cc(Cl)ccc12 ZINC000020564060 171252834 /nfs/dbraw/zinc/25/28/34/171252834.db2.gz TXIHEJRFIQZGER-UHFFFAOYSA-N 1 1 286.737 4.639 20 0 CJADMO CCOc1ccccc1C[NH2+][C@@H](C)c1ccccc1Cl ZINC000020566546 262251999 /nfs/dbraw/zinc/25/19/99/262251999.db2.gz MGYOTJFBUGUINV-ZDUSSCGKSA-N 1 1 289.806 4.590 20 0 CJADMO CCOc1ccccc1C[NH2+][C@H](C)c1ccccc1Cl ZINC000020566548 262251949 /nfs/dbraw/zinc/25/19/49/262251949.db2.gz MGYOTJFBUGUINV-CYBMUJFWSA-N 1 1 289.806 4.590 20 0 CJADMO C[C@@H]([NH2+]Cc1c(Cl)cccc1Cl)c1cccs1 ZINC000020567093 171255181 /nfs/dbraw/zinc/25/51/81/171255181.db2.gz REPKAOFBKUMSFU-SECBINFHSA-N 1 1 286.227 4.906 20 0 CJADMO C[C@H]([NH2+]Cc1c(Cl)cccc1Cl)c1cccs1 ZINC000020567094 171255140 /nfs/dbraw/zinc/25/51/40/171255140.db2.gz REPKAOFBKUMSFU-VIFPVBQESA-N 1 1 286.227 4.906 20 0 CJADMO Fc1ccccc1C[NH2+]C1c2ccccc2-c2ccccc21 ZINC000020828527 171275172 /nfs/dbraw/zinc/27/51/72/171275172.db2.gz HTFCCHGSPAOCLH-UHFFFAOYSA-N 1 1 289.353 4.685 20 0 CJADMO Clc1ccc(C[NH2+][C@@H]2CCCc3occc32)c(Cl)c1 ZINC000021060629 171296645 /nfs/dbraw/zinc/29/66/45/171296645.db2.gz HNGGNSRFTGIJLP-CQSZACIVSA-N 1 1 296.197 4.754 20 0 CJADMO Clc1ccc(C[NH2+][C@H]2CCCc3occc32)c(Cl)c1 ZINC000021060633 171296920 /nfs/dbraw/zinc/29/69/20/171296920.db2.gz HNGGNSRFTGIJLP-AWEZNQCLSA-N 1 1 296.197 4.754 20 0 CJADMO C[C@@H]([NH2+]Cc1cc2ccccc2o1)c1ccccc1Cl ZINC000021514327 262388211 /nfs/dbraw/zinc/38/82/11/262388211.db2.gz LRCWUSYSRRKITJ-GFCCVEGCSA-N 1 1 285.774 4.937 20 0 CJADMO C[C@H]([NH2+]Cc1cc2ccccc2o1)c1ccccc1Cl ZINC000021514329 262387934 /nfs/dbraw/zinc/38/79/34/262387934.db2.gz LRCWUSYSRRKITJ-LBPRGKRZSA-N 1 1 285.774 4.937 20 0 CJADMO C[C@@H]([NH2+][C@@H](C)c1ccccc1Cl)c1ccccc1F ZINC000021804768 171327094 /nfs/dbraw/zinc/32/70/94/171327094.db2.gz MIEFXJCCPCIFKB-NWDGAFQWSA-N 1 1 277.770 4.891 20 0 CJADMO C[C@H]([NH2+][C@@H](C)c1ccccc1Cl)c1ccccc1F ZINC000021804771 171327180 /nfs/dbraw/zinc/32/71/80/171327180.db2.gz MIEFXJCCPCIFKB-RYUDHWBXSA-N 1 1 277.770 4.891 20 0 CJADMO C[C@@H]([NH2+][C@H](C)c1ccccc1Cl)c1ccccc1F ZINC000021804774 171327067 /nfs/dbraw/zinc/32/70/67/171327067.db2.gz MIEFXJCCPCIFKB-VXGBXAGGSA-N 1 1 277.770 4.891 20 0 CJADMO C[C@@H]([NH2+][C@@H](C)c1ccccc1F)c1ccccc1Cl ZINC000021804776 171327069 /nfs/dbraw/zinc/32/70/69/171327069.db2.gz MIEFXJCCPCIFKB-NEPJUHHUSA-N 1 1 277.770 4.891 20 0 CJADMO Cc1ccc([C@@H]([NH2+]Cc2ccco2)c2ccccc2)c(C)c1 ZINC000022143754 171355907 /nfs/dbraw/zinc/35/59/07/171355907.db2.gz MGJHMJHQUKDFNT-FQEVSTJZSA-N 1 1 291.394 4.776 20 0 CJADMO Cc1ccc([C@H]([NH2+]Cc2ccco2)c2ccccc2)c(C)c1 ZINC000022143756 171356015 /nfs/dbraw/zinc/35/60/15/171356015.db2.gz MGJHMJHQUKDFNT-HXUWFJFHSA-N 1 1 291.394 4.776 20 0 CJADMO Cc1ccc(C)c([C@@H]([NH2+]Cc2ccco2)c2ccccc2)c1 ZINC000022147583 171357081 /nfs/dbraw/zinc/35/70/81/171357081.db2.gz QGUNYECBLHFCHM-FQEVSTJZSA-N 1 1 291.394 4.776 20 0 CJADMO Cc1ccc(C)c([C@H]([NH2+]Cc2ccco2)c2ccccc2)c1 ZINC000022147588 171357141 /nfs/dbraw/zinc/35/71/41/171357141.db2.gz QGUNYECBLHFCHM-HXUWFJFHSA-N 1 1 291.394 4.776 20 0 CJADMO C[C@H]([NH2+]Cc1ccc([C@H]2C[C@@H]2C)o1)c1ccc(F)c(F)c1 ZINC000035043176 260005187 /nfs/dbraw/zinc/00/51/87/260005187.db2.gz NXQWPDCTNBCMSS-MJVIPROJSA-N 1 1 291.341 4.532 20 0 CJADMO C[C@H]([NH2+]Cc1ccc([C@@H]2C[C@@H]2C)o1)c1ccc(F)c(F)c1 ZINC000035043182 260005137 /nfs/dbraw/zinc/00/51/37/260005137.db2.gz NXQWPDCTNBCMSS-COPLHBTASA-N 1 1 291.341 4.532 20 0 CJADMO COc1ccc(C)cc1C[NH2+][C@@H](C)c1ccccc1Cl ZINC000035162019 172022224 /nfs/dbraw/zinc/02/22/24/172022224.db2.gz ZJKVGQIMUSYHDL-ZDUSSCGKSA-N 1 1 289.806 4.508 20 0 CJADMO COc1ccc(C)cc1C[NH2+][C@H](C)c1ccccc1Cl ZINC000035162020 172022546 /nfs/dbraw/zinc/02/25/46/172022546.db2.gz ZJKVGQIMUSYHDL-CYBMUJFWSA-N 1 1 289.806 4.508 20 0 CJADMO CSc1ccc([C@H](C)[NH2+]Cc2c(F)cccc2F)cc1 ZINC000035256483 330244723 /nfs/dbraw/zinc/24/47/23/330244723.db2.gz OPXCPJPYRZYVNM-NSHDSACASA-N 1 1 293.382 4.538 20 0 CJADMO CSc1ccc([C@@H](C)[NH2+]Cc2c(F)cccc2F)cc1 ZINC000035256484 330244827 /nfs/dbraw/zinc/24/48/27/330244827.db2.gz OPXCPJPYRZYVNM-LLVKDONJSA-N 1 1 293.382 4.538 20 0 CJADMO CC[C@H]([NH2+]Cc1ccco1)c1ccc(Cl)cc1Cl ZINC000035624737 172304784 /nfs/dbraw/zinc/30/47/84/172304784.db2.gz FPFBTIVCDLGCEX-AWEZNQCLSA-N 1 1 284.186 4.827 20 0 CJADMO CC[C@@H]([NH2+]Cc1ccco1)c1ccc(Cl)cc1Cl ZINC000035624739 172304872 /nfs/dbraw/zinc/30/48/72/172304872.db2.gz FPFBTIVCDLGCEX-CQSZACIVSA-N 1 1 284.186 4.827 20 0 CJADMO CC[C@H]([NH2+]Cc1ccccn1)c1ccc(Cl)cc1Cl ZINC000035625086 172304926 /nfs/dbraw/zinc/30/49/26/172304926.db2.gz WWWNNBGDSIRRCR-HNNXBMFYSA-N 1 1 295.213 4.629 20 0 CJADMO CC[C@@H]([NH2+]Cc1ccccn1)c1ccc(Cl)cc1Cl ZINC000035625088 172304818 /nfs/dbraw/zinc/30/48/18/172304818.db2.gz WWWNNBGDSIRRCR-OAHLLOKOSA-N 1 1 295.213 4.629 20 0 CJADMO C[C@H]([NH2+][C@@H](C)c1cc(Cl)ccc1Cl)c1ccco1 ZINC000035738960 330250107 /nfs/dbraw/zinc/25/01/07/330250107.db2.gz YYLNZVHKYGRUPI-UWVGGRQHSA-N 1 1 284.186 4.998 20 0 CJADMO C[C@@H]([NH2+][C@@H](C)c1cc(Cl)ccc1Cl)c1ccco1 ZINC000035738961 330250113 /nfs/dbraw/zinc/25/01/13/330250113.db2.gz YYLNZVHKYGRUPI-VHSXEESVSA-N 1 1 284.186 4.998 20 0 CJADMO C[C@@H]([NH2+][C@@H](C)c1ccco1)c1cc(Cl)ccc1Cl ZINC000035738962 330250092 /nfs/dbraw/zinc/25/00/92/330250092.db2.gz YYLNZVHKYGRUPI-ZJUUUORDSA-N 1 1 284.186 4.998 20 0 CJADMO C[C@@H]([NH2+][C@H](C)c1cc(Cl)ccc1Cl)c1ccco1 ZINC000035738963 330250064 /nfs/dbraw/zinc/25/00/64/330250064.db2.gz YYLNZVHKYGRUPI-NXEZZACHSA-N 1 1 284.186 4.998 20 0 CJADMO Cc1nc([C@@H](C)[NH2+][C@@H](C)c2ccc(Cl)cc2)cs1 ZINC000036914661 527032223 /nfs/dbraw/zinc/03/22/23/527032223.db2.gz ZIRYLSDGQPWOQC-VHSXEESVSA-N 1 1 280.824 4.517 20 0 CJADMO Cc1nc([C@H](C)[NH2+][C@@H](C)c2ccc(Cl)cc2)cs1 ZINC000036914662 527066099 /nfs/dbraw/zinc/06/60/99/527066099.db2.gz ZIRYLSDGQPWOQC-UWVGGRQHSA-N 1 1 280.824 4.517 20 0 CJADMO Cc1nc([C@@H](C)[NH2+][C@H](C)c2ccc(Cl)cc2)cs1 ZINC000036914663 527033676 /nfs/dbraw/zinc/03/36/76/527033676.db2.gz ZIRYLSDGQPWOQC-NXEZZACHSA-N 1 1 280.824 4.517 20 0 CJADMO Cc1nc([C@H](C)[NH2+][C@H](C)c2ccc(Cl)cc2)cs1 ZINC000036914664 527066161 /nfs/dbraw/zinc/06/61/61/527066161.db2.gz ZIRYLSDGQPWOQC-ZJUUUORDSA-N 1 1 280.824 4.517 20 0 CJADMO Cc1nc([C@@H](C)[NH2+][C@H](C)c2cccc(Cl)c2)cs1 ZINC000036915255 527034780 /nfs/dbraw/zinc/03/47/80/527034780.db2.gz RHXITTHPBFAZOU-NXEZZACHSA-N 1 1 280.824 4.517 20 0 CJADMO Cc1nc([C@H](C)[NH2+][C@H](C)c2cccc(Cl)c2)cs1 ZINC000036915256 527066917 /nfs/dbraw/zinc/06/69/17/527066917.db2.gz RHXITTHPBFAZOU-ZJUUUORDSA-N 1 1 280.824 4.517 20 0 CJADMO CC[C@@H]([NH2+][C@H](C)c1csc(C)n1)c1cccc(Cl)c1 ZINC000036921556 172804887 /nfs/dbraw/zinc/80/48/87/172804887.db2.gz POPWZCKAZAOXDN-QMTHXVAHSA-N 1 1 294.851 4.907 20 0 CJADMO C[C@H]([NH2+][C@@H](C)c1cc(F)ccc1F)c1ccc(F)cc1F ZINC000036921878 330313858 /nfs/dbraw/zinc/31/38/58/330313858.db2.gz JRMYOXNIYAJJPT-UWVGGRQHSA-N 1 1 297.295 4.655 20 0 CJADMO C[C@@H]([NH2+][C@@H](C)c1cc(F)ccc1F)c1ccc(F)cc1F ZINC000036921879 330313776 /nfs/dbraw/zinc/31/37/76/330313776.db2.gz JRMYOXNIYAJJPT-ZJUUUORDSA-N 1 1 297.295 4.655 20 0 CJADMO C[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1F)c1cc(F)ccc1F ZINC000036921880 330313889 /nfs/dbraw/zinc/31/38/89/330313889.db2.gz JRMYOXNIYAJJPT-VHSXEESVSA-N 1 1 297.295 4.655 20 0 CJADMO C[C@@H]([NH2+][C@H](C)c1cc(F)ccc1F)c1ccc(F)cc1F ZINC000036921881 330313827 /nfs/dbraw/zinc/31/38/27/330313827.db2.gz JRMYOXNIYAJJPT-NXEZZACHSA-N 1 1 297.295 4.655 20 0 CJADMO Cc1cc([C@@H](C)[NH2+][C@@H](C)c2cc(F)ccc2F)c(C)o1 ZINC000036922043 330314049 /nfs/dbraw/zinc/31/40/49/330314049.db2.gz CDRCAIQQPDBCLB-MNOVXSKESA-N 1 1 279.330 4.586 20 0 CJADMO Cc1cc([C@H](C)[NH2+][C@@H](C)c2cc(F)ccc2F)c(C)o1 ZINC000036922044 330314028 /nfs/dbraw/zinc/31/40/28/330314028.db2.gz CDRCAIQQPDBCLB-QWRGUYRKSA-N 1 1 279.330 4.586 20 0 CJADMO Cc1cc([C@@H](C)[NH2+][C@H](C)c2cc(F)ccc2F)c(C)o1 ZINC000036922045 330314047 /nfs/dbraw/zinc/31/40/47/330314047.db2.gz CDRCAIQQPDBCLB-GHMZBOCLSA-N 1 1 279.330 4.586 20 0 CJADMO Cc1cc([C@H](C)[NH2+][C@H](C)c2cc(F)ccc2F)c(C)o1 ZINC000036922046 330314025 /nfs/dbraw/zinc/31/40/25/330314025.db2.gz CDRCAIQQPDBCLB-WDEREUQCSA-N 1 1 279.330 4.586 20 0 CJADMO C[C@H]([NH2+][C@@H](C)c1ccc(F)cc1F)c1ccc(F)c(F)c1 ZINC000036952755 330322526 /nfs/dbraw/zinc/32/25/26/330322526.db2.gz PAMLTOGVDGYCCI-UWVGGRQHSA-N 1 1 297.295 4.655 20 0 CJADMO C[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1F)c1ccc(F)c(F)c1 ZINC000036952756 330322431 /nfs/dbraw/zinc/32/24/31/330322431.db2.gz PAMLTOGVDGYCCI-ZJUUUORDSA-N 1 1 297.295 4.655 20 0 CJADMO C[C@@H]([NH2+][C@@H](C)c1ccc(F)c(F)c1)c1ccc(F)cc1F ZINC000036952757 330322348 /nfs/dbraw/zinc/32/23/48/330322348.db2.gz PAMLTOGVDGYCCI-VHSXEESVSA-N 1 1 297.295 4.655 20 0 CJADMO C[C@@H]([NH2+][C@H](C)c1ccc(F)cc1F)c1ccc(F)c(F)c1 ZINC000036952758 330322378 /nfs/dbraw/zinc/32/23/78/330322378.db2.gz PAMLTOGVDGYCCI-NXEZZACHSA-N 1 1 297.295 4.655 20 0 CJADMO Cc1cc([C@@H](C)[NH2+][C@@H](C)c2ccc(F)cc2F)c(C)o1 ZINC000036952898 330322380 /nfs/dbraw/zinc/32/23/80/330322380.db2.gz CBYRPQHQXXRRQH-WDEREUQCSA-N 1 1 279.330 4.586 20 0 CJADMO Cc1cc([C@H](C)[NH2+][C@@H](C)c2ccc(F)cc2F)c(C)o1 ZINC000036952899 330322444 /nfs/dbraw/zinc/32/24/44/330322444.db2.gz CBYRPQHQXXRRQH-QWRGUYRKSA-N 1 1 279.330 4.586 20 0 CJADMO Cc1cc([C@@H](C)[NH2+][C@H](C)c2ccc(F)cc2F)c(C)o1 ZINC000036952900 330322413 /nfs/dbraw/zinc/32/24/13/330322413.db2.gz CBYRPQHQXXRRQH-GHMZBOCLSA-N 1 1 279.330 4.586 20 0 CJADMO Cc1cc([C@H](C)[NH2+][C@H](C)c2ccc(F)cc2F)c(C)o1 ZINC000036952901 330322448 /nfs/dbraw/zinc/32/24/48/330322448.db2.gz CBYRPQHQXXRRQH-MNOVXSKESA-N 1 1 279.330 4.586 20 0 CJADMO Cc1ccc(CNc2ccc([NH+]3CCCC3)cc2C)s1 ZINC000036955668 327369138 /nfs/dbraw/zinc/36/91/38/327369138.db2.gz BMAFYLHRAFQSQT-UHFFFAOYSA-N 1 1 286.444 4.577 20 0 CJADMO Cc1ccsc1CNc1ccc([NH+]2CCCC2)cc1C ZINC000036955698 327376180 /nfs/dbraw/zinc/37/61/80/327376180.db2.gz GRZLJHPIBHSSTI-UHFFFAOYSA-N 1 1 286.444 4.577 20 0 CJADMO Cc1ccc([C@@H](C)Nc2ccc([NH+]3CCCC3)cc2C)o1 ZINC000036955744 327481261 /nfs/dbraw/zinc/48/12/61/327481261.db2.gz JGIHBTBLTIIIAN-OAHLLOKOSA-N 1 1 284.403 4.670 20 0 CJADMO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccccc2OC(F)F)o1 ZINC000036960441 525741249 /nfs/dbraw/zinc/74/12/49/525741249.db2.gz PVXZRYGXRFXBES-NWDGAFQWSA-N 1 1 295.329 4.601 20 0 CJADMO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2ccccc2OC(F)F)o1 ZINC000036960443 525934096 /nfs/dbraw/zinc/93/40/96/525934096.db2.gz PVXZRYGXRFXBES-RYUDHWBXSA-N 1 1 295.329 4.601 20 0 CJADMO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2ccccc2OC(F)F)o1 ZINC000036960445 525746535 /nfs/dbraw/zinc/74/65/35/525746535.db2.gz PVXZRYGXRFXBES-VXGBXAGGSA-N 1 1 295.329 4.601 20 0 CJADMO Cc1ccc([C@H](C)[NH2+][C@H](C)c2ccccc2OC(F)F)o1 ZINC000036960447 525942957 /nfs/dbraw/zinc/94/29/57/525942957.db2.gz PVXZRYGXRFXBES-NEPJUHHUSA-N 1 1 295.329 4.601 20 0 CJADMO Cc1nc([C@H](C)[NH2+][C@H](c2ccc(F)cc2)C(C)C)cs1 ZINC000036968297 333445076 /nfs/dbraw/zinc/44/50/76/333445076.db2.gz ZGJRVODTMIJPHG-ZBEGNZNMSA-N 1 1 292.423 4.639 20 0 CJADMO CC[C@H]([NH2+][C@@H](C)c1csc(C)n1)c1ccc(Cl)cc1 ZINC000036979395 260060349 /nfs/dbraw/zinc/06/03/49/260060349.db2.gz UUZIZHGMCPSTET-HZMBPMFUSA-N 1 1 294.851 4.907 20 0 CJADMO CC[C@@H]([NH2+][C@@H](C)c1csc(C)n1)c1ccc(Cl)cc1 ZINC000036979397 260060712 /nfs/dbraw/zinc/06/07/12/260060712.db2.gz UUZIZHGMCPSTET-IINYFYTJSA-N 1 1 294.851 4.907 20 0 CJADMO CC[C@H]([NH2+][C@H](C)c1csc(C)n1)c1ccc(Cl)cc1 ZINC000036979399 260060354 /nfs/dbraw/zinc/06/03/54/260060354.db2.gz UUZIZHGMCPSTET-YGRLFVJLSA-N 1 1 294.851 4.907 20 0 CJADMO CC[C@@H]([NH2+][C@H](C)c1csc(C)n1)c1ccc(Cl)cc1 ZINC000036979401 260060389 /nfs/dbraw/zinc/06/03/89/260060389.db2.gz UUZIZHGMCPSTET-QMTHXVAHSA-N 1 1 294.851 4.907 20 0 CJADMO C[C@H]([NH2+]Cc1cc(F)ccc1F)c1ccc(Cl)s1 ZINC000036992053 333452360 /nfs/dbraw/zinc/45/23/60/333452360.db2.gz SEZWAQMXCRIXMK-QMMMGPOBSA-N 1 1 287.762 4.531 20 0 CJADMO C[C@@H]([NH2+]Cc1cc(F)ccc1F)c1ccc(Cl)s1 ZINC000036992054 333452362 /nfs/dbraw/zinc/45/23/62/333452362.db2.gz SEZWAQMXCRIXMK-MRVPVSSYSA-N 1 1 287.762 4.531 20 0 CJADMO CSc1ccc([C@H](C)[NH2+][C@H](C)c2csc(C)n2)cc1 ZINC000036994472 260061124 /nfs/dbraw/zinc/06/11/24/260061124.db2.gz YUXNLEYFYGJSLF-WDEREUQCSA-N 1 1 292.473 4.585 20 0 CJADMO CSc1ccc([C@H](C)[NH2+][C@@H](C)c2csc(C)n2)cc1 ZINC000036994473 260061177 /nfs/dbraw/zinc/06/11/77/260061177.db2.gz YUXNLEYFYGJSLF-QWRGUYRKSA-N 1 1 292.473 4.585 20 0 CJADMO CSc1ccc([C@@H](C)[NH2+][C@H](C)c2csc(C)n2)cc1 ZINC000036994474 260061190 /nfs/dbraw/zinc/06/11/90/260061190.db2.gz YUXNLEYFYGJSLF-GHMZBOCLSA-N 1 1 292.473 4.585 20 0 CJADMO CSc1ccc([C@@H](C)[NH2+][C@@H](C)c2csc(C)n2)cc1 ZINC000036994475 260061130 /nfs/dbraw/zinc/06/11/30/260061130.db2.gz YUXNLEYFYGJSLF-MNOVXSKESA-N 1 1 292.473 4.585 20 0 CJADMO CCC[C@H]([NH2+][C@@H](C)c1csc(C)n1)c1ccccc1 ZINC000037062551 521169585 /nfs/dbraw/zinc/16/95/85/521169585.db2.gz RZIYZYVLUIWMGC-WFASDCNBSA-N 1 1 274.433 4.644 20 0 CJADMO CCC[C@@H]([NH2+][C@@H](C)c1csc(C)n1)c1ccccc1 ZINC000037062552 520788312 /nfs/dbraw/zinc/78/83/12/520788312.db2.gz RZIYZYVLUIWMGC-SWLSCSKDSA-N 1 1 274.433 4.644 20 0 CJADMO CCC[C@H]([NH2+][C@H](C)c1csc(C)n1)c1ccccc1 ZINC000037062553 521175761 /nfs/dbraw/zinc/17/57/61/521175761.db2.gz RZIYZYVLUIWMGC-DOMZBBRYSA-N 1 1 274.433 4.644 20 0 CJADMO CCC[C@@H]([NH2+][C@H](C)c1csc(C)n1)c1ccccc1 ZINC000037062554 520792804 /nfs/dbraw/zinc/79/28/04/520792804.db2.gz RZIYZYVLUIWMGC-IUODEOHRSA-N 1 1 274.433 4.644 20 0 CJADMO Cc1cc([C@@H](C)[NH2+][C@@H](C)c2csc(C)n2)c(C)s1 ZINC000037123109 525471314 /nfs/dbraw/zinc/47/13/14/525471314.db2.gz YDLFVGDMHACQMM-ZJUUUORDSA-N 1 1 280.462 4.542 20 0 CJADMO Cc1cc([C@H](C)[NH2+][C@@H](C)c2csc(C)n2)c(C)s1 ZINC000037123110 525526908 /nfs/dbraw/zinc/52/69/08/525526908.db2.gz YDLFVGDMHACQMM-UWVGGRQHSA-N 1 1 280.462 4.542 20 0 CJADMO Cc1cc([C@@H](C)[NH2+][C@H](C)c2csc(C)n2)c(C)s1 ZINC000037123111 525474632 /nfs/dbraw/zinc/47/46/32/525474632.db2.gz YDLFVGDMHACQMM-NXEZZACHSA-N 1 1 280.462 4.542 20 0 CJADMO Cc1cc([C@H](C)[NH2+][C@H](C)c2csc(C)n2)c(C)s1 ZINC000037123112 525529559 /nfs/dbraw/zinc/52/95/59/525529559.db2.gz YDLFVGDMHACQMM-VHSXEESVSA-N 1 1 280.462 4.542 20 0 CJADMO C[C@@H]([NH2+]Cc1ccc(Cl)cc1Cl)c1cccc(O)c1 ZINC000037151013 333501483 /nfs/dbraw/zinc/50/14/83/333501483.db2.gz WVSMQZHOASQPRF-SNVBAGLBSA-N 1 1 296.197 4.550 20 0 CJADMO C[C@H]([NH2+]Cc1c(Cl)cccc1Cl)c1cccc(O)c1 ZINC000037151184 172986731 /nfs/dbraw/zinc/98/67/31/172986731.db2.gz UVGBHLMUYIVNRM-JTQLQIEISA-N 1 1 296.197 4.550 20 0 CJADMO Fc1ccccc1C[NH2+][C@H](CC(F)(F)F)c1ccccc1 ZINC000037212043 260074488 /nfs/dbraw/zinc/07/44/88/260074488.db2.gz PRJXUNFEFHYRFH-OAHLLOKOSA-N 1 1 297.295 4.609 20 0 CJADMO Fc1ccccc1C[NH2+][C@@H](CC(F)(F)F)c1ccccc1 ZINC000037212044 260074821 /nfs/dbraw/zinc/07/48/21/260074821.db2.gz PRJXUNFEFHYRFH-HNNXBMFYSA-N 1 1 297.295 4.609 20 0 CJADMO C[C@H]([NH2+][C@@H]1CCCc2occc21)c1ccc(F)cc1Cl ZINC000037242013 260077450 /nfs/dbraw/zinc/07/74/50/260077450.db2.gz PPRXQXZDENKFKV-ZUZCIYMTSA-N 1 1 293.769 4.800 20 0 CJADMO C[C@@H]([NH2+][C@@H]1CCCc2occc21)c1ccc(F)cc1Cl ZINC000037242015 260077527 /nfs/dbraw/zinc/07/75/27/260077527.db2.gz PPRXQXZDENKFKV-MEBBXXQBSA-N 1 1 293.769 4.800 20 0 CJADMO C[C@H]([NH2+][C@H]1CCCc2occc21)c1ccc(F)cc1Cl ZINC000037242018 260077466 /nfs/dbraw/zinc/07/74/66/260077466.db2.gz PPRXQXZDENKFKV-BONVTDFDSA-N 1 1 293.769 4.800 20 0 CJADMO C[C@@H]([NH2+][C@H]1CCCc2occc21)c1ccc(F)cc1Cl ZINC000037242020 260077429 /nfs/dbraw/zinc/07/74/29/260077429.db2.gz PPRXQXZDENKFKV-BMIGLBTASA-N 1 1 293.769 4.800 20 0 CJADMO Cc1c2ccccc2oc1[C@@H](C)[NH2+][C@@H](C)c1ccco1 ZINC000037260188 333525867 /nfs/dbraw/zinc/52/58/67/333525867.db2.gz IGKBFHAGOHKCNN-QWHCGFSZSA-N 1 1 269.344 4.746 20 0 CJADMO Cc1c2ccccc2oc1[C@H](C)[NH2+][C@@H](C)c1ccco1 ZINC000037260190 333525953 /nfs/dbraw/zinc/52/59/53/333525953.db2.gz IGKBFHAGOHKCNN-STQMWFEESA-N 1 1 269.344 4.746 20 0 CJADMO Cc1c2ccccc2oc1[C@H](C)[NH2+][C@H](C)c1ccco1 ZINC000037260195 333525939 /nfs/dbraw/zinc/52/59/39/333525939.db2.gz IGKBFHAGOHKCNN-OLZOCXBDSA-N 1 1 269.344 4.746 20 0 CJADMO C[C@H]([NH2+]C(c1cccs1)c1cccs1)c1ccco1 ZINC000037260430 173071001 /nfs/dbraw/zinc/07/10/01/173071001.db2.gz BMBYCNQAOIQDOS-NSHDSACASA-N 1 1 289.425 4.843 20 0 CJADMO C[C@@H]([NH2+]C(c1cccs1)c1cccs1)c1ccco1 ZINC000037260432 260078679 /nfs/dbraw/zinc/07/86/79/260078679.db2.gz BMBYCNQAOIQDOS-LLVKDONJSA-N 1 1 289.425 4.843 20 0 CJADMO C[C@H]([NH2+][C@@H](CC(F)(F)F)c1ccccc1)c1ccco1 ZINC000037260608 260078690 /nfs/dbraw/zinc/07/86/90/260078690.db2.gz VEHUMWFDJIVCFV-AAEUAGOBSA-N 1 1 283.293 4.624 20 0 CJADMO C[C@@H]([NH2+][C@@H](CC(F)(F)F)c1ccccc1)c1ccco1 ZINC000037260610 260078683 /nfs/dbraw/zinc/07/86/83/260078683.db2.gz VEHUMWFDJIVCFV-YPMHNXCESA-N 1 1 283.293 4.624 20 0 CJADMO C[C@H]([NH2+][C@H](CC(F)(F)F)c1ccccc1)c1ccco1 ZINC000037260612 260078887 /nfs/dbraw/zinc/07/88/87/260078887.db2.gz VEHUMWFDJIVCFV-WCQYABFASA-N 1 1 283.293 4.624 20 0 CJADMO C[C@@H]([NH2+][C@H](CC(F)(F)F)c1ccccc1)c1ccco1 ZINC000037260614 260078878 /nfs/dbraw/zinc/07/88/78/260078878.db2.gz VEHUMWFDJIVCFV-DGCLKSJQSA-N 1 1 283.293 4.624 20 0 CJADMO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2ccc(F)cc2Cl)o1 ZINC000037280702 333530432 /nfs/dbraw/zinc/53/04/32/333530432.db2.gz XAKBMUDOAIMDDW-QWRGUYRKSA-N 1 1 281.758 4.792 20 0 CJADMO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2ccc(F)cc2Cl)o1 ZINC000037280704 333530435 /nfs/dbraw/zinc/53/04/35/333530435.db2.gz XAKBMUDOAIMDDW-GHMZBOCLSA-N 1 1 281.758 4.792 20 0 CJADMO Cc1ccc([C@@H](C)[NH2+][C@@H](CC(F)(F)F)c2ccccc2)o1 ZINC000037280875 260079282 /nfs/dbraw/zinc/07/92/82/260079282.db2.gz CSUFQTPTYPLKGV-OCCSQVGLSA-N 1 1 297.320 4.932 20 0 CJADMO Cc1ccc([C@H](C)[NH2+][C@@H](CC(F)(F)F)c2ccccc2)o1 ZINC000037280877 260079421 /nfs/dbraw/zinc/07/94/21/260079421.db2.gz CSUFQTPTYPLKGV-JSGCOSHPSA-N 1 1 297.320 4.932 20 0 CJADMO Cc1ccc([C@@H](C)[NH2+][C@H](CC(F)(F)F)c2ccccc2)o1 ZINC000037280879 260079641 /nfs/dbraw/zinc/07/96/41/260079641.db2.gz CSUFQTPTYPLKGV-TZMCWYRMSA-N 1 1 297.320 4.932 20 0 CJADMO Cc1ccc([C@H](C)[NH2+][C@H](CC(F)(F)F)c2ccccc2)o1 ZINC000037280880 260079357 /nfs/dbraw/zinc/07/93/57/260079357.db2.gz CSUFQTPTYPLKGV-GXTWGEPZSA-N 1 1 297.320 4.932 20 0 CJADMO C[C@H]([NH2+][C@@H](C)c1ccc(F)cc1Cl)c1cccc(O)c1 ZINC000037319260 260087553 /nfs/dbraw/zinc/08/75/53/260087553.db2.gz XAPUDVLEPQNWKU-QWRGUYRKSA-N 1 1 293.769 4.597 20 0 CJADMO C[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1Cl)c1cccc(O)c1 ZINC000037319261 260087581 /nfs/dbraw/zinc/08/75/81/260087581.db2.gz XAPUDVLEPQNWKU-MNOVXSKESA-N 1 1 293.769 4.597 20 0 CJADMO C[C@@H]([NH2+][C@@H](C)c1cccc(O)c1)c1ccc(F)cc1Cl ZINC000037319262 260087305 /nfs/dbraw/zinc/08/73/05/260087305.db2.gz XAPUDVLEPQNWKU-WDEREUQCSA-N 1 1 293.769 4.597 20 0 CJADMO C[C@@H]([NH2+][C@H](C)c1ccc(F)cc1Cl)c1cccc(O)c1 ZINC000037319263 260087210 /nfs/dbraw/zinc/08/72/10/260087210.db2.gz XAPUDVLEPQNWKU-GHMZBOCLSA-N 1 1 293.769 4.597 20 0 CJADMO C[C@H]([NH2+]Cc1ccc(Cl)o1)c1cc2ccccc2o1 ZINC000037487247 333533753 /nfs/dbraw/zinc/53/37/53/333533753.db2.gz MVSKQTYGCZOISH-JTQLQIEISA-N 1 1 275.735 4.530 20 0 CJADMO C[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1F)c1ccccc1F ZINC000037508048 333534262 /nfs/dbraw/zinc/53/42/62/333534262.db2.gz OTNDBDAELLNZPM-MNOVXSKESA-N 1 1 279.305 4.516 20 0 CJADMO C[C@H]([NH2+][C@@H](C)c1c(F)cccc1F)c1ccc(F)c(F)c1 ZINC000037508064 333534439 /nfs/dbraw/zinc/53/44/39/333534439.db2.gz JBKYHGWWRKWLAA-UWVGGRQHSA-N 1 1 297.295 4.655 20 0 CJADMO C[C@@H]([NH2+][C@@H](C)c1c(F)cccc1F)c1ccc(F)c(F)c1 ZINC000037508065 333534250 /nfs/dbraw/zinc/53/42/50/333534250.db2.gz JBKYHGWWRKWLAA-ZJUUUORDSA-N 1 1 297.295 4.655 20 0 CJADMO C[C@@H]([NH2+][C@H](C)c1c(F)cccc1F)c1ccc(F)c(F)c1 ZINC000037508067 326854551 /nfs/dbraw/zinc/85/45/51/326854551.db2.gz JBKYHGWWRKWLAA-NXEZZACHSA-N 1 1 297.295 4.655 20 0 CJADMO Cc1cc2c(o1)CC(C)(C)C[C@@H]2[NH2+]Cc1ccc(Cl)o1 ZINC000037509354 260113744 /nfs/dbraw/zinc/11/37/44/260113744.db2.gz WUFZZBDWELUOBG-ZDUSSCGKSA-N 1 1 293.794 4.638 20 0 CJADMO Cc1cc2c(o1)CC(C)(C)C[C@H]2[NH2+]Cc1ccc(Cl)o1 ZINC000037509355 260113592 /nfs/dbraw/zinc/11/35/92/260113592.db2.gz WUFZZBDWELUOBG-CYBMUJFWSA-N 1 1 293.794 4.638 20 0 CJADMO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2c(F)cccc2F)cc1 ZINC000037770143 333538145 /nfs/dbraw/zinc/53/81/45/333538145.db2.gz PCXROQGZGCMTHH-STQMWFEESA-N 1 1 275.342 4.685 20 0 CJADMO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2c(F)cccc2F)cc1 ZINC000037770144 326861058 /nfs/dbraw/zinc/86/10/58/326861058.db2.gz PCXROQGZGCMTHH-CHWSQXEVSA-N 1 1 275.342 4.685 20 0 CJADMO Cc1ccc([C@H](C)[NH2+][C@H](C)c2c(F)cccc2F)cc1 ZINC000037770145 326861275 /nfs/dbraw/zinc/86/12/75/326861275.db2.gz PCXROQGZGCMTHH-QWHCGFSZSA-N 1 1 275.342 4.685 20 0 CJADMO CC[C@@H]([NH2+][C@H](C)c1c(F)cccc1F)c1ccc(F)cc1 ZINC000037771672 333538398 /nfs/dbraw/zinc/53/83/98/333538398.db2.gz TWMXDGMEIFQNNI-BDJLRTHQSA-N 1 1 293.332 4.906 20 0 CJADMO CC(C)c1ccc(C[NH2+][C@@H](C)c2c(F)cccc2F)cc1 ZINC000037771749 333538769 /nfs/dbraw/zinc/53/87/69/333538769.db2.gz BWZZIKVSTCUVJE-ZDUSSCGKSA-N 1 1 289.369 4.939 20 0 CJADMO CC(C)c1ccc(C[NH2+][C@H](C)c2c(F)cccc2F)cc1 ZINC000037771750 333538730 /nfs/dbraw/zinc/53/87/30/333538730.db2.gz BWZZIKVSTCUVJE-CYBMUJFWSA-N 1 1 289.369 4.939 20 0 CJADMO Cc1cc(C)c(C[NH2+][C@@H](C)c2c(F)cccc2F)cc1C ZINC000037771828 333538736 /nfs/dbraw/zinc/53/87/36/333538736.db2.gz KROOALUJRRFHBW-AWEZNQCLSA-N 1 1 289.369 4.741 20 0 CJADMO CSc1ccc(C[NH2+][C@@H](C)c2c(F)cccc2F)cc1 ZINC000037771920 333538760 /nfs/dbraw/zinc/53/87/60/333538760.db2.gz XQYNFEZTIQBHHA-NSHDSACASA-N 1 1 293.382 4.538 20 0 CJADMO Cc1cc([C@@H](C)[NH2+][C@@H](C)c2c(F)cccc2F)c(C)o1 ZINC000037771940 326861066 /nfs/dbraw/zinc/86/10/66/326861066.db2.gz OVFPHFJASYABHI-MNOVXSKESA-N 1 1 279.330 4.586 20 0 CJADMO Cc1cc([C@H](C)[NH2+][C@@H](C)c2c(F)cccc2F)c(C)o1 ZINC000037771941 333538698 /nfs/dbraw/zinc/53/86/98/333538698.db2.gz OVFPHFJASYABHI-QWRGUYRKSA-N 1 1 279.330 4.586 20 0 CJADMO Cc1cc([C@@H](C)[NH2+][C@H](C)c2c(F)cccc2F)c(C)o1 ZINC000037771942 333538701 /nfs/dbraw/zinc/53/87/01/333538701.db2.gz OVFPHFJASYABHI-GHMZBOCLSA-N 1 1 279.330 4.586 20 0 CJADMO Cc1cc([C@H](C)[NH2+][C@H](C)c2c(F)cccc2F)c(C)o1 ZINC000037771943 333538763 /nfs/dbraw/zinc/53/87/63/333538763.db2.gz OVFPHFJASYABHI-WDEREUQCSA-N 1 1 279.330 4.586 20 0 CJADMO Cc1csc(C[NH2+][C@@H](C)c2ccc(C(C)(C)C)cc2)n1 ZINC000038090655 526358706 /nfs/dbraw/zinc/35/87/06/526358706.db2.gz GNPBOYMXNKJTKG-ZDUSSCGKSA-N 1 1 288.460 4.600 20 0 CJADMO Cc1csc(C[NH2+][C@H](C)c2ccc(C(C)(C)C)cc2)n1 ZINC000038090656 526359919 /nfs/dbraw/zinc/35/99/19/526359919.db2.gz GNPBOYMXNKJTKG-CYBMUJFWSA-N 1 1 288.460 4.600 20 0 CJADMO CCCCC[C@H]([NH2+]Cc1nccs1)c1ccccc1 ZINC000041012737 520312919 /nfs/dbraw/zinc/31/29/19/520312919.db2.gz UXDQPXMOWUKVMV-HNNXBMFYSA-N 1 1 274.433 4.554 20 0 CJADMO Clc1cccc(C[NH2+][C@H](c2ccco2)c2ccccc2)c1 ZINC000041635568 328714239 /nfs/dbraw/zinc/71/42/39/328714239.db2.gz OEKGCGODGRZUIK-SFHVURJKSA-N 1 1 297.785 4.812 20 0 CJADMO Cc1ccsc1C[NH2+][C@@H](c1ccco1)c1ccccc1 ZINC000041635591 328714286 /nfs/dbraw/zinc/71/42/86/328714286.db2.gz DJODEVFEZNSKHR-QGZVFWFLSA-N 1 1 283.396 4.529 20 0 CJADMO C[C@H]([NH2+]Cc1cccc(F)c1F)c1ccc(Cl)s1 ZINC000042269348 328763903 /nfs/dbraw/zinc/76/39/03/328763903.db2.gz KRFIDNPPHLZDKL-QMMMGPOBSA-N 1 1 287.762 4.531 20 0 CJADMO C[C@H]([NH2+]Cc1ccc2ccccc2n1)c1ccccc1Cl ZINC000042300349 328764548 /nfs/dbraw/zinc/76/45/48/328764548.db2.gz TWICNDUVBIFAOO-ZDUSSCGKSA-N 1 1 296.801 4.739 20 0 CJADMO C[C@@H]([NH2+]Cc1ccc(Cl)c(F)c1)c1ccc(F)cc1F ZINC000043389096 328789380 /nfs/dbraw/zinc/78/93/80/328789380.db2.gz KGLBSNAAKLPWBD-SECBINFHSA-N 1 1 299.723 4.608 20 0 CJADMO C[C@H]([NH2+]Cc1ccc(Cl)c(F)c1)c1c(F)cccc1F ZINC000043389819 328789540 /nfs/dbraw/zinc/78/95/40/328789540.db2.gz BXXMNMINURWQDO-VIFPVBQESA-N 1 1 299.723 4.608 20 0 CJADMO Cc1cc[nH+]c(NC(c2ccccc2)c2ccccc2)c1 ZINC000043561442 328804600 /nfs/dbraw/zinc/80/46/00/328804600.db2.gz SMXBBPFBANSXMA-UHFFFAOYSA-N 1 1 274.367 4.592 20 0 CJADMO Cc1cc([C@@H](C)[NH2+]Cc2c(F)cccc2Cl)c(C)o1 ZINC000044729432 330331226 /nfs/dbraw/zinc/33/12/26/330331226.db2.gz MQOCSJQWVSEOPI-SNVBAGLBSA-N 1 1 281.758 4.540 20 0 CJADMO Cc1cc([C@H](C)[NH2+]Cc2c(F)cccc2Cl)c(C)o1 ZINC000044729433 330331174 /nfs/dbraw/zinc/33/11/74/330331174.db2.gz MQOCSJQWVSEOPI-JTQLQIEISA-N 1 1 281.758 4.540 20 0 CJADMO Cc1cc([C@@H](C)[NH2+]Cc2ccc(F)cc2Cl)c(C)o1 ZINC000044730541 330331382 /nfs/dbraw/zinc/33/13/82/330331382.db2.gz VGMLGJKPSXUUBS-SNVBAGLBSA-N 1 1 281.758 4.540 20 0 CJADMO Cc1cc([C@H](C)[NH2+]Cc2ccc(F)cc2Cl)c(C)o1 ZINC000044730542 330331451 /nfs/dbraw/zinc/33/14/51/330331451.db2.gz VGMLGJKPSXUUBS-JTQLQIEISA-N 1 1 281.758 4.540 20 0 CJADMO CC[C@H]([NH2+]Cc1cc(C)no1)c1ccc(Cl)c(Cl)c1 ZINC000044986768 522642548 /nfs/dbraw/zinc/64/25/48/522642548.db2.gz UWWZMPDAVPLYOJ-AWEZNQCLSA-N 1 1 299.201 4.531 20 0 CJADMO CC[C@@H]([NH2+]Cc1cc(C)no1)c1ccc(Cl)c(Cl)c1 ZINC000044986771 522869647 /nfs/dbraw/zinc/86/96/47/522869647.db2.gz UWWZMPDAVPLYOJ-CQSZACIVSA-N 1 1 299.201 4.531 20 0 CJADMO Cc1ccc(C[NH2+]Cc2c(Cl)cccc2Cl)s1 ZINC000048068781 328040745 /nfs/dbraw/zinc/04/07/45/328040745.db2.gz NVIAUBZOINWCGC-UHFFFAOYSA-N 1 1 286.227 4.653 20 0 CJADMO Cc1ccc(CNc2cc[nH+]c3cc(Cl)ccc23)s1 ZINC000048337172 328053322 /nfs/dbraw/zinc/05/33/22/328053322.db2.gz ZEFAKFCILCGZRE-UHFFFAOYSA-N 1 1 288.803 4.870 20 0 CJADMO Cc1ccc([C@@H](C)[NH2+]Cc2c(F)cccc2Cl)s1 ZINC000049158551 525730006 /nfs/dbraw/zinc/73/00/06/525730006.db2.gz RIINRXFLTZYLCJ-SNVBAGLBSA-N 1 1 283.799 4.700 20 0 CJADMO Cc1ccc([C@H](C)[NH2+]Cc2c(F)cccc2Cl)s1 ZINC000049158556 525925675 /nfs/dbraw/zinc/92/56/75/525925675.db2.gz RIINRXFLTZYLCJ-JTQLQIEISA-N 1 1 283.799 4.700 20 0 CJADMO Cc1cc(C[NH2+][C@H](c2ccco2)c2ccccc2)c(C)s1 ZINC000049686204 328378249 /nfs/dbraw/zinc/37/82/49/328378249.db2.gz ZSJJRNLOYZKZEQ-SFHVURJKSA-N 1 1 297.423 4.837 20 0 CJADMO Cc1cc(C[NH2+][C@@H](c2ccco2)c2ccccc2)c(C)s1 ZINC000049686206 328378294 /nfs/dbraw/zinc/37/82/94/328378294.db2.gz ZSJJRNLOYZKZEQ-GOSISDBHSA-N 1 1 297.423 4.837 20 0 CJADMO Cc1ccc(C[NH2+][C@@H](C)c2cc(Cl)ccc2Cl)o1 ZINC000050198688 328391517 /nfs/dbraw/zinc/39/15/17/328391517.db2.gz LRBICVYXBAJMME-JTQLQIEISA-N 1 1 284.186 4.746 20 0 CJADMO Cc1ccc(C[NH2+][C@H](C)c2cc(Cl)ccc2Cl)o1 ZINC000050198690 328391623 /nfs/dbraw/zinc/39/16/23/328391623.db2.gz LRBICVYXBAJMME-SNVBAGLBSA-N 1 1 284.186 4.746 20 0 CJADMO Cc1cc([NH+]2CCCC2)ccc1N[C@@H](C)c1ccsc1 ZINC000050341077 328397292 /nfs/dbraw/zinc/39/72/92/328397292.db2.gz WYSLIQIHRCHJIQ-AWEZNQCLSA-N 1 1 286.444 4.830 20 0 CJADMO Cc1cc([NH+]2CCCC2)ccc1N[C@H](C)c1ccsc1 ZINC000050341080 328397410 /nfs/dbraw/zinc/39/74/10/328397410.db2.gz WYSLIQIHRCHJIQ-CQSZACIVSA-N 1 1 286.444 4.830 20 0 CJADMO Cc1cccc(C[NH2+][C@@H](C)c2cc(Cl)ccc2Cl)n1 ZINC000051573769 328623468 /nfs/dbraw/zinc/62/34/68/328623468.db2.gz JORJFIDKRVFCJY-NSHDSACASA-N 1 1 295.213 4.548 20 0 CJADMO Cc1cccc(C[NH2+][C@@H](C)c2ccc(Cl)cc2Cl)n1 ZINC000051574160 328623203 /nfs/dbraw/zinc/62/32/03/328623203.db2.gz PQXWSVIZYJUGDV-NSHDSACASA-N 1 1 295.213 4.548 20 0 CJADMO CCc1ccc(C[NH2+][C@H](c2ccco2)c2ccccc2)s1 ZINC000051717956 328628464 /nfs/dbraw/zinc/62/84/64/328628464.db2.gz YYTYOCXBFNYCJI-SFHVURJKSA-N 1 1 297.423 4.783 20 0 CJADMO CCc1ccc(C[NH2+][C@@H](c2ccco2)c2ccccc2)s1 ZINC000051717959 328628476 /nfs/dbraw/zinc/62/84/76/328628476.db2.gz YYTYOCXBFNYCJI-GOSISDBHSA-N 1 1 297.423 4.783 20 0 CJADMO Cc1ccc(C[NH2+]C(c2cccs2)c2cccs2)o1 ZINC000053036584 261271923 /nfs/dbraw/zinc/27/19/23/261271923.db2.gz AFJMUIQHFVFSKT-UHFFFAOYSA-N 1 1 289.425 4.590 20 0 CJADMO C[C@@H]([NH2+]Cc1ccc(F)c(Cl)c1)c1ccc(F)cc1F ZINC000053150035 328663634 /nfs/dbraw/zinc/66/36/34/328663634.db2.gz YRQDLZRJDLOVCV-SECBINFHSA-N 1 1 299.723 4.608 20 0 CJADMO C[C@H]([NH2+]Cc1ccc(F)c(Cl)c1)c1cc(F)ccc1F ZINC000053150078 328663683 /nfs/dbraw/zinc/66/36/83/328663683.db2.gz VXONRTVAPPJVQW-VIFPVBQESA-N 1 1 299.723 4.608 20 0 CJADMO C[C@@H]([NH2+]Cc1ccc(F)c(Cl)c1)c1cc(F)ccc1F ZINC000053150082 328663645 /nfs/dbraw/zinc/66/36/45/328663645.db2.gz VXONRTVAPPJVQW-SECBINFHSA-N 1 1 299.723 4.608 20 0 CJADMO CCC[N@@H+](Cc1cc(C)no1)[C@@H](C)c1cc2ccccc2o1 ZINC000053643419 328359804 /nfs/dbraw/zinc/35/98/04/328359804.db2.gz DCTJCGZUJHKICB-AWEZNQCLSA-N 1 1 298.386 4.702 20 0 CJADMO CCC[N@@H+](Cc1cc(C)no1)[C@H](C)c1cc2ccccc2o1 ZINC000053643421 328359751 /nfs/dbraw/zinc/35/97/51/328359751.db2.gz DCTJCGZUJHKICB-CQSZACIVSA-N 1 1 298.386 4.702 20 0 CJADMO CCC[N@@H+](Cc1cc(C)on1)[C@@H](C)c1cc2ccccc2o1 ZINC000053643482 328360159 /nfs/dbraw/zinc/36/01/59/328360159.db2.gz GFUQYYLGPTZJGC-AWEZNQCLSA-N 1 1 298.386 4.702 20 0 CJADMO CCC[N@H+](Cc1cc(C)on1)[C@@H](C)c1cc2ccccc2o1 ZINC000053643482 328360156 /nfs/dbraw/zinc/36/01/56/328360156.db2.gz GFUQYYLGPTZJGC-AWEZNQCLSA-N 1 1 298.386 4.702 20 0 CJADMO CCC[N@@H+](Cc1cc(C)on1)[C@H](C)c1cc2ccccc2o1 ZINC000053643483 328360189 /nfs/dbraw/zinc/36/01/89/328360189.db2.gz GFUQYYLGPTZJGC-CQSZACIVSA-N 1 1 298.386 4.702 20 0 CJADMO CCC[N@H+](Cc1cc(C)on1)[C@H](C)c1cc2ccccc2o1 ZINC000053643483 328360188 /nfs/dbraw/zinc/36/01/88/328360188.db2.gz GFUQYYLGPTZJGC-CQSZACIVSA-N 1 1 298.386 4.702 20 0 CJADMO Clc1ccc([C@@H]([NH2+]Cc2ccco2)c2ccccc2)cc1 ZINC000057567160 330375934 /nfs/dbraw/zinc/37/59/34/330375934.db2.gz WXAVDOKWJCTXAG-SFHVURJKSA-N 1 1 297.785 4.812 20 0 CJADMO Clc1ccc([C@H]([NH2+]Cc2ccco2)c2ccccc2)cc1 ZINC000057567163 330375995 /nfs/dbraw/zinc/37/59/95/330375995.db2.gz WXAVDOKWJCTXAG-GOSISDBHSA-N 1 1 297.785 4.812 20 0 CJADMO Cc1cc(C)cc(C[NH2+][C@H](c2ccco2)c2ccccc2)c1 ZINC000057600509 330376878 /nfs/dbraw/zinc/37/68/78/330376878.db2.gz VMWYYPNPALWYAX-FQEVSTJZSA-N 1 1 291.394 4.776 20 0 CJADMO Cc1cc(C)cc(C[NH2+][C@@H](c2ccco2)c2ccccc2)c1 ZINC000057600511 330376908 /nfs/dbraw/zinc/37/69/08/330376908.db2.gz VMWYYPNPALWYAX-HXUWFJFHSA-N 1 1 291.394 4.776 20 0 CJADMO C[C@H]([NH2+][C@@H]1CCCc2sccc21)c1c(F)cccc1F ZINC000061328295 262394253 /nfs/dbraw/zinc/39/42/53/262394253.db2.gz JJGLEQAPVGLQLC-IINYFYTJSA-N 1 1 293.382 4.755 20 0 CJADMO C[C@@H]([NH2+][C@@H]1CCCc2sccc21)c1c(F)cccc1F ZINC000061328296 262394304 /nfs/dbraw/zinc/39/43/04/262394304.db2.gz JJGLEQAPVGLQLC-QMTHXVAHSA-N 1 1 293.382 4.755 20 0 CJADMO C[C@H]([NH2+][C@H]1CCCc2sccc21)c1c(F)cccc1F ZINC000061328298 262394233 /nfs/dbraw/zinc/39/42/33/262394233.db2.gz JJGLEQAPVGLQLC-HZMBPMFUSA-N 1 1 293.382 4.755 20 0 CJADMO C[C@@H]([NH2+][C@H]1CCCc2sccc21)c1c(F)cccc1F ZINC000061328301 262394005 /nfs/dbraw/zinc/39/40/05/262394005.db2.gz JJGLEQAPVGLQLC-YGRLFVJLSA-N 1 1 293.382 4.755 20 0 CJADMO Fc1cccc(Cl)c1C[NH2+][C@@H]1CCCc2sccc21 ZINC000061359833 262394014 /nfs/dbraw/zinc/39/40/14/262394014.db2.gz IXCMQIGXKZDTDJ-CQSZACIVSA-N 1 1 295.810 4.708 20 0 CJADMO Fc1cccc(Cl)c1C[NH2+][C@H]1CCCc2sccc21 ZINC000061359834 262394415 /nfs/dbraw/zinc/39/44/15/262394415.db2.gz IXCMQIGXKZDTDJ-AWEZNQCLSA-N 1 1 295.810 4.708 20 0 CJADMO C[C@H]([NH2+][C@@H](c1ccccc1)c1ccccn1)c1ccsc1 ZINC000061360663 262395031 /nfs/dbraw/zinc/39/50/31/262395031.db2.gz DXOJZDHTMQEUFU-KSSFIOAISA-N 1 1 294.423 4.583 20 0 CJADMO C[C@@H]([NH2+][C@@H](c1ccccc1)c1ccccn1)c1ccsc1 ZINC000061360664 262394849 /nfs/dbraw/zinc/39/48/49/262394849.db2.gz DXOJZDHTMQEUFU-KDOFPFPSSA-N 1 1 294.423 4.583 20 0 CJADMO C[C@H]([NH2+][C@H](c1ccccc1)c1ccccn1)c1ccsc1 ZINC000061360665 262394792 /nfs/dbraw/zinc/39/47/92/262394792.db2.gz DXOJZDHTMQEUFU-KBXCAEBGSA-N 1 1 294.423 4.583 20 0 CJADMO C[C@@H]([NH2+][C@H](c1ccccc1)c1ccccn1)c1ccsc1 ZINC000061360666 262394655 /nfs/dbraw/zinc/39/46/55/262394655.db2.gz DXOJZDHTMQEUFU-RDTXWAMCSA-N 1 1 294.423 4.583 20 0 CJADMO C[C@H]([NH2+]Cc1c(Cl)cccc1Cl)c1ccsc1 ZINC000061360847 330435864 /nfs/dbraw/zinc/43/58/64/330435864.db2.gz LVSJFLKGQLSTLV-VIFPVBQESA-N 1 1 286.227 4.906 20 0 CJADMO C[C@@H]([NH2+]Cc1c(Cl)cccc1Cl)c1ccsc1 ZINC000061360848 330435812 /nfs/dbraw/zinc/43/58/12/330435812.db2.gz LVSJFLKGQLSTLV-SECBINFHSA-N 1 1 286.227 4.906 20 0 CJADMO Cc1ccc(C[NH2+][C@H](C)c2cc(Cl)ccc2Cl)cn1 ZINC000062050959 333536070 /nfs/dbraw/zinc/53/60/70/333536070.db2.gz ZWVYTCVGHHDABV-LLVKDONJSA-N 1 1 295.213 4.548 20 0 CJADMO Clc1cccc([C@H]([NH2+]Cc2ccco2)c2ccccc2)c1 ZINC000062422404 327226631 /nfs/dbraw/zinc/22/66/31/327226631.db2.gz KUULBRLQVMBOPF-GOSISDBHSA-N 1 1 297.785 4.812 20 0 CJADMO CC[N@@H+](Cc1nc(C)c(C)o1)[C@@H](C)c1cc2ccccc2o1 ZINC000064348716 327038331 /nfs/dbraw/zinc/03/83/31/327038331.db2.gz WTZSIUKVNSGWJG-ZDUSSCGKSA-N 1 1 298.386 4.621 20 0 CJADMO CC[N@H+](Cc1nc(C)c(C)o1)[C@@H](C)c1cc2ccccc2o1 ZINC000064348716 327038330 /nfs/dbraw/zinc/03/83/30/327038330.db2.gz WTZSIUKVNSGWJG-ZDUSSCGKSA-N 1 1 298.386 4.621 20 0 CJADMO CC[N@@H+](Cc1nc(C)c(C)o1)[C@H](C)c1cc2ccccc2o1 ZINC000066434155 521449447 /nfs/dbraw/zinc/44/94/47/521449447.db2.gz WTZSIUKVNSGWJG-CYBMUJFWSA-N 1 1 298.386 4.621 20 0 CJADMO CC[N@H+](Cc1nc(C)c(C)o1)[C@H](C)c1cc2ccccc2o1 ZINC000066434155 521449442 /nfs/dbraw/zinc/44/94/42/521449442.db2.gz WTZSIUKVNSGWJG-CYBMUJFWSA-N 1 1 298.386 4.621 20 0 CJADMO Clc1cccc([C@@H]([NH2+]Cc2ccco2)c2ccccc2)c1 ZINC000067505485 333638766 /nfs/dbraw/zinc/63/87/66/333638766.db2.gz KUULBRLQVMBOPF-SFHVURJKSA-N 1 1 297.785 4.812 20 0 CJADMO Cc1csc([C@@H](C)[NH2+]Cc2ccc(C(C)(C)C)cc2)n1 ZINC000069168669 526413174 /nfs/dbraw/zinc/41/31/74/526413174.db2.gz YYUCUHFLOQTPRX-CYBMUJFWSA-N 1 1 288.460 4.600 20 0 CJADMO Cc1csc([C@H](C)[NH2+]Cc2ccc(C(C)(C)C)cc2)n1 ZINC000069168670 526435963 /nfs/dbraw/zinc/43/59/63/526435963.db2.gz YYUCUHFLOQTPRX-ZDUSSCGKSA-N 1 1 288.460 4.600 20 0 CJADMO C[C@H]([NH2+]Cc1ccc(-c2ccccc2)cc1)c1nccs1 ZINC000070942580 333840054 /nfs/dbraw/zinc/84/00/54/333840054.db2.gz RNOBREJWHIFITD-AWEZNQCLSA-N 1 1 294.423 4.661 20 0 CJADMO C[C@@H]([NH2+]Cc1ccc(-c2ccccc2)cc1)c1nccs1 ZINC000070942581 333840141 /nfs/dbraw/zinc/84/01/41/333840141.db2.gz RNOBREJWHIFITD-CQSZACIVSA-N 1 1 294.423 4.661 20 0 CJADMO Cc1cccnc1C[NH2+][C@@H](C)c1cc(Cl)ccc1Cl ZINC000071339273 525525309 /nfs/dbraw/zinc/52/53/09/525525309.db2.gz NNFKYGMCMLXDCI-NSHDSACASA-N 1 1 295.213 4.548 20 0 CJADMO Cc1cccnc1C[NH2+][C@H](C)c1cc(Cl)ccc1Cl ZINC000071339274 525525210 /nfs/dbraw/zinc/52/52/10/525525210.db2.gz NNFKYGMCMLXDCI-LLVKDONJSA-N 1 1 295.213 4.548 20 0 CJADMO Cc1cccnc1C[NH2+][C@@H](C)c1ccc(Cl)cc1Cl ZINC000071339416 525525762 /nfs/dbraw/zinc/52/57/62/525525762.db2.gz FPMCYQAAJWHOIM-NSHDSACASA-N 1 1 295.213 4.548 20 0 CJADMO Cc1cccnc1C[NH2+][C@H](C)c1ccc(Cl)cc1Cl ZINC000071339417 525524094 /nfs/dbraw/zinc/52/40/94/525524094.db2.gz FPMCYQAAJWHOIM-LLVKDONJSA-N 1 1 295.213 4.548 20 0 CJADMO CC[C@H]([NH2+]Cc1coc(-c2cccs2)n1)c1ccccc1 ZINC000072183755 329857747 /nfs/dbraw/zinc/85/77/47/329857747.db2.gz LWXIIDDRLJWOJJ-HNNXBMFYSA-N 1 1 298.411 4.644 20 0 CJADMO C[C@H]([NH2+][C@H](c1ccco1)c1ccccc1)c1cccc(F)c1 ZINC000074336726 334003991 /nfs/dbraw/zinc/00/39/91/334003991.db2.gz DLEGFCBTQUYPRQ-LIRRHRJNSA-N 1 1 295.357 4.859 20 0 CJADMO C[C@@H]([NH2+][C@H](c1ccco1)c1ccccc1)c1cccc(F)c1 ZINC000074336731 334004064 /nfs/dbraw/zinc/00/40/64/334004064.db2.gz DLEGFCBTQUYPRQ-KUHUBIRLSA-N 1 1 295.357 4.859 20 0 CJADMO C[C@H]([NH2+][C@@H](c1ccco1)c1ccccc1)c1cccc(F)c1 ZINC000074336736 334003984 /nfs/dbraw/zinc/00/39/84/334003984.db2.gz DLEGFCBTQUYPRQ-IFXJQAMLSA-N 1 1 295.357 4.859 20 0 CJADMO C[C@@H]([NH2+][C@@H](c1ccco1)c1ccccc1)c1cccc(F)c1 ZINC000074336740 334003941 /nfs/dbraw/zinc/00/39/41/334003941.db2.gz DLEGFCBTQUYPRQ-AUUYWEPGSA-N 1 1 295.357 4.859 20 0 CJADMO CCC[N@@H+](Cc1ncc(C)o1)[C@@H](C)c1cc2ccccc2o1 ZINC000075646007 334048023 /nfs/dbraw/zinc/04/80/23/334048023.db2.gz FIKCMADXXWCXHR-AWEZNQCLSA-N 1 1 298.386 4.702 20 0 CJADMO CCC[N@H+](Cc1ncc(C)o1)[C@@H](C)c1cc2ccccc2o1 ZINC000075646007 334048022 /nfs/dbraw/zinc/04/80/22/334048022.db2.gz FIKCMADXXWCXHR-AWEZNQCLSA-N 1 1 298.386 4.702 20 0 CJADMO CCC[N@@H+](Cc1ncc(C)o1)[C@H](C)c1cc2ccccc2o1 ZINC000075646009 334048060 /nfs/dbraw/zinc/04/80/60/334048060.db2.gz FIKCMADXXWCXHR-CQSZACIVSA-N 1 1 298.386 4.702 20 0 CJADMO CCC[N@H+](Cc1ncc(C)o1)[C@H](C)c1cc2ccccc2o1 ZINC000075646009 334048058 /nfs/dbraw/zinc/04/80/58/334048058.db2.gz FIKCMADXXWCXHR-CQSZACIVSA-N 1 1 298.386 4.702 20 0 CJADMO CC(C)c1nc(C[NH2+][C@@H](C)c2ccc(Cl)cc2)cs1 ZINC000076572293 334084683 /nfs/dbraw/zinc/08/46/83/334084683.db2.gz BEMLEKRSFBMESS-NSHDSACASA-N 1 1 294.851 4.771 20 0 CJADMO CC(C)c1nc(C[NH2+][C@H](C)c2ccc(Cl)cc2)cs1 ZINC000076572297 334084800 /nfs/dbraw/zinc/08/48/00/334084800.db2.gz BEMLEKRSFBMESS-LLVKDONJSA-N 1 1 294.851 4.771 20 0 CJADMO CC(C)c1nc([C@@H](C)[NH2+]C/C=C/c2ccccc2)cs1 ZINC000076900319 334090793 /nfs/dbraw/zinc/09/07/93/334090793.db2.gz KKNAEYCCLWZATM-DNGMOHDESA-N 1 1 286.444 4.631 20 0 CJADMO CC(C)c1nc([C@H](C)[NH2+]C/C=C/c2ccccc2)cs1 ZINC000076900320 334090679 /nfs/dbraw/zinc/09/06/79/334090679.db2.gz KKNAEYCCLWZATM-RNVIBTMRSA-N 1 1 286.444 4.631 20 0 CJADMO CC(C)c1nc([C@@H](C)[NH2+]Cc2ccc(Cl)cc2)cs1 ZINC000076900824 519865925 /nfs/dbraw/zinc/86/59/25/519865925.db2.gz BTMGHFQSUOIPCP-LLVKDONJSA-N 1 1 294.851 4.771 20 0 CJADMO CC(C)c1nc([C@H](C)[NH2+]Cc2ccc(Cl)cc2)cs1 ZINC000076900826 519867627 /nfs/dbraw/zinc/86/76/27/519867627.db2.gz BTMGHFQSUOIPCP-NSHDSACASA-N 1 1 294.851 4.771 20 0 CJADMO CC(C)c1nc([C@@H](C)[NH2+]Cc2cccc(Cl)c2)cs1 ZINC000076900923 519866333 /nfs/dbraw/zinc/86/63/33/519866333.db2.gz RDVSKYRPRWOFBJ-LLVKDONJSA-N 1 1 294.851 4.771 20 0 CJADMO CC(C)c1nc([C@H](C)[NH2+]Cc2cccc(Cl)c2)cs1 ZINC000076900925 519867518 /nfs/dbraw/zinc/86/75/18/519867518.db2.gz RDVSKYRPRWOFBJ-NSHDSACASA-N 1 1 294.851 4.771 20 0 CJADMO CC[C@@H](C)c1ccc([C@H]([NH2+]Cc2ccon2)C(C)C)cc1 ZINC000077247497 334100031 /nfs/dbraw/zinc/10/00/31/334100031.db2.gz ZQVMSOZZBYKXHZ-RDTXWAMCSA-N 1 1 286.419 4.675 20 0 CJADMO CC[C@H](C)c1ccc([C@H]([NH2+]Cc2ccon2)C(C)C)cc1 ZINC000077247498 334099934 /nfs/dbraw/zinc/09/99/34/334099934.db2.gz ZQVMSOZZBYKXHZ-KBXCAEBGSA-N 1 1 286.419 4.675 20 0 CJADMO CC[C@@H](C)c1ccc([C@@H]([NH2+]Cc2ccon2)C(C)C)cc1 ZINC000077247499 334099940 /nfs/dbraw/zinc/09/99/40/334099940.db2.gz ZQVMSOZZBYKXHZ-KDOFPFPSSA-N 1 1 286.419 4.675 20 0 CJADMO CC[C@H](C)c1ccc([C@@H]([NH2+]Cc2ccon2)C(C)C)cc1 ZINC000077247500 334100027 /nfs/dbraw/zinc/10/00/27/334100027.db2.gz ZQVMSOZZBYKXHZ-KSSFIOAISA-N 1 1 286.419 4.675 20 0 CJADMO CC[C@H]([NH2+]Cc1ccc2ccccc2c1)c1nccs1 ZINC000078004247 334120300 /nfs/dbraw/zinc/12/03/00/334120300.db2.gz MCTZXHHDIMWJTK-INIZCTEOSA-N 1 1 282.412 4.537 20 0 CJADMO CC[C@@H]([NH2+]Cc1ccc2ccccc2c1)c1nccs1 ZINC000078004249 334120207 /nfs/dbraw/zinc/12/02/07/334120207.db2.gz MCTZXHHDIMWJTK-MRXNPFEDSA-N 1 1 282.412 4.537 20 0 CJADMO c1cnc2c(c1)cccc2C[N@H+](CC1CC1)C1CCCCC1 ZINC000078455075 177343210 /nfs/dbraw/zinc/34/32/10/177343210.db2.gz GTJUZQXELIDRHY-UHFFFAOYSA-N 1 1 294.442 4.780 20 0 CJADMO C[C@H]([NH2+][C@H](c1ccco1)c1ccccc1)c1ccc(F)cc1 ZINC000078595547 334136829 /nfs/dbraw/zinc/13/68/29/334136829.db2.gz IWWVYSDPFZGODR-LIRRHRJNSA-N 1 1 295.357 4.859 20 0 CJADMO C[C@@H]([NH2+][C@H](c1ccco1)c1ccccc1)c1ccc(F)cc1 ZINC000078595552 334136969 /nfs/dbraw/zinc/13/69/69/334136969.db2.gz IWWVYSDPFZGODR-KUHUBIRLSA-N 1 1 295.357 4.859 20 0 CJADMO C[C@H]([NH2+][C@@H](c1ccco1)c1ccccc1)c1ccc(F)cc1 ZINC000078595557 334136854 /nfs/dbraw/zinc/13/68/54/334136854.db2.gz IWWVYSDPFZGODR-IFXJQAMLSA-N 1 1 295.357 4.859 20 0 CJADMO C[C@@H]([NH2+][C@@H](c1ccco1)c1ccccc1)c1ccc(F)cc1 ZINC000078595561 334136920 /nfs/dbraw/zinc/13/69/20/334136920.db2.gz IWWVYSDPFZGODR-AUUYWEPGSA-N 1 1 295.357 4.859 20 0 CJADMO C[N@@H+](CCSc1ccccc1)Cc1ccc(Cl)s1 ZINC000078738960 334140130 /nfs/dbraw/zinc/14/01/30/334140130.db2.gz UKGSHIJTYDXAJS-UHFFFAOYSA-N 1 1 297.876 4.626 20 0 CJADMO c1csc(C[N@H+](CCSc2ccccc2)C2CC2)c1 ZINC000078738996 334140123 /nfs/dbraw/zinc/14/01/23/334140123.db2.gz ODBYWNDQFDQMSV-UHFFFAOYSA-N 1 1 289.469 4.505 20 0 CJADMO C[C@@H](c1ccccc1F)[N@@H+](C)CCSc1ccccc1 ZINC000078739043 334140161 /nfs/dbraw/zinc/14/01/61/334140161.db2.gz YADMQXOEBLVVDV-AWEZNQCLSA-N 1 1 289.419 4.611 20 0 CJADMO C[C@H](c1ccccc1F)[N@@H+](C)CCSc1ccccc1 ZINC000078739049 334140204 /nfs/dbraw/zinc/14/02/04/334140204.db2.gz YADMQXOEBLVVDV-CQSZACIVSA-N 1 1 289.419 4.611 20 0 CJADMO Fc1ccc(C[N@H+]2CCCCC[C@H]2c2ccco2)cc1 ZINC000078830625 177395137 /nfs/dbraw/zinc/39/51/37/177395137.db2.gz OJTKEFKBAHYONR-INIZCTEOSA-N 1 1 273.351 4.536 20 0 CJADMO Fc1ccc(C[N@H+]2CCCCC[C@@H]2c2ccco2)cc1 ZINC000078830636 177395045 /nfs/dbraw/zinc/39/50/45/177395045.db2.gz OJTKEFKBAHYONR-MRXNPFEDSA-N 1 1 273.351 4.536 20 0 CJADMO Fc1cccc(C[N@H+]2CCCCC[C@@H]2c2ccco2)c1 ZINC000078831423 177395651 /nfs/dbraw/zinc/39/56/51/177395651.db2.gz GSAURFKHTZTWMT-MRXNPFEDSA-N 1 1 273.351 4.536 20 0 CJADMO Fc1cccc(C[N@H+]2CCCCC[C@H]2c2ccco2)c1 ZINC000078831442 177395575 /nfs/dbraw/zinc/39/55/75/177395575.db2.gz GSAURFKHTZTWMT-INIZCTEOSA-N 1 1 273.351 4.536 20 0 CJADMO C[C@@H](c1cccs1)[N@@H+](C)CCSc1ccccc1 ZINC000079618476 334158180 /nfs/dbraw/zinc/15/81/80/334158180.db2.gz SGGBSFKFTGOUQW-ZDUSSCGKSA-N 1 1 277.458 4.533 20 0 CJADMO C[C@H](c1cccs1)[N@@H+](C)CCSc1ccccc1 ZINC000079618480 334158380 /nfs/dbraw/zinc/15/83/80/334158380.db2.gz SGGBSFKFTGOUQW-CYBMUJFWSA-N 1 1 277.458 4.533 20 0 CJADMO CC(C)[N@@H+](CCSc1ccccc1)Cc1cccs1 ZINC000079618617 334158335 /nfs/dbraw/zinc/15/83/35/334158335.db2.gz RJKVLQZSXOKZIP-UHFFFAOYSA-N 1 1 291.485 4.751 20 0 CJADMO CC(C)c1nc(C[NH2+][C@H](C)c2cccc(Cl)c2)cs1 ZINC000079913943 334164186 /nfs/dbraw/zinc/16/41/86/334164186.db2.gz JLRDZXOVLNWEFO-LLVKDONJSA-N 1 1 294.851 4.771 20 0 CJADMO CC[C@H]([NH2+][C@@H](C)c1cccc(Cl)c1)c1nccs1 ZINC000080256123 334168570 /nfs/dbraw/zinc/16/85/70/334168570.db2.gz XEYHNTYDCSXWPF-GWCFXTLKSA-N 1 1 280.824 4.598 20 0 CJADMO CC[C@@H]([NH2+][C@@H](C)c1cccc(Cl)c1)c1nccs1 ZINC000080256128 334168545 /nfs/dbraw/zinc/16/85/45/334168545.db2.gz XEYHNTYDCSXWPF-GXFFZTMASA-N 1 1 280.824 4.598 20 0 CJADMO CC[C@H]([NH2+][C@H](C)c1cccc(Cl)c1)c1nccs1 ZINC000080256131 334168603 /nfs/dbraw/zinc/16/86/03/334168603.db2.gz XEYHNTYDCSXWPF-MFKMUULPSA-N 1 1 280.824 4.598 20 0 CJADMO CC[C@@H]([NH2+][C@H](C)c1cccc(Cl)c1)c1nccs1 ZINC000080256137 334168573 /nfs/dbraw/zinc/16/85/73/334168573.db2.gz XEYHNTYDCSXWPF-ZWNOBZJWSA-N 1 1 280.824 4.598 20 0 CJADMO CC[C@H]([NH2+]Cc1ccc(C(C)(C)C)cc1)c1nccs1 ZINC000080257380 334168670 /nfs/dbraw/zinc/16/86/70/334168670.db2.gz LGLPXTWIUUDGNC-HNNXBMFYSA-N 1 1 288.460 4.682 20 0 CJADMO CC[C@@H]([NH2+]Cc1ccc(C(C)(C)C)cc1)c1nccs1 ZINC000080257386 334168518 /nfs/dbraw/zinc/16/85/18/334168518.db2.gz LGLPXTWIUUDGNC-OAHLLOKOSA-N 1 1 288.460 4.682 20 0 CJADMO CC[C@H]([NH2+][C@@H](C)c1ccc(F)c(Cl)c1)c1nccs1 ZINC000080257866 334168511 /nfs/dbraw/zinc/16/85/11/334168511.db2.gz YWAWXAAACYXNTR-ZANVPECISA-N 1 1 298.814 4.738 20 0 CJADMO CC[C@@H]([NH2+][C@@H](C)c1ccc(F)c(Cl)c1)c1nccs1 ZINC000080257874 334168536 /nfs/dbraw/zinc/16/85/36/334168536.db2.gz YWAWXAAACYXNTR-TVQRCGJNSA-N 1 1 298.814 4.738 20 0 CJADMO CC[C@H]([NH2+][C@H](C)c1ccc(F)c(Cl)c1)c1nccs1 ZINC000080257879 334168487 /nfs/dbraw/zinc/16/84/87/334168487.db2.gz YWAWXAAACYXNTR-RNCFNFMXSA-N 1 1 298.814 4.738 20 0 CJADMO CC[C@@H]([NH2+][C@H](C)c1ccc(F)c(Cl)c1)c1nccs1 ZINC000080257883 334168597 /nfs/dbraw/zinc/16/85/97/334168597.db2.gz YWAWXAAACYXNTR-NOZJJQNGSA-N 1 1 298.814 4.738 20 0 CJADMO CC[C@H]([NH2+]Cc1ccc(C(C)C)cc1)c1nccs1 ZINC000080258822 334168492 /nfs/dbraw/zinc/16/84/92/334168492.db2.gz ADIUUBCALFXFOI-HNNXBMFYSA-N 1 1 274.433 4.507 20 0 CJADMO CC[C@@H]([NH2+]Cc1ccc(C(C)C)cc1)c1nccs1 ZINC000080258828 334168647 /nfs/dbraw/zinc/16/86/47/334168647.db2.gz ADIUUBCALFXFOI-OAHLLOKOSA-N 1 1 274.433 4.507 20 0 CJADMO CC[C@H]([NH2+][C@@H](C)c1ccc(Cl)cc1)c1nccs1 ZINC000080261370 334168837 /nfs/dbraw/zinc/16/88/37/334168837.db2.gz CETPIKINNRKXGI-GWCFXTLKSA-N 1 1 280.824 4.598 20 0 CJADMO CC[C@@H]([NH2+][C@@H](C)c1ccc(Cl)cc1)c1nccs1 ZINC000080261372 334168975 /nfs/dbraw/zinc/16/89/75/334168975.db2.gz CETPIKINNRKXGI-GXFFZTMASA-N 1 1 280.824 4.598 20 0 CJADMO CC[C@H]([NH2+][C@H](C)c1ccc(Cl)cc1)c1nccs1 ZINC000080261377 334168770 /nfs/dbraw/zinc/16/87/70/334168770.db2.gz CETPIKINNRKXGI-MFKMUULPSA-N 1 1 280.824 4.598 20 0 CJADMO CC[C@@H]([NH2+][C@H](C)c1ccc(Cl)cc1)c1nccs1 ZINC000080261382 334168756 /nfs/dbraw/zinc/16/87/56/334168756.db2.gz CETPIKINNRKXGI-ZWNOBZJWSA-N 1 1 280.824 4.598 20 0 CJADMO CC[C@H]([NH2+][C@@H](C)c1cc2ccccc2o1)c1nccs1 ZINC000080263464 334168814 /nfs/dbraw/zinc/16/88/14/334168814.db2.gz TZRPYTKDSFFTGA-AAEUAGOBSA-N 1 1 286.400 4.691 20 0 CJADMO CC[C@@H]([NH2+][C@@H](C)c1cc2ccccc2o1)c1nccs1 ZINC000080263472 334168981 /nfs/dbraw/zinc/16/89/81/334168981.db2.gz TZRPYTKDSFFTGA-WCQYABFASA-N 1 1 286.400 4.691 20 0 CJADMO CC[C@H]([NH2+][C@H](C)c1cc2ccccc2o1)c1nccs1 ZINC000080263477 334168768 /nfs/dbraw/zinc/16/87/68/334168768.db2.gz TZRPYTKDSFFTGA-YPMHNXCESA-N 1 1 286.400 4.691 20 0 CJADMO CC[C@@H]([NH2+][C@H](C)c1cc2ccccc2o1)c1nccs1 ZINC000080263481 334169019 /nfs/dbraw/zinc/16/90/19/334169019.db2.gz TZRPYTKDSFFTGA-DGCLKSJQSA-N 1 1 286.400 4.691 20 0 CJADMO C[C@H]([NH2+][C@@H]1CCC(C)(C)c2ccccc21)c1nccs1 ZINC000080265092 260178718 /nfs/dbraw/zinc/17/87/18/260178718.db2.gz IGBQKEHIWPVCDJ-SWLSCSKDSA-N 1 1 286.444 4.606 20 0 CJADMO C[C@@H]([NH2+][C@@H]1CCC(C)(C)c2ccccc21)c1nccs1 ZINC000080265094 260178711 /nfs/dbraw/zinc/17/87/11/260178711.db2.gz IGBQKEHIWPVCDJ-IUODEOHRSA-N 1 1 286.444 4.606 20 0 CJADMO C[C@H]([NH2+][C@H]1CCC(C)(C)c2ccccc21)c1nccs1 ZINC000080265095 260178982 /nfs/dbraw/zinc/17/89/82/260178982.db2.gz IGBQKEHIWPVCDJ-WFASDCNBSA-N 1 1 286.444 4.606 20 0 CJADMO C[C@@H]([NH2+][C@H]1CCC(C)(C)c2ccccc21)c1nccs1 ZINC000080265097 260179006 /nfs/dbraw/zinc/17/90/06/260179006.db2.gz IGBQKEHIWPVCDJ-DOMZBBRYSA-N 1 1 286.444 4.606 20 0 CJADMO CC(C)Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2nccs2)cc1 ZINC000080265303 334168743 /nfs/dbraw/zinc/16/87/43/334168743.db2.gz PUWLWQWXGXWGIJ-KGLIPLIRSA-N 1 1 288.460 4.753 20 0 CJADMO CC(C)Cc1ccc([C@H](C)[NH2+][C@@H](C)c2nccs2)cc1 ZINC000080265304 334168847 /nfs/dbraw/zinc/16/88/47/334168847.db2.gz PUWLWQWXGXWGIJ-KBPBESRZSA-N 1 1 288.460 4.753 20 0 CJADMO CC(C)c1ccc([C@@H](C)[NH2+][C@@H](C)c2nccs2)cc1 ZINC000080265319 260179266 /nfs/dbraw/zinc/17/92/66/260179266.db2.gz QBKSHZULZLBAHB-OLZOCXBDSA-N 1 1 274.433 4.678 20 0 CJADMO CC(C)c1ccc([C@H](C)[NH2+][C@@H](C)c2nccs2)cc1 ZINC000080265321 260179285 /nfs/dbraw/zinc/17/92/85/260179285.db2.gz QBKSHZULZLBAHB-STQMWFEESA-N 1 1 274.433 4.678 20 0 CJADMO CCCCc1ccc([C@@H](C)[NH2+][C@@H](C)c2nccs2)cc1 ZINC000080265374 334169010 /nfs/dbraw/zinc/16/90/10/334169010.db2.gz GFXHFQVFPXFVJA-KGLIPLIRSA-N 1 1 288.460 4.898 20 0 CJADMO CCCCc1ccc([C@H](C)[NH2+][C@@H](C)c2nccs2)cc1 ZINC000080265376 334168895 /nfs/dbraw/zinc/16/88/95/334168895.db2.gz GFXHFQVFPXFVJA-KBPBESRZSA-N 1 1 288.460 4.898 20 0 CJADMO C[C@H]([NH2+][C@@H](c1ccc(Cl)cc1)C1CC1)c1nccs1 ZINC000080265534 334168819 /nfs/dbraw/zinc/16/88/19/334168819.db2.gz XSSUVYNZGZKHFR-IINYFYTJSA-N 1 1 292.835 4.598 20 0 CJADMO C[C@@H]([NH2+][C@@H](c1ccc(Cl)cc1)C1CC1)c1nccs1 ZINC000080265537 334168889 /nfs/dbraw/zinc/16/88/89/334168889.db2.gz XSSUVYNZGZKHFR-QMTHXVAHSA-N 1 1 292.835 4.598 20 0 CJADMO C[C@H]([NH2+][C@H](c1ccc(Cl)cc1)C1CC1)c1nccs1 ZINC000080265540 334168808 /nfs/dbraw/zinc/16/88/08/334168808.db2.gz XSSUVYNZGZKHFR-HZMBPMFUSA-N 1 1 292.835 4.598 20 0 CJADMO C[C@@H]([NH2+][C@H](c1ccc(Cl)cc1)C1CC1)c1nccs1 ZINC000080265543 334168874 /nfs/dbraw/zinc/16/88/74/334168874.db2.gz XSSUVYNZGZKHFR-YGRLFVJLSA-N 1 1 292.835 4.598 20 0 CJADMO CC[C@H]([NH2+][C@@H](C)c1nccs1)c1cccc(Cl)c1 ZINC000080265688 330345494 /nfs/dbraw/zinc/34/54/94/330345494.db2.gz RBAOMJHGNGPSTI-GWCFXTLKSA-N 1 1 280.824 4.598 20 0 CJADMO CC[C@@H]([NH2+][C@@H](C)c1nccs1)c1cccc(Cl)c1 ZINC000080265690 330345512 /nfs/dbraw/zinc/34/55/12/330345512.db2.gz RBAOMJHGNGPSTI-GXFFZTMASA-N 1 1 280.824 4.598 20 0 CJADMO CC[C@H]([NH2+][C@H](C)c1nccs1)c1cccc(Cl)c1 ZINC000080265693 330345438 /nfs/dbraw/zinc/34/54/38/330345438.db2.gz RBAOMJHGNGPSTI-MFKMUULPSA-N 1 1 280.824 4.598 20 0 CJADMO CC[C@@H]([NH2+][C@H](C)c1nccs1)c1cccc(Cl)c1 ZINC000080265698 330345425 /nfs/dbraw/zinc/34/54/25/330345425.db2.gz RBAOMJHGNGPSTI-ZWNOBZJWSA-N 1 1 280.824 4.598 20 0 CJADMO CCC[C@H]([NH2+][C@@H](C)c1nccs1)c1ccc(Cl)cc1 ZINC000080265876 334168799 /nfs/dbraw/zinc/16/87/99/334168799.db2.gz VDHASSPKPIQSOQ-FZMZJTMJSA-N 1 1 294.851 4.989 20 0 CJADMO CCC[C@@H]([NH2+][C@@H](C)c1nccs1)c1ccc(Cl)cc1 ZINC000080265879 334168893 /nfs/dbraw/zinc/16/88/93/334168893.db2.gz VDHASSPKPIQSOQ-SMDDNHRTSA-N 1 1 294.851 4.989 20 0 CJADMO CC[C@H]([NH2+][C@@H](C)c1nccs1)c1ccc(Cl)cc1 ZINC000080266473 330345515 /nfs/dbraw/zinc/34/55/15/330345515.db2.gz QWLILPMMYMHIBG-GWCFXTLKSA-N 1 1 280.824 4.598 20 0 CJADMO CC[C@@H]([NH2+][C@@H](C)c1nccs1)c1ccc(Cl)cc1 ZINC000080266476 330345471 /nfs/dbraw/zinc/34/54/71/330345471.db2.gz QWLILPMMYMHIBG-GXFFZTMASA-N 1 1 280.824 4.598 20 0 CJADMO CC[C@H]([NH2+][C@H](C)c1nccs1)c1ccc(Cl)cc1 ZINC000080266479 330345505 /nfs/dbraw/zinc/34/55/05/330345505.db2.gz QWLILPMMYMHIBG-MFKMUULPSA-N 1 1 280.824 4.598 20 0 CJADMO CC[C@@H]([NH2+][C@H](C)c1nccs1)c1ccc(Cl)cc1 ZINC000080266482 330345419 /nfs/dbraw/zinc/34/54/19/330345419.db2.gz QWLILPMMYMHIBG-ZWNOBZJWSA-N 1 1 280.824 4.598 20 0 CJADMO C[C@H]([NH2+][C@@H](C)c1ccc(C(C)(C)C)cc1)c1nccs1 ZINC000080266906 260179149 /nfs/dbraw/zinc/17/91/49/260179149.db2.gz BTOZHDUXAGRMTF-STQMWFEESA-N 1 1 288.460 4.852 20 0 CJADMO CCCc1ccc([C@@H](C)[NH2+][C@@H](C)c2nccs2)cc1 ZINC000080267976 334169257 /nfs/dbraw/zinc/16/92/57/334169257.db2.gz GONNLNMHIFNVQT-OLZOCXBDSA-N 1 1 274.433 4.507 20 0 CJADMO CCCc1ccc([C@H](C)[NH2+][C@@H](C)c2nccs2)cc1 ZINC000080267984 334169081 /nfs/dbraw/zinc/16/90/81/334169081.db2.gz GONNLNMHIFNVQT-STQMWFEESA-N 1 1 274.433 4.507 20 0 CJADMO Cc1c2ccccc2oc1[C@@H](C)[NH2+][C@@H](C)c1nccs1 ZINC000080268153 334169231 /nfs/dbraw/zinc/16/92/31/334169231.db2.gz MATFAICSEYVMTR-NEPJUHHUSA-N 1 1 286.400 4.610 20 0 CJADMO Cc1c2ccccc2oc1[C@H](C)[NH2+][C@@H](C)c1nccs1 ZINC000080268156 334169169 /nfs/dbraw/zinc/16/91/69/334169169.db2.gz MATFAICSEYVMTR-RYUDHWBXSA-N 1 1 286.400 4.610 20 0 CJADMO Cc1c2ccccc2oc1[C@@H](C)[NH2+][C@H](C)c1nccs1 ZINC000080268159 334169074 /nfs/dbraw/zinc/16/90/74/334169074.db2.gz MATFAICSEYVMTR-VXGBXAGGSA-N 1 1 286.400 4.610 20 0 CJADMO Cc1c2ccccc2oc1[C@H](C)[NH2+][C@H](C)c1nccs1 ZINC000080268162 334169210 /nfs/dbraw/zinc/16/92/10/334169210.db2.gz MATFAICSEYVMTR-NWDGAFQWSA-N 1 1 286.400 4.610 20 0 CJADMO Cc1csc([C@@H](C)[NH2+][C@@H](C)c2cccc(Cl)c2)n1 ZINC000080270013 334169206 /nfs/dbraw/zinc/16/92/06/334169206.db2.gz WPVVOXDDOQXHRC-WDEREUQCSA-N 1 1 280.824 4.517 20 0 CJADMO Cc1csc([C@H](C)[NH2+][C@@H](C)c2cccc(Cl)c2)n1 ZINC000080270017 334169233 /nfs/dbraw/zinc/16/92/33/334169233.db2.gz WPVVOXDDOQXHRC-QWRGUYRKSA-N 1 1 280.824 4.517 20 0 CJADMO Cc1csc([C@@H](C)[NH2+][C@H](C)c2cccc(Cl)c2)n1 ZINC000080270019 334169109 /nfs/dbraw/zinc/16/91/09/334169109.db2.gz WPVVOXDDOQXHRC-GHMZBOCLSA-N 1 1 280.824 4.517 20 0 CJADMO Cc1csc([C@H](C)[NH2+][C@H](C)c2cccc(Cl)c2)n1 ZINC000080270024 334169181 /nfs/dbraw/zinc/16/91/81/334169181.db2.gz WPVVOXDDOQXHRC-MNOVXSKESA-N 1 1 280.824 4.517 20 0 CJADMO Cc1csc([C@@H](C)[NH2+][C@@H](C)c2ccc(F)c(Cl)c2)n1 ZINC000080270799 334169035 /nfs/dbraw/zinc/16/90/35/334169035.db2.gz HUYBROOTOFNETJ-VHSXEESVSA-N 1 1 298.814 4.656 20 0 CJADMO Cc1csc([C@H](C)[NH2+][C@@H](C)c2ccc(F)c(Cl)c2)n1 ZINC000080270802 334169204 /nfs/dbraw/zinc/16/92/04/334169204.db2.gz HUYBROOTOFNETJ-UWVGGRQHSA-N 1 1 298.814 4.656 20 0 CJADMO Cc1csc([C@@H](C)[NH2+][C@H](C)c2ccc(F)c(Cl)c2)n1 ZINC000080270805 334169120 /nfs/dbraw/zinc/16/91/20/334169120.db2.gz HUYBROOTOFNETJ-NXEZZACHSA-N 1 1 298.814 4.656 20 0 CJADMO Cc1csc([C@H](C)[NH2+][C@H](C)c2ccc(F)c(Cl)c2)n1 ZINC000080270810 334169198 /nfs/dbraw/zinc/16/91/98/334169198.db2.gz HUYBROOTOFNETJ-ZJUUUORDSA-N 1 1 298.814 4.656 20 0 CJADMO Cc1csc([C@@H](C)[NH2+][C@@H](C)c2ccc(Cl)cc2)n1 ZINC000080273258 334169432 /nfs/dbraw/zinc/16/94/32/334169432.db2.gz DRMDNYZNEYTPMJ-WDEREUQCSA-N 1 1 280.824 4.517 20 0 CJADMO Cc1csc([C@H](C)[NH2+][C@@H](C)c2ccc(Cl)cc2)n1 ZINC000080273260 334169519 /nfs/dbraw/zinc/16/95/19/334169519.db2.gz DRMDNYZNEYTPMJ-QWRGUYRKSA-N 1 1 280.824 4.517 20 0 CJADMO Cc1csc([C@@H](C)[NH2+][C@H](C)c2ccc(Cl)cc2)n1 ZINC000080273263 334169383 /nfs/dbraw/zinc/16/93/83/334169383.db2.gz DRMDNYZNEYTPMJ-GHMZBOCLSA-N 1 1 280.824 4.517 20 0 CJADMO Cc1csc([C@H](C)[NH2+][C@H](C)c2ccc(Cl)cc2)n1 ZINC000080273265 334169318 /nfs/dbraw/zinc/16/93/18/334169318.db2.gz DRMDNYZNEYTPMJ-MNOVXSKESA-N 1 1 280.824 4.517 20 0 CJADMO Cc1csc([C@H](C)[NH2+][C@H](C)c2cc(C)sc2C)n1 ZINC000080273468 330116439 /nfs/dbraw/zinc/11/64/39/330116439.db2.gz MSCTVADFSXBBSJ-MNOVXSKESA-N 1 1 280.462 4.542 20 0 CJADMO Cc1csc([C@H](C)[NH2+][C@@H](C)c2cc(C)sc2C)n1 ZINC000080273471 330116545 /nfs/dbraw/zinc/11/65/45/330116545.db2.gz MSCTVADFSXBBSJ-QWRGUYRKSA-N 1 1 280.462 4.542 20 0 CJADMO Cc1csc([C@@H](C)[NH2+][C@H](C)c2cc(C)sc2C)n1 ZINC000080273473 330116535 /nfs/dbraw/zinc/11/65/35/330116535.db2.gz MSCTVADFSXBBSJ-GHMZBOCLSA-N 1 1 280.462 4.542 20 0 CJADMO Cc1csc([C@@H](C)[NH2+][C@@H](C)c2cc(C)sc2C)n1 ZINC000080273476 330116564 /nfs/dbraw/zinc/11/65/64/330116564.db2.gz MSCTVADFSXBBSJ-WDEREUQCSA-N 1 1 280.462 4.542 20 0 CJADMO Cc1csc([C@@H](C)[NH2+][C@@H](C)c2cc3ccccc3o2)n1 ZINC000080274647 260179916 /nfs/dbraw/zinc/17/99/16/260179916.db2.gz ZADQEZQZRVKSBA-NWDGAFQWSA-N 1 1 286.400 4.610 20 0 CJADMO Cc1csc([C@H](C)[NH2+][C@@H](C)c2cc3ccccc3o2)n1 ZINC000080274652 260179805 /nfs/dbraw/zinc/17/98/05/260179805.db2.gz ZADQEZQZRVKSBA-RYUDHWBXSA-N 1 1 286.400 4.610 20 0 CJADMO Cc1csc([C@@H](C)[NH2+][C@H](C)c2cc3ccccc3o2)n1 ZINC000080274655 260179761 /nfs/dbraw/zinc/17/97/61/260179761.db2.gz ZADQEZQZRVKSBA-VXGBXAGGSA-N 1 1 286.400 4.610 20 0 CJADMO Cc1csc([C@H](C)[NH2+][C@H](C)c2cc3ccccc3o2)n1 ZINC000080274659 260179422 /nfs/dbraw/zinc/17/94/22/260179422.db2.gz ZADQEZQZRVKSBA-NEPJUHHUSA-N 1 1 286.400 4.610 20 0 CJADMO CSc1ccc([C@H](C)[NH2+][C@H](C)c2nc(C)cs2)cc1 ZINC000080274676 260179674 /nfs/dbraw/zinc/17/96/74/260179674.db2.gz LYHRHIYIHKTADO-NWDGAFQWSA-N 1 1 292.473 4.585 20 0 CJADMO CSc1ccc([C@H](C)[NH2+][C@@H](C)c2nc(C)cs2)cc1 ZINC000080274683 260179918 /nfs/dbraw/zinc/17/99/18/260179918.db2.gz LYHRHIYIHKTADO-RYUDHWBXSA-N 1 1 292.473 4.585 20 0 CJADMO CSc1ccc([C@@H](C)[NH2+][C@H](C)c2nc(C)cs2)cc1 ZINC000080274689 260179912 /nfs/dbraw/zinc/17/99/12/260179912.db2.gz LYHRHIYIHKTADO-VXGBXAGGSA-N 1 1 292.473 4.585 20 0 CJADMO CSc1ccc([C@@H](C)[NH2+][C@@H](C)c2nc(C)cs2)cc1 ZINC000080274694 260179799 /nfs/dbraw/zinc/17/97/99/260179799.db2.gz LYHRHIYIHKTADO-NEPJUHHUSA-N 1 1 292.473 4.585 20 0 CJADMO Cc1csc([C@@H](C)[NH2+][C@@H](C)c2ccc(Cl)s2)n1 ZINC000080275427 330351011 /nfs/dbraw/zinc/35/10/11/330351011.db2.gz WBDBYZBTGJJCIT-DTWKUNHWSA-N 1 1 286.853 4.578 20 0 CJADMO Cc1csc([C@H](C)[NH2+][C@@H](C)c2ccc(Cl)s2)n1 ZINC000080275430 330351113 /nfs/dbraw/zinc/35/11/13/330351113.db2.gz WBDBYZBTGJJCIT-IUCAKERBSA-N 1 1 286.853 4.578 20 0 CJADMO Cc1csc([C@@H](C)[NH2+][C@H](C)c2ccc(Cl)s2)n1 ZINC000080275435 330350981 /nfs/dbraw/zinc/35/09/81/330350981.db2.gz WBDBYZBTGJJCIT-RKDXNWHRSA-N 1 1 286.853 4.578 20 0 CJADMO Cc1csc([C@H](C)[NH2+][C@H](C)c2ccc(Cl)s2)n1 ZINC000080275439 330351100 /nfs/dbraw/zinc/35/11/00/330351100.db2.gz WBDBYZBTGJJCIT-BDAKNGLRSA-N 1 1 286.853 4.578 20 0 CJADMO Cc1cnc(C(C)(C)[NH2+]Cc2ccc(C(C)C)cc2)s1 ZINC000080346793 334170669 /nfs/dbraw/zinc/17/06/69/334170669.db2.gz UHWACNXPEWGTOY-UHFFFAOYSA-N 1 1 288.460 4.600 20 0 CJADMO C[C@@H](c1ccco1)[N@@H+](Cc1cccc2cccnc21)C1CC1 ZINC000086233498 330369146 /nfs/dbraw/zinc/36/91/46/330369146.db2.gz GPHJOVUIJROENT-AWEZNQCLSA-N 1 1 292.382 4.553 20 0 CJADMO C[C@H](c1ccco1)[N@@H+](Cc1cccc2cccnc21)C1CC1 ZINC000086233500 330369180 /nfs/dbraw/zinc/36/91/80/330369180.db2.gz GPHJOVUIJROENT-CQSZACIVSA-N 1 1 292.382 4.553 20 0 CJADMO C[C@H]([NH2+][C@@H](c1ccc(F)cc1)C(C)(C)C)c1nccs1 ZINC000086509515 525542864 /nfs/dbraw/zinc/54/28/64/525542864.db2.gz YKPFZLIOBHHEIR-FZMZJTMJSA-N 1 1 292.423 4.720 20 0 CJADMO C[C@@H]([NH2+][C@@H](c1ccc(F)cc1)C(C)(C)C)c1nccs1 ZINC000086509516 525629447 /nfs/dbraw/zinc/62/94/47/525629447.db2.gz YKPFZLIOBHHEIR-RISCZKNCSA-N 1 1 292.423 4.720 20 0 CJADMO C[C@H]([NH2+][C@H](c1ccc(F)cc1)C(C)(C)C)c1nccs1 ZINC000086509518 525599159 /nfs/dbraw/zinc/59/91/59/525599159.db2.gz YKPFZLIOBHHEIR-SMDDNHRTSA-N 1 1 292.423 4.720 20 0 CJADMO C[C@@H]([NH2+][C@H](c1ccc(F)cc1)C(C)(C)C)c1nccs1 ZINC000086509520 525671118 /nfs/dbraw/zinc/67/11/18/525671118.db2.gz YKPFZLIOBHHEIR-BXUZGUMPSA-N 1 1 292.423 4.720 20 0 CJADMO Cc1csc([C@@H](C)[NH2+]Cc2ccc(CC(C)C)cc2)n1 ZINC000088296683 333088065 /nfs/dbraw/zinc/08/80/65/333088065.db2.gz MHVYUYMWFDPBCH-CQSZACIVSA-N 1 1 288.460 4.501 20 0 CJADMO Cc1csc([C@H](C)[NH2+]Cc2ccc(CC(C)C)cc2)n1 ZINC000088296685 333087942 /nfs/dbraw/zinc/08/79/42/333087942.db2.gz MHVYUYMWFDPBCH-AWEZNQCLSA-N 1 1 288.460 4.501 20 0 CJADMO Cc1cnc([C@@H](C)[NH2+]Cc2ccc(CC(C)C)cc2)s1 ZINC000088740786 328042697 /nfs/dbraw/zinc/04/26/97/328042697.db2.gz YXTGYBFRKNQCCD-CQSZACIVSA-N 1 1 288.460 4.501 20 0 CJADMO Cc1cnc([C@H](C)[NH2+]Cc2ccc(CC(C)C)cc2)s1 ZINC000088740787 328042819 /nfs/dbraw/zinc/04/28/19/328042819.db2.gz YXTGYBFRKNQCCD-AWEZNQCLSA-N 1 1 288.460 4.501 20 0 CJADMO Cc1ccoc1C[NH2+][C@@H](c1ccccc1)c1cccc(F)c1 ZINC000088766073 334341576 /nfs/dbraw/zinc/34/15/76/334341576.db2.gz VUAADXGKGVAYHW-IBGZPJMESA-N 1 1 295.357 4.606 20 0 CJADMO Cc1ccoc1C[NH2+][C@H](c1ccccc1)c1cccc(F)c1 ZINC000088766075 334341398 /nfs/dbraw/zinc/34/13/98/334341398.db2.gz VUAADXGKGVAYHW-LJQANCHMSA-N 1 1 295.357 4.606 20 0 CJADMO Cc1ccc(C[NH2+][C@@H](c2ccccc2)c2cccc(F)c2)o1 ZINC000088766205 334341437 /nfs/dbraw/zinc/34/14/37/334341437.db2.gz GXJVWVHWISXAGQ-IBGZPJMESA-N 1 1 295.357 4.606 20 0 CJADMO Cc1ccc(C[NH2+][C@H](c2ccccc2)c2cccc(F)c2)o1 ZINC000088766206 334341479 /nfs/dbraw/zinc/34/14/79/334341479.db2.gz GXJVWVHWISXAGQ-LJQANCHMSA-N 1 1 295.357 4.606 20 0 CJADMO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2csc(C(C)C)n2)cc1 ZINC000090048731 334356327 /nfs/dbraw/zinc/35/63/27/334356327.db2.gz CKBPZVHQSZBZLQ-KGLIPLIRSA-N 1 1 288.460 4.987 20 0 CJADMO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2csc(C(C)C)n2)cc1 ZINC000090048732 334356432 /nfs/dbraw/zinc/35/64/32/334356432.db2.gz CKBPZVHQSZBZLQ-KBPBESRZSA-N 1 1 288.460 4.987 20 0 CJADMO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2csc(C(C)C)n2)cc1 ZINC000090048733 334356352 /nfs/dbraw/zinc/35/63/52/334356352.db2.gz CKBPZVHQSZBZLQ-ZIAGYGMSSA-N 1 1 288.460 4.987 20 0 CJADMO Cc1ccc([C@H](C)[NH2+][C@H](C)c2csc(C(C)C)n2)cc1 ZINC000090048734 334356381 /nfs/dbraw/zinc/35/63/81/334356381.db2.gz CKBPZVHQSZBZLQ-UONOGXRCSA-N 1 1 288.460 4.987 20 0 CJADMO CC(C)c1nc([C@@H](C)[NH2+][C@@H](C)c2ccccc2)cs1 ZINC000090048739 327176577 /nfs/dbraw/zinc/17/65/77/327176577.db2.gz NOSLBDRSXNRHED-QWHCGFSZSA-N 1 1 274.433 4.678 20 0 CJADMO CC(C)c1nc([C@H](C)[NH2+][C@@H](C)c2ccccc2)cs1 ZINC000090048740 327176535 /nfs/dbraw/zinc/17/65/35/327176535.db2.gz NOSLBDRSXNRHED-STQMWFEESA-N 1 1 274.433 4.678 20 0 CJADMO CC(C)c1nc([C@@H](C)[NH2+][C@H](C)c2ccccc2)cs1 ZINC000090048741 327176560 /nfs/dbraw/zinc/17/65/60/327176560.db2.gz NOSLBDRSXNRHED-CHWSQXEVSA-N 1 1 274.433 4.678 20 0 CJADMO CC(C)c1nc([C@H](C)[NH2+][C@H](C)c2ccccc2)cs1 ZINC000090048742 327176475 /nfs/dbraw/zinc/17/64/75/327176475.db2.gz NOSLBDRSXNRHED-OLZOCXBDSA-N 1 1 274.433 4.678 20 0 CJADMO CC(C)c1nc([C@@H](C)[NH2+][C@@H](C)c2cccs2)cs1 ZINC000090049419 327176461 /nfs/dbraw/zinc/17/64/61/327176461.db2.gz WLWMTMVQKQAOLE-MNOVXSKESA-N 1 1 280.462 4.740 20 0 CJADMO CC(C)c1nc([C@H](C)[NH2+][C@@H](C)c2cccs2)cs1 ZINC000090049420 327176426 /nfs/dbraw/zinc/17/64/26/327176426.db2.gz WLWMTMVQKQAOLE-QWRGUYRKSA-N 1 1 280.462 4.740 20 0 CJADMO CC(C)c1nc([C@@H](C)[NH2+][C@H](C)c2cccs2)cs1 ZINC000090049422 327176530 /nfs/dbraw/zinc/17/65/30/327176530.db2.gz WLWMTMVQKQAOLE-GHMZBOCLSA-N 1 1 280.462 4.740 20 0 CJADMO CC(C)c1nc([C@H](C)[NH2+][C@H](C)c2cccs2)cs1 ZINC000090049423 327176469 /nfs/dbraw/zinc/17/64/69/327176469.db2.gz WLWMTMVQKQAOLE-WDEREUQCSA-N 1 1 280.462 4.740 20 0 CJADMO C[C@H]([NH2+][C@@H](C)c1c(F)cccc1Cl)c1cccs1 ZINC000090180446 260336317 /nfs/dbraw/zinc/33/63/17/260336317.db2.gz QVPBHECHOOMIBE-UWVGGRQHSA-N 1 1 283.799 4.952 20 0 CJADMO C[C@@H]([NH2+][C@@H](C)c1c(F)cccc1Cl)c1cccs1 ZINC000090180447 260336326 /nfs/dbraw/zinc/33/63/26/260336326.db2.gz QVPBHECHOOMIBE-ZJUUUORDSA-N 1 1 283.799 4.952 20 0 CJADMO C[C@@H]([NH2+][C@@H](C)c1cccs1)c1c(F)cccc1Cl ZINC000090180448 260336273 /nfs/dbraw/zinc/33/62/73/260336273.db2.gz QVPBHECHOOMIBE-VHSXEESVSA-N 1 1 283.799 4.952 20 0 CJADMO C[C@@H]([NH2+][C@H](C)c1c(F)cccc1Cl)c1cccs1 ZINC000090180449 260336664 /nfs/dbraw/zinc/33/66/64/260336664.db2.gz QVPBHECHOOMIBE-NXEZZACHSA-N 1 1 283.799 4.952 20 0 CJADMO C[C@H]([NH2+][C@@H](C)c1c(F)cccc1Cl)c1ccsc1 ZINC000090180500 260336716 /nfs/dbraw/zinc/33/67/16/260336716.db2.gz OFDCPBHYIXJIGY-UWVGGRQHSA-N 1 1 283.799 4.952 20 0 CJADMO C[C@@H]([NH2+][C@@H](C)c1c(F)cccc1Cl)c1ccsc1 ZINC000090180501 260336355 /nfs/dbraw/zinc/33/63/55/260336355.db2.gz OFDCPBHYIXJIGY-ZJUUUORDSA-N 1 1 283.799 4.952 20 0 CJADMO C[C@@H]([NH2+][C@@H](C)c1ccsc1)c1c(F)cccc1Cl ZINC000090180502 260336682 /nfs/dbraw/zinc/33/66/82/260336682.db2.gz OFDCPBHYIXJIGY-VHSXEESVSA-N 1 1 283.799 4.952 20 0 CJADMO C[C@@H]([NH2+][C@H](C)c1c(F)cccc1Cl)c1ccsc1 ZINC000090180503 260336638 /nfs/dbraw/zinc/33/66/38/260336638.db2.gz OFDCPBHYIXJIGY-NXEZZACHSA-N 1 1 283.799 4.952 20 0 CJADMO C[C@H]([NH2+]Cc1nc(C2CC2)cs1)c1ccc(Cl)s1 ZINC000090458365 327178817 /nfs/dbraw/zinc/17/88/17/327178817.db2.gz YCLKUNXOESUCFY-QMMMGPOBSA-N 1 1 298.864 4.586 20 0 CJADMO C[C@@H]([NH2+]Cc1nc(C2CC2)cs1)c1ccc(Cl)s1 ZINC000090458367 327178844 /nfs/dbraw/zinc/17/88/44/327178844.db2.gz YCLKUNXOESUCFY-MRVPVSSYSA-N 1 1 298.864 4.586 20 0 CJADMO Cc1cc([C@@H](C)[NH2+]Cc2nc(C3CC3)cs2)c(C)s1 ZINC000090458406 327178714 /nfs/dbraw/zinc/17/87/14/327178714.db2.gz PQUAKVCBZYSECU-SNVBAGLBSA-N 1 1 292.473 4.550 20 0 CJADMO Cc1cc([C@H](C)[NH2+]Cc2nc(C3CC3)cs2)c(C)s1 ZINC000090458408 327178897 /nfs/dbraw/zinc/17/88/97/327178897.db2.gz PQUAKVCBZYSECU-JTQLQIEISA-N 1 1 292.473 4.550 20 0 CJADMO C[C@H]([NH2+]Cc1nc(C2CC2)cs1)c1ccc(Cl)cc1 ZINC000090458541 327178741 /nfs/dbraw/zinc/17/87/41/327178741.db2.gz IQTNDMSHPQKYON-JTQLQIEISA-N 1 1 292.835 4.525 20 0 CJADMO C[C@@H]([NH2+]Cc1nc(C2CC2)cs1)c1ccc(Cl)cc1 ZINC000090458542 327178743 /nfs/dbraw/zinc/17/87/43/327178743.db2.gz IQTNDMSHPQKYON-SNVBAGLBSA-N 1 1 292.835 4.525 20 0 CJADMO C[C@H]([NH2+]Cc1nc(C2CC2)cs1)c1cccc(Cl)c1 ZINC000090459479 327178710 /nfs/dbraw/zinc/17/87/10/327178710.db2.gz BYDYEQJDFMOKNS-JTQLQIEISA-N 1 1 292.835 4.525 20 0 CJADMO C[C@@H]([NH2+]Cc1nc(C2CC2)cs1)c1cccc(Cl)c1 ZINC000090459482 327178729 /nfs/dbraw/zinc/17/87/29/327178729.db2.gz BYDYEQJDFMOKNS-SNVBAGLBSA-N 1 1 292.835 4.525 20 0 CJADMO C[C@H]([NH2+]Cc1nc(C2CC2)cs1)c1cc2ccccc2o1 ZINC000090459558 327178789 /nfs/dbraw/zinc/17/87/89/327178789.db2.gz MBULDTBZQOYLLN-NSHDSACASA-N 1 1 298.411 4.618 20 0 CJADMO C[C@@H]([NH2+]Cc1nc(C2CC2)cs1)c1cc2ccccc2o1 ZINC000090459560 327178680 /nfs/dbraw/zinc/17/86/80/327178680.db2.gz MBULDTBZQOYLLN-LLVKDONJSA-N 1 1 298.411 4.618 20 0 CJADMO CCC(C)(C)c1ccc(C[NH2+][C@@H](C)c2nccs2)cc1 ZINC000090727189 260395782 /nfs/dbraw/zinc/39/57/82/260395782.db2.gz YRAXBKDGCOOAOV-ZDUSSCGKSA-N 1 1 288.460 4.682 20 0 CJADMO CCC(C)(C)c1ccc(C[NH2+][C@H](C)c2nccs2)cc1 ZINC000090727192 260395854 /nfs/dbraw/zinc/39/58/54/260395854.db2.gz YRAXBKDGCOOAOV-CYBMUJFWSA-N 1 1 288.460 4.682 20 0 CJADMO CCc1ccc([C@@H](C)[NH2+][C@@H](C)c2cccc(F)c2F)o1 ZINC000090963590 334370089 /nfs/dbraw/zinc/37/00/89/334370089.db2.gz AJPBTZQJJRGUAL-WDEREUQCSA-N 1 1 279.330 4.532 20 0 CJADMO CCc1ccc([C@H](C)[NH2+][C@@H](C)c2cccc(F)c2F)o1 ZINC000090963591 334370099 /nfs/dbraw/zinc/37/00/99/334370099.db2.gz AJPBTZQJJRGUAL-QWRGUYRKSA-N 1 1 279.330 4.532 20 0 CJADMO CCc1ccc([C@@H](C)[NH2+][C@H](C)c2cccc(F)c2F)o1 ZINC000090963592 334369983 /nfs/dbraw/zinc/36/99/83/334369983.db2.gz AJPBTZQJJRGUAL-GHMZBOCLSA-N 1 1 279.330 4.532 20 0 CJADMO CCc1ccc([C@H](C)[NH2+][C@H](C)c2cccc(F)c2F)o1 ZINC000090963593 334370152 /nfs/dbraw/zinc/37/01/52/334370152.db2.gz AJPBTZQJJRGUAL-MNOVXSKESA-N 1 1 279.330 4.532 20 0 CJADMO C[C@H]([NH2+][C@@H](C)c1cccc(F)c1F)c1cc(F)cc(F)c1 ZINC000090963704 334370071 /nfs/dbraw/zinc/37/00/71/334370071.db2.gz CKHHLTXIVAJQKR-UWVGGRQHSA-N 1 1 297.295 4.655 20 0 CJADMO C[C@@H]([NH2+][C@@H](C)c1cc(F)cc(F)c1)c1cccc(F)c1F ZINC000090963705 334370064 /nfs/dbraw/zinc/37/00/64/334370064.db2.gz CKHHLTXIVAJQKR-VHSXEESVSA-N 1 1 297.295 4.655 20 0 CJADMO C[C@@H]([NH2+][C@@H](C)c1cccc(F)c1F)c1cc(F)cc(F)c1 ZINC000090963706 334370068 /nfs/dbraw/zinc/37/00/68/334370068.db2.gz CKHHLTXIVAJQKR-ZJUUUORDSA-N 1 1 297.295 4.655 20 0 CJADMO C[C@@H]([NH2+][C@H](C)c1cccc(F)c1F)c1cc(F)cc(F)c1 ZINC000090963707 334370130 /nfs/dbraw/zinc/37/01/30/334370130.db2.gz CKHHLTXIVAJQKR-NXEZZACHSA-N 1 1 297.295 4.655 20 0 CJADMO Cc1cnc(C[NH2+][C@@H](c2ccccc2Cl)C(C)C)s1 ZINC000091348605 334376738 /nfs/dbraw/zinc/37/67/38/334376738.db2.gz RDPNXFUPHAXVQU-OAHLLOKOSA-N 1 1 294.851 4.592 20 0 CJADMO Cc1cnc(C[NH2+][C@H](c2ccccc2Cl)C(C)C)s1 ZINC000091348606 334376824 /nfs/dbraw/zinc/37/68/24/334376824.db2.gz RDPNXFUPHAXVQU-HNNXBMFYSA-N 1 1 294.851 4.592 20 0 CJADMO CC(C)[C@H]([NH2+][C@@H](C)c1nccs1)c1ccccc1Cl ZINC000091725009 334382384 /nfs/dbraw/zinc/38/23/84/334382384.db2.gz BUXXQQLITYJGEI-FZMZJTMJSA-N 1 1 294.851 4.844 20 0 CJADMO CC(C)[C@@H]([NH2+][C@@H](C)c1nccs1)c1ccccc1Cl ZINC000091725010 334382352 /nfs/dbraw/zinc/38/23/52/334382352.db2.gz BUXXQQLITYJGEI-SMDDNHRTSA-N 1 1 294.851 4.844 20 0 CJADMO CC(C)[C@H]([NH2+][C@H](C)c1nccs1)c1ccccc1Cl ZINC000091725012 334382480 /nfs/dbraw/zinc/38/24/80/334382480.db2.gz BUXXQQLITYJGEI-RISCZKNCSA-N 1 1 294.851 4.844 20 0 CJADMO CC(C)[C@@H]([NH2+][C@H](C)c1nccs1)c1ccccc1Cl ZINC000091725014 334382370 /nfs/dbraw/zinc/38/23/70/334382370.db2.gz BUXXQQLITYJGEI-BXUZGUMPSA-N 1 1 294.851 4.844 20 0 CJADMO CCCC[N@@H+](Cc1cncs1)[C@@H](C)c1ccccc1 ZINC000092263399 327191311 /nfs/dbraw/zinc/19/13/11/327191311.db2.gz QCSUFXKRUWOPOH-AWEZNQCLSA-N 1 1 274.433 4.506 20 0 CJADMO CCCC[N@@H+](Cc1cncs1)[C@H](C)c1ccccc1 ZINC000092263403 327191477 /nfs/dbraw/zinc/19/14/77/327191477.db2.gz QCSUFXKRUWOPOH-CQSZACIVSA-N 1 1 274.433 4.506 20 0 CJADMO C[C@@H]([NH2+]Cc1cc(Cl)cs1)c1c(F)cccc1F ZINC000093094662 262574282 /nfs/dbraw/zinc/57/42/82/262574282.db2.gz VANDYBNCIOQJNQ-MRVPVSSYSA-N 1 1 287.762 4.531 20 0 CJADMO C[C@H]([NH2+][C@@H]1CSc2ccccc21)c1ccccc1Cl ZINC000093978048 265206086 /nfs/dbraw/zinc/20/60/86/265206086.db2.gz LFBAENLHUPTHHJ-XHDPSFHLSA-N 1 1 289.831 4.838 20 0 CJADMO C[C@@H]([NH2+][C@@H]1CSc2ccccc21)c1ccccc1Cl ZINC000093978049 265205866 /nfs/dbraw/zinc/20/58/66/265205866.db2.gz LFBAENLHUPTHHJ-IAQYHMDHSA-N 1 1 289.831 4.838 20 0 CJADMO C[C@H]([NH2+][C@H]1CSc2ccccc21)c1ccccc1Cl ZINC000093978050 265206426 /nfs/dbraw/zinc/20/64/26/265206426.db2.gz LFBAENLHUPTHHJ-NHYWBVRUSA-N 1 1 289.831 4.838 20 0 CJADMO C[C@@H]([NH2+][C@H]1CSc2ccccc21)c1ccccc1Cl ZINC000093978051 265206145 /nfs/dbraw/zinc/20/61/45/265206145.db2.gz LFBAENLHUPTHHJ-ABAIWWIYSA-N 1 1 289.831 4.838 20 0 CJADMO C[C@H]([NH2+]Cc1ccc(C2CC2)cc1)c1c(F)cccc1F ZINC000094519141 265247362 /nfs/dbraw/zinc/24/73/62/265247362.db2.gz ZUNVLVGWYNUZEF-LBPRGKRZSA-N 1 1 287.353 4.693 20 0 CJADMO C[C@@H]([NH2+]Cc1ccc(C2CC2)cc1)c1c(F)cccc1F ZINC000094519142 265247486 /nfs/dbraw/zinc/24/74/86/265247486.db2.gz ZUNVLVGWYNUZEF-GFCCVEGCSA-N 1 1 287.353 4.693 20 0 CJADMO C[C@H]([NH2+][C@@H](C)c1ccc(F)cc1F)c1cc(F)cc(F)c1 ZINC000094826547 265259263 /nfs/dbraw/zinc/25/92/63/265259263.db2.gz RFUORXSFQOJAOJ-UWVGGRQHSA-N 1 1 297.295 4.655 20 0 CJADMO C[C@@H]([NH2+][C@@H](C)c1cc(F)cc(F)c1)c1ccc(F)cc1F ZINC000094826548 265259238 /nfs/dbraw/zinc/25/92/38/265259238.db2.gz RFUORXSFQOJAOJ-VHSXEESVSA-N 1 1 297.295 4.655 20 0 CJADMO C[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1F)c1cc(F)cc(F)c1 ZINC000094826549 265259840 /nfs/dbraw/zinc/25/98/40/265259840.db2.gz RFUORXSFQOJAOJ-ZJUUUORDSA-N 1 1 297.295 4.655 20 0 CJADMO C[C@@H]([NH2+][C@H](C)c1ccc(F)cc1F)c1cc(F)cc(F)c1 ZINC000094826550 265259897 /nfs/dbraw/zinc/25/98/97/265259897.db2.gz RFUORXSFQOJAOJ-NXEZZACHSA-N 1 1 297.295 4.655 20 0 CJADMO C[C@H]([NH2+][C@@H](C)c1c(F)cccc1F)c1cc(F)cc(F)c1 ZINC000094827009 265260564 /nfs/dbraw/zinc/26/05/64/265260564.db2.gz SCDOCPGWCNBCCT-UWVGGRQHSA-N 1 1 297.295 4.655 20 0 CJADMO C[C@@H]([NH2+][C@@H](C)c1c(F)cccc1F)c1cc(F)cc(F)c1 ZINC000094827010 265259440 /nfs/dbraw/zinc/25/94/40/265259440.db2.gz SCDOCPGWCNBCCT-ZJUUUORDSA-N 1 1 297.295 4.655 20 0 CJADMO C[C@@H]([NH2+][C@@H](C)c1cc(F)cc(F)c1)c1c(F)cccc1F ZINC000094827011 265260356 /nfs/dbraw/zinc/26/03/56/265260356.db2.gz SCDOCPGWCNBCCT-VHSXEESVSA-N 1 1 297.295 4.655 20 0 CJADMO C[C@@H]([NH2+][C@H](C)c1c(F)cccc1F)c1cc(F)cc(F)c1 ZINC000094827012 265260543 /nfs/dbraw/zinc/26/05/43/265260543.db2.gz SCDOCPGWCNBCCT-NXEZZACHSA-N 1 1 297.295 4.655 20 0 CJADMO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2c(F)cccc2F)cc1F ZINC000094837485 265264062 /nfs/dbraw/zinc/26/40/62/265264062.db2.gz NLWGBURKYPJFJI-NEPJUHHUSA-N 1 1 293.332 4.824 20 0 CJADMO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2c(F)cccc2F)cc1F ZINC000094837486 265264233 /nfs/dbraw/zinc/26/42/33/265264233.db2.gz NLWGBURKYPJFJI-RYUDHWBXSA-N 1 1 293.332 4.824 20 0 CJADMO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2c(F)cccc2F)cc1F ZINC000094837487 265263468 /nfs/dbraw/zinc/26/34/68/265263468.db2.gz NLWGBURKYPJFJI-VXGBXAGGSA-N 1 1 293.332 4.824 20 0 CJADMO Cc1ccc([C@H](C)[NH2+][C@H](C)c2c(F)cccc2F)cc1F ZINC000094837488 265263596 /nfs/dbraw/zinc/26/35/96/265263596.db2.gz NLWGBURKYPJFJI-NWDGAFQWSA-N 1 1 293.332 4.824 20 0 CJADMO C[C@H]([NH2+]C(c1ccccc1)c1ccccc1)c1ccoc1 ZINC000094867518 334506268 /nfs/dbraw/zinc/50/62/68/334506268.db2.gz WSIBQBCZPJMRIY-HNNXBMFYSA-N 1 1 277.367 4.720 20 0 CJADMO C[C@@H]([NH2+]C(c1ccccc1)c1ccccc1)c1ccoc1 ZINC000094867519 334506289 /nfs/dbraw/zinc/50/62/89/334506289.db2.gz WSIBQBCZPJMRIY-OAHLLOKOSA-N 1 1 277.367 4.720 20 0 CJADMO Cc1cscc1C[NH2+]Cc1c(Cl)cccc1Cl ZINC000094876976 265268653 /nfs/dbraw/zinc/26/86/53/265268653.db2.gz FIIWEILBEFSNBX-UHFFFAOYSA-N 1 1 286.227 4.653 20 0 CJADMO CC[C@H]([NH2+]Cc1ccc(CC(C)C)cc1)c1nccs1 ZINC000094896463 265272242 /nfs/dbraw/zinc/27/22/42/265272242.db2.gz QVYYZALLXMORTP-INIZCTEOSA-N 1 1 288.460 4.583 20 0 CJADMO CC[C@@H]([NH2+]Cc1ccc(CC(C)C)cc1)c1nccs1 ZINC000094896464 265272547 /nfs/dbraw/zinc/27/25/47/265272547.db2.gz QVYYZALLXMORTP-MRXNPFEDSA-N 1 1 288.460 4.583 20 0 CJADMO Cc1ccc([C@@H](C)[NH2+]Cc2c(F)cccc2Cl)cc1F ZINC000094953007 265277845 /nfs/dbraw/zinc/27/78/45/265277845.db2.gz FKECOGOWYFHJLK-LLVKDONJSA-N 1 1 295.760 4.777 20 0 CJADMO Cc1ccc([C@H](C)[NH2+]Cc2c(F)cccc2Cl)cc1F ZINC000094953008 265277396 /nfs/dbraw/zinc/27/73/96/265277396.db2.gz FKECOGOWYFHJLK-NSHDSACASA-N 1 1 295.760 4.777 20 0 CJADMO Cc1ccc([C@@H](C)[NH2+]Cc2nc(C(C)(C)C)cs2)s1 ZINC000094965641 525735911 /nfs/dbraw/zinc/73/59/11/525735911.db2.gz YIFXINUAHJEEJT-LLVKDONJSA-N 1 1 294.489 4.661 20 0 CJADMO Cc1ccc([C@H](C)[NH2+]Cc2nc(C(C)(C)C)cs2)s1 ZINC000094965642 525930087 /nfs/dbraw/zinc/93/00/87/525930087.db2.gz YIFXINUAHJEEJT-NSHDSACASA-N 1 1 294.489 4.661 20 0 CJADMO Cc1ccccc1[C@@H](C)[NH2+]Cc1nc(C(C)(C)C)cs1 ZINC000094965687 265280215 /nfs/dbraw/zinc/28/02/15/265280215.db2.gz YYGHGKDODNLLHL-CYBMUJFWSA-N 1 1 288.460 4.600 20 0 CJADMO Cc1ccccc1[C@H](C)[NH2+]Cc1nc(C(C)(C)C)cs1 ZINC000094965688 265279967 /nfs/dbraw/zinc/27/99/67/265279967.db2.gz YYGHGKDODNLLHL-ZDUSSCGKSA-N 1 1 288.460 4.600 20 0 CJADMO Cc1ccc([C@@H](C)[NH2+]Cc2nc(C(C)(C)C)cs2)cc1 ZINC000094965716 265280805 /nfs/dbraw/zinc/28/08/05/265280805.db2.gz HBGHOXILOFGUGP-CYBMUJFWSA-N 1 1 288.460 4.600 20 0 CJADMO Cc1ccc([C@H](C)[NH2+]Cc2nc(C(C)(C)C)cs2)cc1 ZINC000094965717 265280991 /nfs/dbraw/zinc/28/09/91/265280991.db2.gz HBGHOXILOFGUGP-ZDUSSCGKSA-N 1 1 288.460 4.600 20 0 CJADMO Cc1cc([C@@H](C)[NH2+]Cc2nc(C(C)(C)C)cs2)c(C)o1 ZINC000094965790 525467156 /nfs/dbraw/zinc/46/71/56/525467156.db2.gz BINVGLSPLYHYRJ-LLVKDONJSA-N 1 1 292.448 4.501 20 0 CJADMO Cc1cc([C@H](C)[NH2+]Cc2nc(C(C)(C)C)cs2)c(C)o1 ZINC000094965791 525523134 /nfs/dbraw/zinc/52/31/34/525523134.db2.gz BINVGLSPLYHYRJ-NSHDSACASA-N 1 1 292.448 4.501 20 0 CJADMO Cc1ccc2c(c1)[C@H]([NH2+][C@@H](C)c1c(F)cccc1F)CC2 ZINC000096496971 265366270 /nfs/dbraw/zinc/36/62/70/265366270.db2.gz JYGAOODDGUTTBJ-YVEFUNNKSA-N 1 1 287.353 4.611 20 0 CJADMO Cc1ccc2c(c1)[C@@H]([NH2+][C@@H](C)c1c(F)cccc1F)CC2 ZINC000096496973 265366641 /nfs/dbraw/zinc/36/66/41/265366641.db2.gz JYGAOODDGUTTBJ-SJCJKPOMSA-N 1 1 287.353 4.611 20 0 CJADMO Cc1ccc2c(c1)[C@H]([NH2+][C@H](C)c1c(F)cccc1F)CC2 ZINC000096496975 265366348 /nfs/dbraw/zinc/36/63/48/265366348.db2.gz JYGAOODDGUTTBJ-SJKOYZFVSA-N 1 1 287.353 4.611 20 0 CJADMO Cc1ccc2c(c1)[C@@H]([NH2+][C@H](C)c1c(F)cccc1F)CC2 ZINC000096496977 265366492 /nfs/dbraw/zinc/36/64/92/265366492.db2.gz JYGAOODDGUTTBJ-PXAZEXFGSA-N 1 1 287.353 4.611 20 0 CJADMO CCCCC[N@H+]1CCC[C@@H]1c1nc2ccccc2s1 ZINC000096971253 185144137 /nfs/dbraw/zinc/14/41/37/185144137.db2.gz XIOAHCOFNRFQFY-CQSZACIVSA-N 1 1 274.433 4.623 20 0 CJADMO CCCCC[N@H+]1CCC[C@H]1c1nc2ccccc2s1 ZINC000096971254 185144129 /nfs/dbraw/zinc/14/41/29/185144129.db2.gz XIOAHCOFNRFQFY-AWEZNQCLSA-N 1 1 274.433 4.623 20 0 CJADMO C[C@H]([NH2+]C(c1ccccc1)c1ccccc1)c1ccccn1 ZINC000098080743 185684138 /nfs/dbraw/zinc/68/41/38/185684138.db2.gz ZAGCLBXHMQTTDY-INIZCTEOSA-N 1 1 288.394 4.522 20 0 CJADMO C[C@@H]([NH2+]C(c1ccccc1)c1ccccc1)c1ccccn1 ZINC000098080744 185684850 /nfs/dbraw/zinc/68/48/50/185684850.db2.gz ZAGCLBXHMQTTDY-MRXNPFEDSA-N 1 1 288.394 4.522 20 0 CJADMO CC(C)(C)c1cnc(C[NH2+][C@@H](c2ccccc2)C2CCC2)o1 ZINC000104697447 519070597 /nfs/dbraw/zinc/07/05/97/519070597.db2.gz LCWDNPQDHUAHOQ-SFHVURJKSA-N 1 1 298.430 4.603 20 0 CJADMO CC(C)(C)c1cnc(C[NH2+][C@H](c2ccccc2)C2CCC2)o1 ZINC000104697450 519072260 /nfs/dbraw/zinc/07/22/60/519072260.db2.gz LCWDNPQDHUAHOQ-GOSISDBHSA-N 1 1 298.430 4.603 20 0 CJADMO Cc1ccc([C@@H](C)[NH2+]Cc2ccc(-c3ccc(F)cc3)o2)o1 ZINC000104908631 328811340 /nfs/dbraw/zinc/81/13/40/328811340.db2.gz MOPXPXCIEDSTDU-CYBMUJFWSA-N 1 1 299.345 4.838 20 0 CJADMO COc1ccc([C@H](C)[N@@H+](C)Cc2ccc(Cl)s2)cc1 ZINC000105731500 330328024 /nfs/dbraw/zinc/32/80/24/330328024.db2.gz MDAIVDDHSIZKSK-NSHDSACASA-N 1 1 295.835 4.603 20 0 CJADMO COc1ccc([C@@H](C)[N@@H+](C)Cc2ccc(Cl)s2)cc1 ZINC000105731502 330328062 /nfs/dbraw/zinc/32/80/62/330328062.db2.gz MDAIVDDHSIZKSK-LLVKDONJSA-N 1 1 295.835 4.603 20 0 CJADMO Cc1ccc(C[NH2+][C@H](c2ccco2)c2ccccc2)cc1F ZINC000106410004 330337576 /nfs/dbraw/zinc/33/75/76/330337576.db2.gz VVCUDTDMCORXSD-IBGZPJMESA-N 1 1 295.357 4.606 20 0 CJADMO Cc1ccc(C[NH2+][C@@H](c2ccco2)c2ccccc2)cc1F ZINC000106410006 330337562 /nfs/dbraw/zinc/33/75/62/330337562.db2.gz VVCUDTDMCORXSD-LJQANCHMSA-N 1 1 295.357 4.606 20 0 CJADMO C[C@H]([NH2+]Cc1cccc(F)c1F)c1cc2ccccc2o1 ZINC000107038258 330346029 /nfs/dbraw/zinc/34/60/29/330346029.db2.gz FCMDPWKGRCFPAV-NSHDSACASA-N 1 1 287.309 4.562 20 0 CJADMO C[C@@H]([NH2+]Cc1cccc(F)c1F)c1cc2ccccc2o1 ZINC000107038262 330345956 /nfs/dbraw/zinc/34/59/56/330345956.db2.gz FCMDPWKGRCFPAV-LLVKDONJSA-N 1 1 287.309 4.562 20 0 CJADMO CC(C)[N@@H+](Cc1csc(-c2ccoc2)n1)C1CCCC1 ZINC000108364437 330353670 /nfs/dbraw/zinc/35/36/70/330353670.db2.gz POFVQEPZOFJNNX-UHFFFAOYSA-N 1 1 290.432 4.556 20 0 CJADMO CC(C)[N@@H+](Cc1coc(-c2cccs2)n1)C1CCCC1 ZINC000108365372 330353695 /nfs/dbraw/zinc/35/36/95/330353695.db2.gz ZPWJDUHLCGSJMD-UHFFFAOYSA-N 1 1 290.432 4.556 20 0 CJADMO C[C@@H]([NH2+]Cc1ccc([C@H]2C[C@@H]2C)o1)c1ccc(F)cc1F ZINC000108977518 186239164 /nfs/dbraw/zinc/23/91/64/186239164.db2.gz VRLZUYGWPDDGJR-RWSFTLGLSA-N 1 1 291.341 4.532 20 0 CJADMO C[C@@H]([NH2+]Cc1ccc([C@@H]2C[C@@H]2C)o1)c1ccc(F)cc1F ZINC000108977525 186239230 /nfs/dbraw/zinc/23/92/30/186239230.db2.gz VRLZUYGWPDDGJR-FIXISWKDSA-N 1 1 291.341 4.532 20 0 CJADMO Cc1oc(-c2ccccc2)nc1C[N@H+](C(C)C)C1CCCC1 ZINC000110796256 328319374 /nfs/dbraw/zinc/31/93/74/328319374.db2.gz LFRUGIKXFUBHCN-UHFFFAOYSA-N 1 1 298.430 4.803 20 0 CJADMO CC(C)[N@@H+](Cc1cc(F)cc2cccnc21)C1CCCC1 ZINC000111173011 328332571 /nfs/dbraw/zinc/33/25/71/328332571.db2.gz ZLZRYDZPMNVEQT-UHFFFAOYSA-N 1 1 286.394 4.527 20 0 CJADMO Fc1ccc2c(C3=CC[N@H+]([C@H]4C=CCCC4)CC3)c[nH]c2c1 ZINC000111190873 328334304 /nfs/dbraw/zinc/33/43/04/328334304.db2.gz MZZMUXSPVRLNOE-INIZCTEOSA-N 1 1 296.389 4.505 20 0 CJADMO Fc1ccc2c(C3=CC[N@H+]([C@@H]4C=CCCC4)CC3)c[nH]c2c1 ZINC000111190875 328334230 /nfs/dbraw/zinc/33/42/30/328334230.db2.gz MZZMUXSPVRLNOE-MRXNPFEDSA-N 1 1 296.389 4.505 20 0 CJADMO C[C@H]([NH2+]Cc1cc(F)ccc1F)c1ccc(F)cc1Cl ZINC000111404969 328354511 /nfs/dbraw/zinc/35/45/11/328354511.db2.gz MTBIMUXXHPXBRC-VIFPVBQESA-N 1 1 299.723 4.608 20 0 CJADMO C[C@@H]([NH2+]Cc1cc(F)ccc1F)c1ccc(F)cc1Cl ZINC000111404971 328354392 /nfs/dbraw/zinc/35/43/92/328354392.db2.gz MTBIMUXXHPXBRC-SECBINFHSA-N 1 1 299.723 4.608 20 0 CJADMO CC[C@H]([NH2+][C@@H](C)c1ccc(F)c(F)c1)c1nc(C)cs1 ZINC000112544495 328440870 /nfs/dbraw/zinc/44/08/70/328440870.db2.gz FWDHSOMTEWDSMT-HZMBPMFUSA-N 1 1 296.386 4.532 20 0 CJADMO C[C@H]([NH2+]Cc1csc(C2CC2)n1)c1ccc(Cl)cc1 ZINC000113312584 328602113 /nfs/dbraw/zinc/60/21/13/328602113.db2.gz SRSDAPRRGKOORE-JTQLQIEISA-N 1 1 292.835 4.525 20 0 CJADMO c1sc(C2CC2)nc1C[NH2+]C1(c2ccccc2)CCCC1 ZINC000113958245 328638784 /nfs/dbraw/zinc/63/87/84/328638784.db2.gz SRJOFGPTCRPWMN-UHFFFAOYSA-N 1 1 298.455 4.580 20 0 CJADMO C[C@H]([NH2+][C@@H](C)c1cccc(Cl)c1Cl)c1cccnc1 ZINC000117943287 330366507 /nfs/dbraw/zinc/36/65/07/330366507.db2.gz LZMZVALUVPIRLZ-QWRGUYRKSA-N 1 1 295.213 4.800 20 0 CJADMO C[C@@H]([NH2+][C@@H](C)c1cccc(Cl)c1Cl)c1cccnc1 ZINC000117943289 330366466 /nfs/dbraw/zinc/36/64/66/330366466.db2.gz LZMZVALUVPIRLZ-MNOVXSKESA-N 1 1 295.213 4.800 20 0 CJADMO C[C@@H]([NH2+][C@@H](C)c1cccnc1)c1cccc(Cl)c1Cl ZINC000117943292 330366540 /nfs/dbraw/zinc/36/65/40/330366540.db2.gz LZMZVALUVPIRLZ-WDEREUQCSA-N 1 1 295.213 4.800 20 0 CJADMO C[C@@H]([NH2+][C@H](C)c1cccc(Cl)c1Cl)c1cccnc1 ZINC000117943294 330366484 /nfs/dbraw/zinc/36/64/84/330366484.db2.gz LZMZVALUVPIRLZ-GHMZBOCLSA-N 1 1 295.213 4.800 20 0 CJADMO Cc1ccc(C[NH2+][C@@H](C)c2cccc(Cl)c2Cl)o1 ZINC000117951178 330366610 /nfs/dbraw/zinc/36/66/10/330366610.db2.gz WPHWUBCKIFPPFW-JTQLQIEISA-N 1 1 284.186 4.746 20 0 CJADMO Cc1ccc(C[NH2+][C@H](C)c2cccc(Cl)c2Cl)o1 ZINC000117951179 330366653 /nfs/dbraw/zinc/36/66/53/330366653.db2.gz WPHWUBCKIFPPFW-SNVBAGLBSA-N 1 1 284.186 4.746 20 0 CJADMO C[C@H]([NH2+]Cc1ccccc1OC1CCC1)c1ccccc1F ZINC000118442912 330367279 /nfs/dbraw/zinc/36/72/79/330367279.db2.gz PBGZDYRUBMZVCL-AWEZNQCLSA-N 1 1 299.389 4.608 20 0 CJADMO C[C@@H]([NH2+]Cc1ccccc1OC1CCC1)c1ccccc1F ZINC000118442915 330367336 /nfs/dbraw/zinc/36/73/36/330367336.db2.gz PBGZDYRUBMZVCL-CQSZACIVSA-N 1 1 299.389 4.608 20 0 CJADMO C[C@@H](c1ccc(Cl)cc1Cl)[N@@H+](C)Cc1ccncc1 ZINC000118888433 330368568 /nfs/dbraw/zinc/36/85/68/330368568.db2.gz YVSQVPUVPKJOCP-NSHDSACASA-N 1 1 295.213 4.581 20 0 CJADMO C[C@@H](c1ccc(Cl)cc1Cl)[N@H+](C)Cc1ccncc1 ZINC000118888433 330368567 /nfs/dbraw/zinc/36/85/67/330368567.db2.gz YVSQVPUVPKJOCP-NSHDSACASA-N 1 1 295.213 4.581 20 0 CJADMO C[C@H](c1ccc(Cl)cc1Cl)[N@@H+](C)Cc1ccncc1 ZINC000118888435 330368519 /nfs/dbraw/zinc/36/85/19/330368519.db2.gz YVSQVPUVPKJOCP-LLVKDONJSA-N 1 1 295.213 4.581 20 0 CJADMO C[C@H](c1ccc(Cl)cc1Cl)[N@H+](C)Cc1ccncc1 ZINC000118888435 330368518 /nfs/dbraw/zinc/36/85/18/330368518.db2.gz YVSQVPUVPKJOCP-LLVKDONJSA-N 1 1 295.213 4.581 20 0 CJADMO Cc1cc([C@@H](C)[NH2+]Cc2cc(Cl)ccc2F)c(C)o1 ZINC000118969604 330369087 /nfs/dbraw/zinc/36/90/87/330369087.db2.gz SYXFZQHEBFKEER-SNVBAGLBSA-N 1 1 281.758 4.540 20 0 CJADMO Cc1cc([C@H](C)[NH2+]Cc2cc(Cl)ccc2F)c(C)o1 ZINC000118969720 330369215 /nfs/dbraw/zinc/36/92/15/330369215.db2.gz SYXFZQHEBFKEER-JTQLQIEISA-N 1 1 281.758 4.540 20 0 CJADMO CC[C@@H](C)Oc1cc(C)ccc1C[NH2+][C@@H](C)c1ccco1 ZINC000119217622 330371918 /nfs/dbraw/zinc/37/19/18/330371918.db2.gz MSBWIGFTDIJSTP-CABCVRRESA-N 1 1 287.403 4.616 20 0 CJADMO CC[C@H](C)Oc1cc(C)ccc1C[NH2+][C@@H](C)c1ccco1 ZINC000119217735 330371959 /nfs/dbraw/zinc/37/19/59/330371959.db2.gz MSBWIGFTDIJSTP-GJZGRUSLSA-N 1 1 287.403 4.616 20 0 CJADMO CC[C@@H](C)Oc1cc(C)ccc1C[NH2+][C@H](C)c1ccco1 ZINC000119217863 330372004 /nfs/dbraw/zinc/37/20/04/330372004.db2.gz MSBWIGFTDIJSTP-HUUCEWRRSA-N 1 1 287.403 4.616 20 0 CJADMO CC[C@H](C)Oc1cc(C)ccc1C[NH2+][C@H](C)c1ccco1 ZINC000119217979 330371961 /nfs/dbraw/zinc/37/19/61/330371961.db2.gz MSBWIGFTDIJSTP-LSDHHAIUSA-N 1 1 287.403 4.616 20 0 CJADMO CC[N@@H+](Cc1nc(C)c(-c2ccc(Cl)cc2)o1)C(C)C ZINC000119420285 330374839 /nfs/dbraw/zinc/37/48/39/330374839.db2.gz MHQYBZSUQHTIHK-UHFFFAOYSA-N 1 1 292.810 4.534 20 0 CJADMO CC(C)[N@@H+](Cc1csc(-c2ccsc2)n1)C1CCC1 ZINC000119776795 330379727 /nfs/dbraw/zinc/37/97/27/330379727.db2.gz KNRZPZSAEIFZOH-UHFFFAOYSA-N 1 1 292.473 4.635 20 0 CJADMO Cc1cc(C[NH2+][C@@H](C)c2ccc(-c3ccccc3)cc2)on1 ZINC000120098564 330384540 /nfs/dbraw/zinc/38/45/40/330384540.db2.gz CLHZSXXAESOWRU-HNNXBMFYSA-N 1 1 292.382 4.501 20 0 CJADMO Cc1cc(C[NH2+][C@H](C)c2ccc(-c3ccccc3)cc2)on1 ZINC000120098717 330384500 /nfs/dbraw/zinc/38/45/00/330384500.db2.gz CLHZSXXAESOWRU-OAHLLOKOSA-N 1 1 292.382 4.501 20 0 CJADMO C[C@H]([NH2+]C1c2ccccc2-c2ccccc21)c1ccccn1 ZINC000120151202 330385919 /nfs/dbraw/zinc/38/59/19/330385919.db2.gz BQZNLNVIHVZKBI-AWEZNQCLSA-N 1 1 286.378 4.502 20 0 CJADMO C[C@@H]([NH2+]C1c2ccccc2-c2ccccc21)c1ccccn1 ZINC000120151370 330385868 /nfs/dbraw/zinc/38/58/68/330385868.db2.gz BQZNLNVIHVZKBI-CQSZACIVSA-N 1 1 286.378 4.502 20 0 CJADMO c1coc([C@@H]([NH2+][C@@H]2CCc3ccccc32)c2ccccc2)c1 ZINC000120475498 330388325 /nfs/dbraw/zinc/38/83/25/330388325.db2.gz UFGCMCSBCODTEJ-QUCCMNQESA-N 1 1 289.378 4.646 20 0 CJADMO C[C@@H](c1cccnc1)[N@@H+](C)Cc1ccc(Cl)c(Cl)c1 ZINC000120475584 330388406 /nfs/dbraw/zinc/38/84/06/330388406.db2.gz WYFCMWNNZUHWDU-NSHDSACASA-N 1 1 295.213 4.581 20 0 CJADMO c1coc([C@H]([NH2+][C@@H]2CCc3ccccc32)c2ccccc2)c1 ZINC000120475637 330388327 /nfs/dbraw/zinc/38/83/27/330388327.db2.gz UFGCMCSBCODTEJ-UYAOXDASSA-N 1 1 289.378 4.646 20 0 CJADMO C[C@H](c1cccnc1)[N@@H+](C)Cc1ccc(Cl)c(Cl)c1 ZINC000120475768 330388385 /nfs/dbraw/zinc/38/83/85/330388385.db2.gz WYFCMWNNZUHWDU-LLVKDONJSA-N 1 1 295.213 4.581 20 0 CJADMO c1coc([C@@H]([NH2+][C@H]2CCc3ccccc32)c2ccccc2)c1 ZINC000120475798 330388334 /nfs/dbraw/zinc/38/83/34/330388334.db2.gz UFGCMCSBCODTEJ-ICSRJNTNSA-N 1 1 289.378 4.646 20 0 CJADMO c1coc([C@H]([NH2+][C@H]2CCc3ccccc32)c2ccccc2)c1 ZINC000120475948 330388348 /nfs/dbraw/zinc/38/83/48/330388348.db2.gz UFGCMCSBCODTEJ-AZUAARDMSA-N 1 1 289.378 4.646 20 0 CJADMO CC(C)[C@H]([NH2+][C@@H](C)c1ccco1)c1ccc(F)cc1F ZINC000120832172 330392864 /nfs/dbraw/zinc/39/28/64/330392864.db2.gz MIBZCSGLOKKGJX-ZBEGNZNMSA-N 1 1 279.330 4.606 20 0 CJADMO CC(C)[C@@H]([NH2+][C@@H](C)c1ccco1)c1ccc(F)cc1F ZINC000120832335 330392766 /nfs/dbraw/zinc/39/27/66/330392766.db2.gz MIBZCSGLOKKGJX-MEDUHNTESA-N 1 1 279.330 4.606 20 0 CJADMO CC(C)[C@H]([NH2+][C@H](C)c1ccco1)c1ccc(F)cc1F ZINC000120832481 330392835 /nfs/dbraw/zinc/39/28/35/330392835.db2.gz MIBZCSGLOKKGJX-BZNIZROVSA-N 1 1 279.330 4.606 20 0 CJADMO CC(C)[C@@H]([NH2+][C@H](C)c1ccco1)c1ccc(F)cc1F ZINC000120832626 330392897 /nfs/dbraw/zinc/39/28/97/330392897.db2.gz MIBZCSGLOKKGJX-BDJLRTHQSA-N 1 1 279.330 4.606 20 0 CJADMO CCC[C@H]([NH2+][C@@H](C)c1ccco1)c1ccc(F)cc1F ZINC000120884541 330392009 /nfs/dbraw/zinc/39/20/09/330392009.db2.gz NXEWWSNSZIHXLB-NHYWBVRUSA-N 1 1 279.330 4.750 20 0 CJADMO CCC[C@@H]([NH2+][C@@H](C)c1ccco1)c1ccc(F)cc1F ZINC000120884690 330391938 /nfs/dbraw/zinc/39/19/38/330391938.db2.gz NXEWWSNSZIHXLB-XHDPSFHLSA-N 1 1 279.330 4.750 20 0 CJADMO CCC[C@H]([NH2+][C@H](C)c1ccco1)c1ccc(F)cc1F ZINC000120884864 330391974 /nfs/dbraw/zinc/39/19/74/330391974.db2.gz NXEWWSNSZIHXLB-ABAIWWIYSA-N 1 1 279.330 4.750 20 0 CJADMO CCC[C@@H]([NH2+][C@H](C)c1ccco1)c1ccc(F)cc1F ZINC000120885024 330391995 /nfs/dbraw/zinc/39/19/95/330391995.db2.gz NXEWWSNSZIHXLB-IAQYHMDHSA-N 1 1 279.330 4.750 20 0 CJADMO CCC(CC)c1cc(C[NH2+][C@@H](C)c2ccc(C)cc2)on1 ZINC000121232828 330397483 /nfs/dbraw/zinc/39/74/83/330397483.db2.gz JLRWUEYYYPGIBO-AWEZNQCLSA-N 1 1 286.419 4.737 20 0 CJADMO CCC(CC)c1cc(C[NH2+][C@H](C)c2ccc(C)cc2)on1 ZINC000121232992 330397533 /nfs/dbraw/zinc/39/75/33/330397533.db2.gz JLRWUEYYYPGIBO-CQSZACIVSA-N 1 1 286.419 4.737 20 0 CJADMO CCC(CC)c1cc(C[NH2+][C@@H](C)c2cccc(C)c2)on1 ZINC000121235551 330398338 /nfs/dbraw/zinc/39/83/38/330398338.db2.gz UFJJMQMWZJNFSU-AWEZNQCLSA-N 1 1 286.419 4.737 20 0 CJADMO CCC(CC)c1cc(C[NH2+][C@H](C)c2cccc(C)c2)on1 ZINC000121235680 330398408 /nfs/dbraw/zinc/39/84/08/330398408.db2.gz UFJJMQMWZJNFSU-CQSZACIVSA-N 1 1 286.419 4.737 20 0 CJADMO C[C@H]([NH2+]Cc1ccc([C@H]2C[C@H]2C)o1)c1cccc(F)c1F ZINC000121937098 330408762 /nfs/dbraw/zinc/40/87/62/330408762.db2.gz RZLIYXACMRONHP-SUNKGSAMSA-N 1 1 291.341 4.532 20 0 CJADMO CC(C)(C)c1nc(CNc2cccc3cc[nH+]cc32)cs1 ZINC000122728653 330427693 /nfs/dbraw/zinc/42/76/93/330427693.db2.gz CEHMOCYJVMIEBZ-UHFFFAOYSA-N 1 1 297.427 4.601 20 0 CJADMO Cc1ccc([C@H](C)[NH2+]Cc2ccc(-c3ccccc3)o2)o1 ZINC000122974163 330435100 /nfs/dbraw/zinc/43/51/00/330435100.db2.gz XMTMUCUNKPMQEX-AWEZNQCLSA-N 1 1 281.355 4.699 20 0 CJADMO CC(C)c1[nH+]ccn1Cc1csc(C2CCCCC2)n1 ZINC000123653184 326915117 /nfs/dbraw/zinc/91/51/17/326915117.db2.gz CBNZFTLMNXWAGR-UHFFFAOYSA-N 1 1 289.448 4.559 20 0 CJADMO Cc1ccsc1[C@@H](C)[NH2+]Cc1coc(-c2ccccc2)n1 ZINC000123822826 333553875 /nfs/dbraw/zinc/55/38/75/333553875.db2.gz JZVTWCPYHWTLEK-CYBMUJFWSA-N 1 1 298.411 4.562 20 0 CJADMO Cc1ccsc1[C@H](C)[NH2+]Cc1coc(-c2ccccc2)n1 ZINC000123823055 333553972 /nfs/dbraw/zinc/55/39/72/333553972.db2.gz JZVTWCPYHWTLEK-ZDUSSCGKSA-N 1 1 298.411 4.562 20 0 CJADMO CCCc1ccc([C@@H](C)[NH2+]Cc2csc(CC)n2)cc1 ZINC000124083847 333556080 /nfs/dbraw/zinc/55/60/80/333556080.db2.gz DFBARTACPXUBDD-CYBMUJFWSA-N 1 1 288.460 4.509 20 0 CJADMO CCCc1ccc([C@H](C)[NH2+]Cc2csc(CC)n2)cc1 ZINC000124084071 333556084 /nfs/dbraw/zinc/55/60/84/333556084.db2.gz DFBARTACPXUBDD-ZDUSSCGKSA-N 1 1 288.460 4.509 20 0 CJADMO C[C@H]([NH2+][C@@H](c1ccccc1)c1ccc(F)cc1)c1ccco1 ZINC000124543874 333559711 /nfs/dbraw/zinc/55/97/11/333559711.db2.gz JNVKDQCFUOZTGF-LIRRHRJNSA-N 1 1 295.357 4.859 20 0 CJADMO C[C@@H]([NH2+][C@H](c1ccccc1)c1ccc(F)cc1)c1ccco1 ZINC000124544530 333559799 /nfs/dbraw/zinc/55/97/99/333559799.db2.gz JNVKDQCFUOZTGF-AUUYWEPGSA-N 1 1 295.357 4.859 20 0 CJADMO Cc1cc([C@@H](C)[NH2+]Cc2cccc(Cl)c2F)c(C)o1 ZINC000125129979 333564002 /nfs/dbraw/zinc/56/40/02/333564002.db2.gz MALMOOSAWIRWAQ-SNVBAGLBSA-N 1 1 281.758 4.540 20 0 CJADMO Cc1cc(C[NH2+][C@H](C)c2ccc(-c3cccs3)cc2)on1 ZINC000125517181 333567259 /nfs/dbraw/zinc/56/72/59/333567259.db2.gz MPJGNEPZWXPBDD-CYBMUJFWSA-N 1 1 298.411 4.562 20 0 CJADMO Cc1cc(C[NH2+][C@H](C)c2ccc(C3CCCCC3)cc2)on1 ZINC000125602924 333568145 /nfs/dbraw/zinc/56/81/45/333568145.db2.gz OCLYHLBDHJTHGU-OAHLLOKOSA-N 1 1 298.430 4.882 20 0 CJADMO Cc1ccc(C[NH2+][C@@H](C)c2ccc(Cl)cc2Cl)nc1 ZINC000126941894 327615653 /nfs/dbraw/zinc/61/56/53/327615653.db2.gz LGMXCZPBMQTDQV-NSHDSACASA-N 1 1 295.213 4.548 20 0 CJADMO Cc1csc([C@H](C)[NH2+]Cc2ccc(C(C)(C)C)s2)n1 ZINC000127005726 333555302 /nfs/dbraw/zinc/55/53/02/333555302.db2.gz ZMFJUGYADDTJCC-NSHDSACASA-N 1 1 294.489 4.661 20 0 CJADMO Cc1cccc(C[NH2+][C@@H](C)c2cc3cc(C)c(C)cc3o2)n1 ZINC000127224415 333623602 /nfs/dbraw/zinc/62/36/02/333623602.db2.gz KFNPWIMXXZNNOI-HNNXBMFYSA-N 1 1 294.398 4.604 20 0 CJADMO Cc1cccc(C[NH2+][C@H](C)c2cc3cc(C)c(C)cc3o2)n1 ZINC000127224621 333623533 /nfs/dbraw/zinc/62/35/33/333623533.db2.gz KFNPWIMXXZNNOI-OAHLLOKOSA-N 1 1 294.398 4.604 20 0 CJADMO C[C@H]([NH2+]Cc1cscn1)c1cccc(-c2ccccc2)c1 ZINC000127281624 333625365 /nfs/dbraw/zinc/62/53/65/333625365.db2.gz USDQRJQJYBTKLV-AWEZNQCLSA-N 1 1 294.423 4.661 20 0 CJADMO C[C@@H]([NH2+]Cc1cscn1)c1cccc(-c2ccccc2)c1 ZINC000127281871 333625401 /nfs/dbraw/zinc/62/54/01/333625401.db2.gz USDQRJQJYBTKLV-CQSZACIVSA-N 1 1 294.423 4.661 20 0 CJADMO Cc1cccc(C[NH2+][C@@H](C)c2ccc(-c3ccccc3)o2)n1 ZINC000127319946 333626358 /nfs/dbraw/zinc/62/63/58/333626358.db2.gz FBEBIGNHLZDSFV-HNNXBMFYSA-N 1 1 292.382 4.501 20 0 CJADMO CC(C)(C)c1ccc(C[NH2+]C(C)(C)c2nccs2)s1 ZINC000127369180 327149533 /nfs/dbraw/zinc/14/95/33/327149533.db2.gz FJZTWRPPYHMVEN-UHFFFAOYSA-N 1 1 294.489 4.527 20 0 CJADMO CC(C)CCC[C@H]([NH2+]Cc1cscn1)c1ccccc1 ZINC000127403793 333628274 /nfs/dbraw/zinc/62/82/74/333628274.db2.gz GHLRAZSZCPVYLU-KRWDZBQOSA-N 1 1 288.460 4.800 20 0 CJADMO Cc1cnc([C@@H](C)[NH2+]Cc2ccc(C(C)(C)C)s2)s1 ZINC000127754436 260369786 /nfs/dbraw/zinc/36/97/86/260369786.db2.gz NNSBJGABURPXEH-LLVKDONJSA-N 1 1 294.489 4.661 20 0 CJADMO Cc1cnc([C@H](C)[NH2+]Cc2ccc(C(C)(C)C)s2)s1 ZINC000127754671 260369878 /nfs/dbraw/zinc/36/98/78/260369878.db2.gz NNSBJGABURPXEH-NSHDSACASA-N 1 1 294.489 4.661 20 0 CJADMO C[C@@H]([NH2+]C(c1ccccc1)c1ccccc1)c1cncs1 ZINC000128001588 333639850 /nfs/dbraw/zinc/63/98/50/333639850.db2.gz VMPWNCQERMEMGA-CQSZACIVSA-N 1 1 294.423 4.583 20 0 CJADMO C[C@H]([NH2+]Cc1nccs1)c1cccc(-c2ccccc2)c1 ZINC000128120378 333642729 /nfs/dbraw/zinc/64/27/29/333642729.db2.gz GHYASQKVZPBBSM-AWEZNQCLSA-N 1 1 294.423 4.661 20 0 CJADMO CC(C)CCC[C@H]([NH2+]Cc1nccs1)c1ccccc1 ZINC000128226945 329606130 /nfs/dbraw/zinc/60/61/30/329606130.db2.gz DVEISUYGMSGWCC-INIZCTEOSA-N 1 1 288.460 4.800 20 0 CJADMO CC(C)CCC[C@@H]([NH2+]Cc1nccs1)c1ccccc1 ZINC000128227195 329606125 /nfs/dbraw/zinc/60/61/25/329606125.db2.gz DVEISUYGMSGWCC-MRXNPFEDSA-N 1 1 288.460 4.800 20 0 CJADMO C[C@H]([NH2+][C@@H]1CCCc2sc(Cl)cc21)c1nccs1 ZINC000128403257 525564018 /nfs/dbraw/zinc/56/40/18/525564018.db2.gz IXHWOZVXMRHGOI-WCBMZHEXSA-N 1 1 298.864 4.586 20 0 CJADMO C[C@@H]([NH2+][C@@H]1CCCc2sc(Cl)cc21)c1nccs1 ZINC000128403526 525639630 /nfs/dbraw/zinc/63/96/30/525639630.db2.gz IXHWOZVXMRHGOI-PSASIEDQSA-N 1 1 298.864 4.586 20 0 CJADMO C[C@H]([NH2+][C@H]1CCCc2sc(Cl)cc21)c1nccs1 ZINC000128403752 525613939 /nfs/dbraw/zinc/61/39/39/525613939.db2.gz IXHWOZVXMRHGOI-WPRPVWTQSA-N 1 1 298.864 4.586 20 0 CJADMO C[C@@H]([NH2+][C@H]1CCCc2sc(Cl)cc21)c1nccs1 ZINC000128403966 525682504 /nfs/dbraw/zinc/68/25/04/525682504.db2.gz IXHWOZVXMRHGOI-SCZZXKLOSA-N 1 1 298.864 4.586 20 0 CJADMO Cc1cccc([C@H](C)[NH2+]Cc2csc(-c3ccco3)n2)c1 ZINC000128456909 333673641 /nfs/dbraw/zinc/67/36/41/333673641.db2.gz DUJGWESMFLTBLJ-ZDUSSCGKSA-N 1 1 298.411 4.562 20 0 CJADMO Cc1ccncc1C[NH2+][C@@H](C)c1cc(Cl)ccc1Cl ZINC000128478004 260374779 /nfs/dbraw/zinc/37/47/79/260374779.db2.gz ILTJDEUEVLXYSO-NSHDSACASA-N 1 1 295.213 4.548 20 0 CJADMO Cc1ccncc1C[NH2+][C@H](C)c1cc(Cl)ccc1Cl ZINC000128478212 260374898 /nfs/dbraw/zinc/37/48/98/260374898.db2.gz ILTJDEUEVLXYSO-LLVKDONJSA-N 1 1 295.213 4.548 20 0 CJADMO Cc1cc(C)cc([C@H](C)[NH2+]Cc2nc(C(C)C)cs2)c1 ZINC000128527319 333682479 /nfs/dbraw/zinc/68/24/79/333682479.db2.gz FBLUNRIJXUESQL-AWEZNQCLSA-N 1 1 288.460 4.734 20 0 CJADMO Cc1cc([C@@H](C)[NH2+]Cc2nc(C(C)C)cs2)c(C)s1 ZINC000128545245 525469493 /nfs/dbraw/zinc/46/94/93/525469493.db2.gz RFNHZBFNFQUSHP-LLVKDONJSA-N 1 1 294.489 4.796 20 0 CJADMO Cc1cc([C@H](C)[NH2+]Cc2nc(C(C)C)cs2)c(C)s1 ZINC000128545460 525522568 /nfs/dbraw/zinc/52/25/68/525522568.db2.gz RFNHZBFNFQUSHP-NSHDSACASA-N 1 1 294.489 4.796 20 0 CJADMO Cc1ccc(C)c([C@@H](C)[NH2+]Cc2nc(C(C)C)cs2)c1 ZINC000128571528 333687413 /nfs/dbraw/zinc/68/74/13/333687413.db2.gz BGVLBYTVALBRRF-CQSZACIVSA-N 1 1 288.460 4.734 20 0 CJADMO Cc1ccc(C)c([C@H](C)[NH2+]Cc2nc(C(C)C)cs2)c1 ZINC000128571748 333687526 /nfs/dbraw/zinc/68/75/26/333687526.db2.gz BGVLBYTVALBRRF-AWEZNQCLSA-N 1 1 288.460 4.734 20 0 CJADMO Cc1ccc([C@@H](C)[NH2+]Cc2nc(C(C)C)cs2)cc1C ZINC000128596939 333690334 /nfs/dbraw/zinc/69/03/34/333690334.db2.gz IMCRSBDXHPREKH-CQSZACIVSA-N 1 1 288.460 4.734 20 0 CJADMO Cc1ccc([C@H](C)[NH2+]Cc2nc(C(C)C)cs2)cc1C ZINC000128597165 333690291 /nfs/dbraw/zinc/69/02/91/333690291.db2.gz IMCRSBDXHPREKH-AWEZNQCLSA-N 1 1 288.460 4.734 20 0 CJADMO CC(C)c1csc(C[NH2+][C@@H](C)c2cccc(Cl)c2)n1 ZINC000128622011 519855010 /nfs/dbraw/zinc/85/50/10/519855010.db2.gz ZUOLVPYGQPVSLU-NSHDSACASA-N 1 1 294.851 4.771 20 0 CJADMO CC(C)c1csc(C[NH2+][C@H](C)c2cccc(Cl)c2)n1 ZINC000128622216 519855256 /nfs/dbraw/zinc/85/52/56/519855256.db2.gz ZUOLVPYGQPVSLU-LLVKDONJSA-N 1 1 294.851 4.771 20 0 CJADMO CC(C)c1csc(C[NH2+][C@@H](C)c2ccc(Cl)cc2)n1 ZINC000128669526 519854502 /nfs/dbraw/zinc/85/45/02/519854502.db2.gz QNIXBRXWWSOHEO-NSHDSACASA-N 1 1 294.851 4.771 20 0 CJADMO CC(C)c1csc(C[NH2+][C@H](C)c2ccc(Cl)cc2)n1 ZINC000128669745 519855308 /nfs/dbraw/zinc/85/53/08/519855308.db2.gz QNIXBRXWWSOHEO-LLVKDONJSA-N 1 1 294.851 4.771 20 0 CJADMO CC[C@H]([NH2+]Cc1nc(C(C)C)cs1)c1ccc(F)cc1 ZINC000128672881 522668358 /nfs/dbraw/zinc/66/83/58/522668358.db2.gz VTJQQWOHQDEEGU-AWEZNQCLSA-N 1 1 292.423 4.647 20 0 CJADMO CC[C@@H]([NH2+]Cc1nc(C(C)C)cs1)c1ccc(F)cc1 ZINC000128673140 522891587 /nfs/dbraw/zinc/89/15/87/522891587.db2.gz VTJQQWOHQDEEGU-CQSZACIVSA-N 1 1 292.423 4.647 20 0 CJADMO CCc1ccc([C@@H](C)[NH2+]Cc2nc(C(C)C)cs2)s1 ZINC000128701581 524026084 /nfs/dbraw/zinc/02/60/84/524026084.db2.gz DHUUBDNCWIRQND-LLVKDONJSA-N 1 1 294.489 4.741 20 0 CJADMO CCc1ccc([C@H](C)[NH2+]Cc2nc(C(C)C)cs2)s1 ZINC000128701756 524047228 /nfs/dbraw/zinc/04/72/28/524047228.db2.gz DHUUBDNCWIRQND-NSHDSACASA-N 1 1 294.489 4.741 20 0 CJADMO CC[C@H]([NH2+]Cc1ccoc1)c1ccc(Cl)cc1Cl ZINC000129310117 329616602 /nfs/dbraw/zinc/61/66/02/329616602.db2.gz GTRTYNNUNVKWRU-AWEZNQCLSA-N 1 1 284.186 4.827 20 0 CJADMO c1coc(C[NH2+][C@@H]2CC3(CCCCC3)Oc3ccccc32)c1 ZINC000129576529 333777751 /nfs/dbraw/zinc/77/77/51/333777751.db2.gz ZCTPETRREYYGBV-QGZVFWFLSA-N 1 1 297.398 4.596 20 0 CJADMO c1coc(C[NH2+][C@H]2CC3(CCCCC3)Oc3ccccc32)c1 ZINC000129576758 333777754 /nfs/dbraw/zinc/77/77/54/333777754.db2.gz ZCTPETRREYYGBV-KRWDZBQOSA-N 1 1 297.398 4.596 20 0 CJADMO CC[C@](C)([NH2+]Cc1ccc(Cl)cc1C)c1nccs1 ZINC000129806355 523488520 /nfs/dbraw/zinc/48/85/20/523488520.db2.gz JFMBPBJVNBGVJI-HNNXBMFYSA-N 1 1 294.851 4.520 20 0 CJADMO CC[C@@](C)([NH2+]Cc1ccc(Cl)cc1C)c1nccs1 ZINC000129806604 523658149 /nfs/dbraw/zinc/65/81/49/523658149.db2.gz JFMBPBJVNBGVJI-OAHLLOKOSA-N 1 1 294.851 4.520 20 0 CJADMO CCc1cnc(C[NH2+][C@@H](C)c2ccc(C(C)C)cc2)s1 ZINC000130401713 333841243 /nfs/dbraw/zinc/84/12/43/333841243.db2.gz DWVAKSWAJIBJDQ-ZDUSSCGKSA-N 1 1 288.460 4.680 20 0 CJADMO Cc1cccc(C(C)(C)[NH2+]Cc2csc(C(C)C)n2)c1 ZINC000130454017 330343988 /nfs/dbraw/zinc/34/39/88/330343988.db2.gz XLCBTCXJODLUFZ-UHFFFAOYSA-N 1 1 288.460 4.600 20 0 CJADMO CCCc1ccc([C@H](C)[NH2+]Cc2ncc(CC)s2)cc1 ZINC000130508896 333847932 /nfs/dbraw/zinc/84/79/32/333847932.db2.gz ATXLJBZPURKRHJ-ZDUSSCGKSA-N 1 1 288.460 4.509 20 0 CJADMO CCc1cnc(C[NH2+][C@@H](CC)c2ccc(Cl)cc2)s1 ZINC000130657035 333865285 /nfs/dbraw/zinc/86/52/85/333865285.db2.gz HBQDLKRPCZEGEW-AWEZNQCLSA-N 1 1 294.851 4.600 20 0 CJADMO C[C@H]([NH2+][C@@H](C)c1cccnc1Cl)c1ccccc1Cl ZINC000130719606 525538755 /nfs/dbraw/zinc/53/87/55/525538755.db2.gz TYYMZXUERVJJIU-QWRGUYRKSA-N 1 1 295.213 4.800 20 0 CJADMO C[C@@H]([NH2+][C@@H](C)c1cccnc1Cl)c1ccccc1Cl ZINC000130719829 525616745 /nfs/dbraw/zinc/61/67/45/525616745.db2.gz TYYMZXUERVJJIU-MNOVXSKESA-N 1 1 295.213 4.800 20 0 CJADMO C[C@@H]([NH2+][C@@H](C)c1ccccc1Cl)c1cccnc1Cl ZINC000130720085 525614380 /nfs/dbraw/zinc/61/43/80/525614380.db2.gz TYYMZXUERVJJIU-WDEREUQCSA-N 1 1 295.213 4.800 20 0 CJADMO C[C@@H]([NH2+][C@H](C)c1cccnc1Cl)c1ccccc1Cl ZINC000130720276 525665095 /nfs/dbraw/zinc/66/50/95/525665095.db2.gz TYYMZXUERVJJIU-GHMZBOCLSA-N 1 1 295.213 4.800 20 0 CJADMO Cc1ccc([C@H](C)Nc2cccc3cc[nH+]cc32)s1 ZINC000131106070 333902341 /nfs/dbraw/zinc/90/23/41/333902341.db2.gz MDLJYADFTBFHCI-LBPRGKRZSA-N 1 1 268.385 4.778 20 0 CJADMO Cc1cncc(C[NH2+][C@@H](C)c2cc(Cl)ccc2Cl)c1 ZINC000131121537 526203716 /nfs/dbraw/zinc/20/37/16/526203716.db2.gz RESUWCLVDXSWJU-NSHDSACASA-N 1 1 295.213 4.548 20 0 CJADMO Cc1cncc(C[NH2+][C@H](C)c2cc(Cl)ccc2Cl)c1 ZINC000131121755 526206707 /nfs/dbraw/zinc/20/67/07/526206707.db2.gz RESUWCLVDXSWJU-LLVKDONJSA-N 1 1 295.213 4.548 20 0 CJADMO Cc1cncc(C[NH2+][C@@H](C)c2ccc(Cl)cc2Cl)c1 ZINC000131129438 260401276 /nfs/dbraw/zinc/40/12/76/260401276.db2.gz XZGPHFXFUPDFBP-NSHDSACASA-N 1 1 295.213 4.548 20 0 CJADMO C[C@H]([NH2+]Cc1ccc(C(F)F)cc1)c1c(F)cccc1F ZINC000131363284 525435733 /nfs/dbraw/zinc/43/57/33/525435733.db2.gz HWGURJMNYGAVQH-JTQLQIEISA-N 1 1 297.295 4.753 20 0 CJADMO C[C@@H]([NH2+]Cc1ccc(C(F)F)cc1)c1c(F)cccc1F ZINC000131363498 525518998 /nfs/dbraw/zinc/51/89/98/525518998.db2.gz HWGURJMNYGAVQH-SNVBAGLBSA-N 1 1 297.295 4.753 20 0 CJADMO c1ccc2c(c1)SCC[C@H]2Nc1cccc2cc[nH+]cc21 ZINC000131414546 333934932 /nfs/dbraw/zinc/93/49/32/333934932.db2.gz TYFXCNONAWSZQN-QGZVFWFLSA-N 1 1 292.407 4.884 20 0 CJADMO Fc1cc(CNc2cccc3cc[nH+]cc32)ccc1Cl ZINC000131415782 333934977 /nfs/dbraw/zinc/93/49/77/333934977.db2.gz RHUYCVWUQFZCHA-UHFFFAOYSA-N 1 1 286.737 4.639 20 0 CJADMO FC(F)(F)[C@H]1CCC[C@@H](Nc2cccc3cc[nH+]cc32)C1 ZINC000131417481 333934957 /nfs/dbraw/zinc/93/49/57/333934957.db2.gz QFXMTVXUMPLANY-QWHCGFSZSA-N 1 1 294.320 4.768 20 0 CJADMO FC(F)(F)[C@H]1CCC[C@H](Nc2cccc3cc[nH+]cc32)C1 ZINC000131417700 333934848 /nfs/dbraw/zinc/93/48/48/333934848.db2.gz QFXMTVXUMPLANY-STQMWFEESA-N 1 1 294.320 4.768 20 0 CJADMO FC(F)(F)[C@@H]1CCC[C@H](Nc2cccc3cc[nH+]cc32)C1 ZINC000131418131 333934865 /nfs/dbraw/zinc/93/48/65/333934865.db2.gz QFXMTVXUMPLANY-OLZOCXBDSA-N 1 1 294.320 4.768 20 0 CJADMO C[C@H](Nc1cccc2cc[nH+]cc21)c1cccc(F)c1 ZINC000131427472 333936627 /nfs/dbraw/zinc/93/66/27/333936627.db2.gz IDICJGRZPQHMML-LBPRGKRZSA-N 1 1 266.319 4.547 20 0 CJADMO C[C@H](Nc1cccc2cc[nH+]cc21)c1cc(F)ccc1F ZINC000131436296 333938721 /nfs/dbraw/zinc/93/87/21/333938721.db2.gz WBHJFLLPUNCPSC-NSHDSACASA-N 1 1 284.309 4.686 20 0 CJADMO C[C@@H](Nc1cccc2cc[nH+]cc21)c1cc(F)ccc1F ZINC000131436527 333938755 /nfs/dbraw/zinc/93/87/55/333938755.db2.gz WBHJFLLPUNCPSC-LLVKDONJSA-N 1 1 284.309 4.686 20 0 CJADMO c1c2ccccc2oc1CNc1cccc2cc[nH+]cc21 ZINC000131443519 518203690 /nfs/dbraw/zinc/20/36/90/518203690.db2.gz YZYAFFYQCJSLGX-UHFFFAOYSA-N 1 1 274.323 4.593 20 0 CJADMO c1ccc(C2CC(Nc3cccc4cc[nH+]cc43)C2)cc1 ZINC000131443749 333940268 /nfs/dbraw/zinc/94/02/68/333940268.db2.gz PBUFUZJOMYSKGI-UHFFFAOYSA-N 1 1 274.367 4.593 20 0 CJADMO C[C@H](Nc1cccc2cc[nH+]cc21)c1ccc(F)cc1F ZINC000131444786 333940559 /nfs/dbraw/zinc/94/05/59/333940559.db2.gz OITRAROISBOERH-NSHDSACASA-N 1 1 284.309 4.686 20 0 CJADMO c1cc2c(s1)CCC[C@H]2Nc1cccc2cc[nH+]cc21 ZINC000131446445 333940363 /nfs/dbraw/zinc/94/03/63/333940363.db2.gz FYUZKPRZJUKVHA-OAHLLOKOSA-N 1 1 280.396 4.786 20 0 CJADMO c1cc2c(s1)CCC[C@@H]2Nc1cccc2cc[nH+]cc21 ZINC000131446642 333940566 /nfs/dbraw/zinc/94/05/66/333940566.db2.gz FYUZKPRZJUKVHA-HNNXBMFYSA-N 1 1 280.396 4.786 20 0 CJADMO C[C@@H]1C[C@@H]1c1ccc(CNc2cccc3cc[nH+]cc32)o1 ZINC000131447880 333940651 /nfs/dbraw/zinc/94/06/51/333940651.db2.gz KFYNWPQTYIVDCM-DOMZBBRYSA-N 1 1 278.355 4.563 20 0 CJADMO C[C@H]1C[C@@H]1c1ccc(CNc2cccc3cc[nH+]cc32)o1 ZINC000131448052 333940646 /nfs/dbraw/zinc/94/06/46/333940646.db2.gz KFYNWPQTYIVDCM-WFASDCNBSA-N 1 1 278.355 4.563 20 0 CJADMO C[C@H]1C[C@H]1c1ccc(CNc2cccc3cc[nH+]cc32)o1 ZINC000131448408 333940790 /nfs/dbraw/zinc/94/07/90/333940790.db2.gz KFYNWPQTYIVDCM-SWLSCSKDSA-N 1 1 278.355 4.563 20 0 CJADMO COc1ccc(CNc2cccc3cc[nH+]cc32)cc1Cl ZINC000131449624 333941574 /nfs/dbraw/zinc/94/15/74/333941574.db2.gz RWUTUBHAXWPTTI-UHFFFAOYSA-N 1 1 298.773 4.509 20 0 CJADMO CC[C@H](Nc1cccc2cc[nH+]cc21)c1ccc(F)cc1 ZINC000131459990 333942015 /nfs/dbraw/zinc/94/20/15/333942015.db2.gz STTKKBAYHHODOD-KRWDZBQOSA-N 1 1 280.346 4.937 20 0 CJADMO CC[C@@H](Nc1cccc2cc[nH+]cc21)c1ccc(F)cc1 ZINC000131460154 333942071 /nfs/dbraw/zinc/94/20/71/333942071.db2.gz STTKKBAYHHODOD-QGZVFWFLSA-N 1 1 280.346 4.937 20 0 CJADMO C[C@H](Nc1cccc2cc[nH+]cc21)c1ccc(F)cc1 ZINC000131482637 333943376 /nfs/dbraw/zinc/94/33/76/333943376.db2.gz DBOBTRXORWSMBI-LBPRGKRZSA-N 1 1 266.319 4.547 20 0 CJADMO C[C@H](Nc1cccc2cc[nH+]cc21)c1ccc(F)c(F)c1 ZINC000131486767 333943491 /nfs/dbraw/zinc/94/34/91/333943491.db2.gz JIZIZCRGHBLCQL-NSHDSACASA-N 1 1 284.309 4.686 20 0 CJADMO C[C@@H]([NH2+]Cc1cccc(C(F)F)c1)c1c(F)cccc1F ZINC000131820274 525533926 /nfs/dbraw/zinc/53/39/26/525533926.db2.gz JKSAMMOEDMXJTE-SNVBAGLBSA-N 1 1 297.295 4.753 20 0 CJADMO Cc1cccc([C@@H](C)[NH2+]Cc2nc(C(C)(C)C)cs2)c1 ZINC000133597318 334046950 /nfs/dbraw/zinc/04/69/50/334046950.db2.gz XSXPJLGDJNCXTN-CYBMUJFWSA-N 1 1 288.460 4.600 20 0 CJADMO Cc1cccc([C@H](C)[NH2+]Cc2nc(C(C)(C)C)cs2)c1 ZINC000133597511 334046938 /nfs/dbraw/zinc/04/69/38/334046938.db2.gz XSXPJLGDJNCXTN-ZDUSSCGKSA-N 1 1 288.460 4.600 20 0 CJADMO C[C@H]([NH2+]Cc1ccoc1)c1cc(F)c(Cl)cc1Cl ZINC000134281967 334086740 /nfs/dbraw/zinc/08/67/40/334086740.db2.gz YXIYAQNRGCCPGU-QMMMGPOBSA-N 1 1 288.149 4.576 20 0 CJADMO C[C@@H]([NH2+]Cc1ccoc1)c1cc(F)c(Cl)cc1Cl ZINC000134281993 334086800 /nfs/dbraw/zinc/08/68/00/334086800.db2.gz YXIYAQNRGCCPGU-MRVPVSSYSA-N 1 1 288.149 4.576 20 0 CJADMO Cc1cnc([C@@H](C)[NH2+][C@@H](C)c2ccc(F)c(Cl)c2)s1 ZINC000134898486 334107399 /nfs/dbraw/zinc/10/73/99/334107399.db2.gz GCVVYBFKDVRRCE-VHSXEESVSA-N 1 1 298.814 4.656 20 0 CJADMO Cc1cnc([C@H](C)[NH2+][C@@H](C)c2ccc(F)c(Cl)c2)s1 ZINC000134898508 334107241 /nfs/dbraw/zinc/10/72/41/334107241.db2.gz GCVVYBFKDVRRCE-UWVGGRQHSA-N 1 1 298.814 4.656 20 0 CJADMO Cc1cnc([C@@H](C)[NH2+][C@H](C)c2ccc(F)c(Cl)c2)s1 ZINC000134898529 334107391 /nfs/dbraw/zinc/10/73/91/334107391.db2.gz GCVVYBFKDVRRCE-NXEZZACHSA-N 1 1 298.814 4.656 20 0 CJADMO Cc1cnc([C@H](C)[NH2+][C@H](C)c2ccc(F)c(Cl)c2)s1 ZINC000134898548 334107323 /nfs/dbraw/zinc/10/73/23/334107323.db2.gz GCVVYBFKDVRRCE-ZJUUUORDSA-N 1 1 298.814 4.656 20 0 CJADMO Cc1cnc([C@@H](C)[NH2+]Cc2csc3ccccc23)s1 ZINC000134907314 334107924 /nfs/dbraw/zinc/10/79/24/334107924.db2.gz AFSXXMMNYFUKIU-LLVKDONJSA-N 1 1 288.441 4.517 20 0 CJADMO Cc1cnc([C@H](C)[NH2+]Cc2csc3ccccc23)s1 ZINC000134907336 334107812 /nfs/dbraw/zinc/10/78/12/334107812.db2.gz AFSXXMMNYFUKIU-NSHDSACASA-N 1 1 288.441 4.517 20 0 CJADMO Cc1cnc([C@@H](C)[NH2+]Cc2ccc(C(C)(C)C)cc2)s1 ZINC000134910043 334108113 /nfs/dbraw/zinc/10/81/13/334108113.db2.gz KVHARUGLLRYVRT-CYBMUJFWSA-N 1 1 288.460 4.600 20 0 CJADMO Cc1cnc([C@H](C)[NH2+]Cc2ccc(C(C)(C)C)cc2)s1 ZINC000134910064 334108163 /nfs/dbraw/zinc/10/81/63/334108163.db2.gz KVHARUGLLRYVRT-ZDUSSCGKSA-N 1 1 288.460 4.600 20 0 CJADMO CCCC[N@@H+](Cc1nccs1)[C@@H](C)c1ccccc1 ZINC000135009249 334112119 /nfs/dbraw/zinc/11/21/19/334112119.db2.gz ZLMRVCNMFQXZAP-AWEZNQCLSA-N 1 1 274.433 4.506 20 0 CJADMO CCCC[N@H+](Cc1nccs1)[C@@H](C)c1ccccc1 ZINC000135009249 334112118 /nfs/dbraw/zinc/11/21/18/334112118.db2.gz ZLMRVCNMFQXZAP-AWEZNQCLSA-N 1 1 274.433 4.506 20 0 CJADMO CCCC[N@@H+](Cc1nccs1)[C@H](C)c1ccccc1 ZINC000135009276 334112198 /nfs/dbraw/zinc/11/21/98/334112198.db2.gz ZLMRVCNMFQXZAP-CQSZACIVSA-N 1 1 274.433 4.506 20 0 CJADMO CCCC[N@H+](Cc1nccs1)[C@H](C)c1ccccc1 ZINC000135009276 334112197 /nfs/dbraw/zinc/11/21/97/334112197.db2.gz ZLMRVCNMFQXZAP-CQSZACIVSA-N 1 1 274.433 4.506 20 0 CJADMO Cc1ccoc1C[NH2+][C@@H](C)c1ccc(Cl)cc1Cl ZINC000135126497 334116840 /nfs/dbraw/zinc/11/68/40/334116840.db2.gz CNWVYKJDMBHBPW-JTQLQIEISA-N 1 1 284.186 4.746 20 0 CJADMO Cc1ccoc1C[NH2+][C@H](C)c1ccc(Cl)cc1Cl ZINC000135126517 334116843 /nfs/dbraw/zinc/11/68/43/334116843.db2.gz CNWVYKJDMBHBPW-SNVBAGLBSA-N 1 1 284.186 4.746 20 0 CJADMO CC[C@H]([NH2+]Cc1nc(C)sc1C)c1ccc(Cl)cc1 ZINC000135131126 334117125 /nfs/dbraw/zinc/11/71/25/334117125.db2.gz UUDAWYURLUDJKL-AWEZNQCLSA-N 1 1 294.851 4.654 20 0 CJADMO CC[C@@H]([NH2+]Cc1nc(C)sc1C)c1ccc(Cl)cc1 ZINC000135131147 334117085 /nfs/dbraw/zinc/11/70/85/334117085.db2.gz UUDAWYURLUDJKL-CQSZACIVSA-N 1 1 294.851 4.654 20 0 CJADMO Cc1cnc([C@@H](C)[NH2+][C@@H](C)c2ccc(C(C)C)cc2)s1 ZINC000135159340 334118398 /nfs/dbraw/zinc/11/83/98/334118398.db2.gz FOWYOUONCJFCAD-UONOGXRCSA-N 1 1 288.460 4.987 20 0 CJADMO Cc1cnc([C@H](C)[NH2+][C@@H](C)c2ccc(C(C)C)cc2)s1 ZINC000135159358 334118516 /nfs/dbraw/zinc/11/85/16/334118516.db2.gz FOWYOUONCJFCAD-KBPBESRZSA-N 1 1 288.460 4.987 20 0 CJADMO Cc1cnc([C@@H](C)[NH2+][C@H](C)c2ccc(C(C)C)cc2)s1 ZINC000135159376 334118583 /nfs/dbraw/zinc/11/85/83/334118583.db2.gz FOWYOUONCJFCAD-ZIAGYGMSSA-N 1 1 288.460 4.987 20 0 CJADMO Cc1cnc([C@H](C)[NH2+][C@H](C)c2ccc(C(C)C)cc2)s1 ZINC000135159398 334118590 /nfs/dbraw/zinc/11/85/90/334118590.db2.gz FOWYOUONCJFCAD-KGLIPLIRSA-N 1 1 288.460 4.987 20 0 CJADMO C[C@H]([NH2+]Cc1cccc(Cl)c1F)c1ccc(F)cc1F ZINC000135376582 334128134 /nfs/dbraw/zinc/12/81/34/334128134.db2.gz GEAPWXDGZPLZEH-VIFPVBQESA-N 1 1 299.723 4.608 20 0 CJADMO C[C@@H]([NH2+]Cc1cccc(Cl)c1F)c1ccc(F)cc1F ZINC000135376602 334128209 /nfs/dbraw/zinc/12/82/09/334128209.db2.gz GEAPWXDGZPLZEH-SECBINFHSA-N 1 1 299.723 4.608 20 0 CJADMO C[C@@H]([NH2+]Cc1ccc([C@H]2C[C@H]2C)o1)c1ccccc1Cl ZINC000148672844 263083868 /nfs/dbraw/zinc/08/38/68/263083868.db2.gz QLGUKCAGXXHIDV-JMSVASOKSA-N 1 1 289.806 4.907 20 0 CJADMO C[C@@H]([NH2+]Cc1ccc([C@H]2C[C@@H]2C)o1)c1ccccc1Cl ZINC000148673035 263083859 /nfs/dbraw/zinc/08/38/59/263083859.db2.gz QLGUKCAGXXHIDV-ZOWXZIJZSA-N 1 1 289.806 4.907 20 0 CJADMO C[C@@H]([NH2+]Cc1ccc([C@@H]2C[C@H]2C)o1)c1ccccc1Cl ZINC000148673221 260965566 /nfs/dbraw/zinc/96/55/66/260965566.db2.gz QLGUKCAGXXHIDV-LALPHHSUSA-N 1 1 289.806 4.907 20 0 CJADMO C[C@@H]([NH2+]Cc1ccc([C@@H]2C[C@@H]2C)o1)c1ccccc1Cl ZINC000148673428 328244962 /nfs/dbraw/zinc/24/49/62/328244962.db2.gz QLGUKCAGXXHIDV-YWPYICTPSA-N 1 1 289.806 4.907 20 0 CJADMO CC[C@H]([NH2+][C@@H]1CCc2c1cccc2Cl)c1nccs1 ZINC000152247689 328082758 /nfs/dbraw/zinc/08/27/58/328082758.db2.gz QMGDQIIEDABSEK-UONOGXRCSA-N 1 1 292.835 4.525 20 0 CJADMO CC[C@@H]([NH2+][C@@H]1CCc2c1cccc2Cl)c1nccs1 ZINC000152247781 328082753 /nfs/dbraw/zinc/08/27/53/328082753.db2.gz QMGDQIIEDABSEK-ZIAGYGMSSA-N 1 1 292.835 4.525 20 0 CJADMO CC[C@H]([NH2+][C@H]1CCc2c1cccc2Cl)c1nccs1 ZINC000152247852 328082877 /nfs/dbraw/zinc/08/28/77/328082877.db2.gz QMGDQIIEDABSEK-KBPBESRZSA-N 1 1 292.835 4.525 20 0 CJADMO CC[C@@H]([NH2+][C@H]1CCc2c1cccc2Cl)c1nccs1 ZINC000152247939 328082966 /nfs/dbraw/zinc/08/29/66/328082966.db2.gz QMGDQIIEDABSEK-KGLIPLIRSA-N 1 1 292.835 4.525 20 0 CJADMO C[C@@H]([NH2+][C@@H](C)c1cccc(Cl)c1Cl)c1ccccn1 ZINC000152325025 327559394 /nfs/dbraw/zinc/55/93/94/327559394.db2.gz QOHBKGPRUUJNNW-WDEREUQCSA-N 1 1 295.213 4.800 20 0 CJADMO C[C@@H]([NH2+][C@@H](C)c1ccc(-c2ccccc2)o1)c1ccccn1 ZINC000152411642 328528975 /nfs/dbraw/zinc/52/89/75/328528975.db2.gz JTHWKWWSNSXKHR-CABCVRRESA-N 1 1 292.382 4.753 20 0 CJADMO c1coc(C[NH+](Cc2cccs2)Cc2cccs2)c1 ZINC000153250861 334575822 /nfs/dbraw/zinc/57/58/22/334575822.db2.gz AWKIYFAJOKSAJU-UHFFFAOYSA-N 1 1 289.425 4.605 20 0 CJADMO CC[C@H]([NH2+][C@@H](C)c1nccs1)c1ccc(Cl)s1 ZINC000153412934 261077767 /nfs/dbraw/zinc/07/77/67/261077767.db2.gz KKSKOGUXLPISOA-IUCAKERBSA-N 1 1 286.853 4.660 20 0 CJADMO CC[C@@H]([NH2+][C@@H](C)c1nccs1)c1ccc(Cl)s1 ZINC000153413038 261077646 /nfs/dbraw/zinc/07/76/46/261077646.db2.gz KKSKOGUXLPISOA-DTWKUNHWSA-N 1 1 286.853 4.660 20 0 CJADMO CC[C@H]([NH2+][C@H](C)c1nccs1)c1ccc(Cl)s1 ZINC000153413156 261077579 /nfs/dbraw/zinc/07/75/79/261077579.db2.gz KKSKOGUXLPISOA-BDAKNGLRSA-N 1 1 286.853 4.660 20 0 CJADMO CC[C@@H]([NH2+][C@H](C)c1nccs1)c1ccc(Cl)s1 ZINC000153413270 261077553 /nfs/dbraw/zinc/07/75/53/261077553.db2.gz KKSKOGUXLPISOA-RKDXNWHRSA-N 1 1 286.853 4.660 20 0 CJADMO Cc1cc(C[NH2+][C@@H](CC(C)C)c2ccc(Cl)cc2)no1 ZINC000153535636 334673148 /nfs/dbraw/zinc/67/31/48/334673148.db2.gz UJZQWYPPNPFPMJ-INIZCTEOSA-N 1 1 292.810 4.513 20 0 CJADMO Cc1cc(C[NH2+][C@H](CC(C)C)c2ccc(Cl)cc2)no1 ZINC000153535743 334673099 /nfs/dbraw/zinc/67/30/99/334673099.db2.gz UJZQWYPPNPFPMJ-MRXNPFEDSA-N 1 1 292.810 4.513 20 0 CJADMO CCc1ccc([C@H](C)[NH2+][C@H](C)c2ccc(F)cc2F)o1 ZINC000153591888 334674302 /nfs/dbraw/zinc/67/43/02/334674302.db2.gz IPPRTUMVKQSAIS-MNOVXSKESA-N 1 1 279.330 4.532 20 0 CJADMO Cc1noc(C)c1C[NH2+][C@H](C)c1cc2cc(C)c(C)cc2o1 ZINC000153919395 261084957 /nfs/dbraw/zinc/08/49/57/261084957.db2.gz MRLDNPOKEYMMLG-CYBMUJFWSA-N 1 1 298.386 4.505 20 0 CJADMO Cc1noc(C)c1C[NH2+][C@@H](C)c1cc2cc(C)c(C)cc2o1 ZINC000153919503 261084901 /nfs/dbraw/zinc/08/49/01/261084901.db2.gz MRLDNPOKEYMMLG-ZDUSSCGKSA-N 1 1 298.386 4.505 20 0 CJADMO C[C@@H]([NH2+][C@@H](C)c1nc(C(C)(C)C)cs1)c1ccccc1 ZINC000153961680 334684137 /nfs/dbraw/zinc/68/41/37/334684137.db2.gz KMSCAKWRYCGZTH-OLZOCXBDSA-N 1 1 288.460 4.852 20 0 CJADMO C[C@@H]([NH2+][C@@H](C)c1nc(C(C)(C)C)cs1)c1cccs1 ZINC000153962564 334684092 /nfs/dbraw/zinc/68/40/92/334684092.db2.gz YORQDZBTKAUIIS-MNOVXSKESA-N 1 1 294.489 4.914 20 0 CJADMO C[C@@H]([NH2+][C@@H](C)c1cccs1)c1nc(C(C)(C)C)cs1 ZINC000153962677 334684108 /nfs/dbraw/zinc/68/41/08/334684108.db2.gz YORQDZBTKAUIIS-WDEREUQCSA-N 1 1 294.489 4.914 20 0 CJADMO C[C@@H]([NH2+][C@H](C)c1nc(C(C)(C)C)cs1)c1cccs1 ZINC000153962747 334684187 /nfs/dbraw/zinc/68/41/87/334684187.db2.gz YORQDZBTKAUIIS-GHMZBOCLSA-N 1 1 294.489 4.914 20 0 CJADMO Cc1ccc([C@@H](C)[NH2+]Cc2csc(C(C)C)n2)cc1F ZINC000154248586 334691386 /nfs/dbraw/zinc/69/13/86/334691386.db2.gz WOAYMWZHTHLIRB-GFCCVEGCSA-N 1 1 292.423 4.565 20 0 CJADMO Cc1ccc([C@H](C)[NH2+][C@@H](c2nc3ccccc3[nH]2)C(C)C)o1 ZINC000154378315 334693639 /nfs/dbraw/zinc/69/36/39/334693639.db2.gz CUEDGVMIMSTOKU-SUMWQHHRSA-N 1 1 297.402 4.512 20 0 CJADMO Cc1ccc([C@@H](C)[NH2+]Cc2cc(-c3ccccc3)on2)s1 ZINC000154741802 334703945 /nfs/dbraw/zinc/70/39/45/334703945.db2.gz WSISQADQVHNCEA-CYBMUJFWSA-N 1 1 298.411 4.562 20 0 CJADMO CC[C@H]([NH2+]Cc1cc(-c2ccccc2)on1)c1ccccc1 ZINC000154764560 334704462 /nfs/dbraw/zinc/70/44/62/334704462.db2.gz LCNVWLVTVCTJQO-SFHVURJKSA-N 1 1 292.382 4.583 20 0 CJADMO Cc1ccc([C@@H](C)[NH2+]Cc2cc(-c3ccccc3)on2)cc1 ZINC000154853034 334705938 /nfs/dbraw/zinc/70/59/38/334705938.db2.gz WDKRJZDMNMODHP-OAHLLOKOSA-N 1 1 292.382 4.501 20 0 CJADMO Cc1ccc([C@H](C)[NH2+]Cc2cc(-c3ccccc3)on2)cc1 ZINC000154853125 334705895 /nfs/dbraw/zinc/70/58/95/334705895.db2.gz WDKRJZDMNMODHP-HNNXBMFYSA-N 1 1 292.382 4.501 20 0 CJADMO Cc1cccc([C@@H](C)[NH2+]Cc2cc(-c3ccccc3)on2)c1 ZINC000154854323 334705821 /nfs/dbraw/zinc/70/58/21/334705821.db2.gz JFOMUNBBYILANT-OAHLLOKOSA-N 1 1 292.382 4.501 20 0 CJADMO Cc1cccc([C@H](C)[NH2+]Cc2cc(-c3ccccc3)on2)c1 ZINC000154854430 518190619 /nfs/dbraw/zinc/19/06/19/518190619.db2.gz JFOMUNBBYILANT-HNNXBMFYSA-N 1 1 292.382 4.501 20 0 CJADMO CCc1nc(C[NH2+][C@@H](CC)c2ccc(CC)cc2)cs1 ZINC000156433600 263097043 /nfs/dbraw/zinc/09/70/43/263097043.db2.gz RLBWRHLTJOOQKF-INIZCTEOSA-N 1 1 288.460 4.509 20 0 CJADMO C[C@H]([NH2+]Cc1cccs1)c1cc(Cl)sc1Cl ZINC000156507196 330736137 /nfs/dbraw/zinc/73/61/37/330736137.db2.gz JYTTZHJWPFFSTG-ZETCQYMHSA-N 1 1 292.256 4.967 20 0 CJADMO C[C@@H]([NH2+]Cc1cccs1)c1cc(Cl)sc1Cl ZINC000156507302 263113037 /nfs/dbraw/zinc/11/30/37/263113037.db2.gz JYTTZHJWPFFSTG-SSDOTTSWSA-N 1 1 292.256 4.967 20 0 CJADMO C[C@@H]([NH2+]Cc1ccc(Cl)cc1F)c1ccc(F)cc1F ZINC000157218262 264235059 /nfs/dbraw/zinc/23/50/59/264235059.db2.gz JRXWTGMHHPJKMN-SECBINFHSA-N 1 1 299.723 4.608 20 0 CJADMO C[C@H]([NH2+]Cc1ccc(Cl)cc1F)c1ccc(F)c(F)c1 ZINC000157219964 264238126 /nfs/dbraw/zinc/23/81/26/264238126.db2.gz UGSORDKOKJXXAX-VIFPVBQESA-N 1 1 299.723 4.608 20 0 CJADMO C[C@@H]([NH2+]Cc1ccc(Cl)cc1F)c1ccc(F)c(F)c1 ZINC000157220130 264237615 /nfs/dbraw/zinc/23/76/15/264237615.db2.gz UGSORDKOKJXXAX-SECBINFHSA-N 1 1 299.723 4.608 20 0 CJADMO CCCCc1ccc([C@H]([NH2+]Cc2ccon2)C(C)C)cc1 ZINC000157357331 334768022 /nfs/dbraw/zinc/76/80/22/334768022.db2.gz RWMYARWDCDPRTH-GOSISDBHSA-N 1 1 286.419 4.504 20 0 CJADMO Cc1cccc(N[C@@H](C)c2ccc(-c3cccnc3)cc2)[nH+]1 ZINC000157834484 524695892 /nfs/dbraw/zinc/69/58/92/524695892.db2.gz LEPWLLCTZMOHTH-HNNXBMFYSA-N 1 1 289.382 4.625 20 0 CJADMO Cc1cccc(N[C@H](C)c2ccc(-c3cccnc3)cc2)[nH+]1 ZINC000157834613 524698342 /nfs/dbraw/zinc/69/83/42/524698342.db2.gz LEPWLLCTZMOHTH-OAHLLOKOSA-N 1 1 289.382 4.625 20 0 CJADMO CC[C@H]([NH2+][C@@H](C)c1ccc(C)o1)c1cc(F)ccc1F ZINC000158118435 522696550 /nfs/dbraw/zinc/69/65/50/522696550.db2.gz QZBOGTQYTFFNBD-NHYWBVRUSA-N 1 1 279.330 4.668 20 0 CJADMO C[C@H]([NH2+][C@@H](C)c1cccc(Cl)c1Cl)c1ccco1 ZINC000160159900 330859981 /nfs/dbraw/zinc/85/99/81/330859981.db2.gz XCXMOQBCHCFNIX-UWVGGRQHSA-N 1 1 284.186 4.998 20 0 CJADMO C[C@@H]([NH2+][C@@H](C)c1cccc(Cl)c1Cl)c1ccco1 ZINC000160160107 330859987 /nfs/dbraw/zinc/85/99/87/330859987.db2.gz XCXMOQBCHCFNIX-VHSXEESVSA-N 1 1 284.186 4.998 20 0 CJADMO C[C@@H]([NH2+][C@H](C)c1cccc(Cl)c1Cl)c1ccco1 ZINC000160160236 330860063 /nfs/dbraw/zinc/86/00/63/330860063.db2.gz XCXMOQBCHCFNIX-NXEZZACHSA-N 1 1 284.186 4.998 20 0 CJADMO CCOc1cccc2cc([C@@H](C)[NH2+][C@@H](C)c3ccco3)oc21 ZINC000161846086 329956751 /nfs/dbraw/zinc/95/67/51/329956751.db2.gz SUBZNIKSIIWSRU-QWHCGFSZSA-N 1 1 299.370 4.836 20 0 CJADMO CCOc1cccc2cc([C@H](C)[NH2+][C@H](C)c3ccco3)oc21 ZINC000161846478 329956893 /nfs/dbraw/zinc/95/68/93/329956893.db2.gz SUBZNIKSIIWSRU-OLZOCXBDSA-N 1 1 299.370 4.836 20 0 CJADMO CCc1nc([C@H](C)[NH2+][C@@H](C)c2ccc(CC)cc2)cs1 ZINC000162288687 327695007 /nfs/dbraw/zinc/69/50/07/327695007.db2.gz MEMJLTAXDWNKOB-STQMWFEESA-N 1 1 288.460 4.680 20 0 CJADMO CCc1nc([C@@H](C)[NH2+][C@@H](C)c2cc(C)sc2C)cs1 ZINC000162289068 261275627 /nfs/dbraw/zinc/27/56/27/261275627.db2.gz CSIBQDQLKXHGNK-WDEREUQCSA-N 1 1 294.489 4.796 20 0 CJADMO CCc1nc([C@H](C)[NH2+][C@@H](C)c2cc(C)sc2C)cs1 ZINC000162289197 261275465 /nfs/dbraw/zinc/27/54/65/261275465.db2.gz CSIBQDQLKXHGNK-QWRGUYRKSA-N 1 1 294.489 4.796 20 0 CJADMO CCc1nc([C@@H](C)[NH2+][C@H](C)c2cc(C)sc2C)cs1 ZINC000162289311 261275259 /nfs/dbraw/zinc/27/52/59/261275259.db2.gz CSIBQDQLKXHGNK-GHMZBOCLSA-N 1 1 294.489 4.796 20 0 CJADMO CCc1nc([C@H](C)[NH2+][C@H](C)c2cc(C)sc2C)cs1 ZINC000162289436 261275745 /nfs/dbraw/zinc/27/57/45/261275745.db2.gz CSIBQDQLKXHGNK-MNOVXSKESA-N 1 1 294.489 4.796 20 0 CJADMO CCc1nc([C@@H](C)[NH2+][C@@H](CC)c2ccc(C)cc2)cs1 ZINC000162289573 329989536 /nfs/dbraw/zinc/98/95/36/329989536.db2.gz JRYRVRSLPLKYAQ-HIFRSBDPSA-N 1 1 288.460 4.816 20 0 CJADMO CCc1nc([C@H](C)[NH2+][C@@H](CC)c2ccc(C)cc2)cs1 ZINC000162289702 329989934 /nfs/dbraw/zinc/98/99/34/329989934.db2.gz JRYRVRSLPLKYAQ-ZFWWWQNUSA-N 1 1 288.460 4.816 20 0 CJADMO CCc1nc([C@H](C)[NH2+][C@H](CC)c2ccc(C)cc2)cs1 ZINC000162289961 329989918 /nfs/dbraw/zinc/98/99/18/329989918.db2.gz JRYRVRSLPLKYAQ-DZGCQCFKSA-N 1 1 288.460 4.816 20 0 CJADMO CC(C)C[C@@H]([NH2+][C@@H](C)c1cscn1)c1ccccc1 ZINC000162321257 260257079 /nfs/dbraw/zinc/25/70/79/260257079.db2.gz YDCRXRKEHKOTNW-DZGCQCFKSA-N 1 1 274.433 4.581 20 0 CJADMO CC(C)C[C@H]([NH2+][C@H](C)c1cscn1)c1ccccc1 ZINC000162321415 260256950 /nfs/dbraw/zinc/25/69/50/260256950.db2.gz YDCRXRKEHKOTNW-HIFRSBDPSA-N 1 1 274.433 4.581 20 0 CJADMO CC(C)C[C@@H]([NH2+][C@H](C)c1cscn1)c1ccccc1 ZINC000162321533 330902350 /nfs/dbraw/zinc/90/23/50/330902350.db2.gz YDCRXRKEHKOTNW-UKRRQHHQSA-N 1 1 274.433 4.581 20 0 CJADMO CCc1nc([C@@H](C)[NH2+][C@@H](C)c2ccc(C)c(C)c2)cs1 ZINC000162330429 330000155 /nfs/dbraw/zinc/00/01/55/330000155.db2.gz YNBPMBQXVZGWCE-UONOGXRCSA-N 1 1 288.460 4.734 20 0 CJADMO CCc1nc([C@H](C)[NH2+][C@@H](C)c2ccc(C)c(C)c2)cs1 ZINC000162330559 330000202 /nfs/dbraw/zinc/00/02/02/330000202.db2.gz YNBPMBQXVZGWCE-KBPBESRZSA-N 1 1 288.460 4.734 20 0 CJADMO CCc1nc([C@@H](C)[NH2+][C@H](C)c2ccc(C)c(C)c2)cs1 ZINC000162330667 330000198 /nfs/dbraw/zinc/00/01/98/330000198.db2.gz YNBPMBQXVZGWCE-ZIAGYGMSSA-N 1 1 288.460 4.734 20 0 CJADMO CCc1nc([C@H](C)[NH2+][C@H](C)c2ccc(C)c(C)c2)cs1 ZINC000162330793 330000243 /nfs/dbraw/zinc/00/02/43/330000243.db2.gz YNBPMBQXVZGWCE-KGLIPLIRSA-N 1 1 288.460 4.734 20 0 CJADMO CCc1nc([C@@H](C)[NH2+][C@@H](CC)c2cccs2)cs1 ZINC000162335029 329999221 /nfs/dbraw/zinc/99/92/21/329999221.db2.gz CNAPUOQSRKPHFE-MNOVXSKESA-N 1 1 280.462 4.569 20 0 CJADMO CCc1nc([C@H](C)[NH2+][C@@H](CC)c2cccs2)cs1 ZINC000162335169 329999328 /nfs/dbraw/zinc/99/93/28/329999328.db2.gz CNAPUOQSRKPHFE-QWRGUYRKSA-N 1 1 280.462 4.569 20 0 CJADMO CC[C@H]([NH2+][C@@H](C)c1cscn1)c1ccc(Cl)cc1 ZINC000162347840 261278479 /nfs/dbraw/zinc/27/84/79/261278479.db2.gz MFMHCZRZERQQGV-GWCFXTLKSA-N 1 1 280.824 4.598 20 0 CJADMO CC[C@@H]([NH2+][C@@H](C)c1cscn1)c1ccc(Cl)cc1 ZINC000162347928 261278320 /nfs/dbraw/zinc/27/83/20/261278320.db2.gz MFMHCZRZERQQGV-GXFFZTMASA-N 1 1 280.824 4.598 20 0 CJADMO CC[C@H]([NH2+][C@H](C)c1cscn1)c1ccc(Cl)cc1 ZINC000162348011 261278582 /nfs/dbraw/zinc/27/85/82/261278582.db2.gz MFMHCZRZERQQGV-MFKMUULPSA-N 1 1 280.824 4.598 20 0 CJADMO CC[C@@H]([NH2+][C@H](C)c1cscn1)c1ccc(Cl)cc1 ZINC000162348111 261278436 /nfs/dbraw/zinc/27/84/36/261278436.db2.gz MFMHCZRZERQQGV-ZWNOBZJWSA-N 1 1 280.824 4.598 20 0 CJADMO C[C@H]([NH2+][C@H](c1ccccc1)C(C)(C)C)c1cscn1 ZINC000162356432 525597303 /nfs/dbraw/zinc/59/73/03/525597303.db2.gz KTRXPBNANSSBMN-SWLSCSKDSA-N 1 1 274.433 4.581 20 0 CJADMO CC[C@H]([NH2+][C@@H](C)c1cscn1)c1cccc(Cl)c1 ZINC000162359775 261278346 /nfs/dbraw/zinc/27/83/46/261278346.db2.gz BRYGVUZGPQNPIP-GWCFXTLKSA-N 1 1 280.824 4.598 20 0 CJADMO CC[C@@H]([NH2+][C@@H](C)c1cscn1)c1cccc(Cl)c1 ZINC000162359906 261278355 /nfs/dbraw/zinc/27/83/55/261278355.db2.gz BRYGVUZGPQNPIP-GXFFZTMASA-N 1 1 280.824 4.598 20 0 CJADMO CC[C@H]([NH2+][C@H](C)c1cscn1)c1cccc(Cl)c1 ZINC000162360025 261278720 /nfs/dbraw/zinc/27/87/20/261278720.db2.gz BRYGVUZGPQNPIP-MFKMUULPSA-N 1 1 280.824 4.598 20 0 CJADMO CC[C@@H]([NH2+][C@H](C)c1cscn1)c1cccc(Cl)c1 ZINC000162360160 261278245 /nfs/dbraw/zinc/27/82/45/261278245.db2.gz BRYGVUZGPQNPIP-ZWNOBZJWSA-N 1 1 280.824 4.598 20 0 CJADMO CCc1nc([C@@H](C)[NH2+][C@@H](C)c2ccc(C)cc2C)cs1 ZINC000162377520 330005757 /nfs/dbraw/zinc/00/57/57/330005757.db2.gz NECDQMZBIXODEV-UONOGXRCSA-N 1 1 288.460 4.734 20 0 CJADMO CCc1nc([C@H](C)[NH2+][C@@H](C)c2ccc(C)cc2C)cs1 ZINC000162377655 330005766 /nfs/dbraw/zinc/00/57/66/330005766.db2.gz NECDQMZBIXODEV-KBPBESRZSA-N 1 1 288.460 4.734 20 0 CJADMO CCc1nc([C@@H](C)[NH2+][C@H](C)c2ccc(C)cc2C)cs1 ZINC000162377794 330005798 /nfs/dbraw/zinc/00/57/98/330005798.db2.gz NECDQMZBIXODEV-ZIAGYGMSSA-N 1 1 288.460 4.734 20 0 CJADMO CCc1nc([C@H](C)[NH2+][C@H](C)c2ccc(C)cc2C)cs1 ZINC000162377918 330005752 /nfs/dbraw/zinc/00/57/52/330005752.db2.gz NECDQMZBIXODEV-KGLIPLIRSA-N 1 1 288.460 4.734 20 0 CJADMO C[C@H]([NH2+][C@H](c1ccc(F)cc1)C(C)(C)C)c1cscn1 ZINC000162398215 330909693 /nfs/dbraw/zinc/90/96/93/330909693.db2.gz BCDYQOREITTYPA-XHDPSFHLSA-N 1 1 292.423 4.720 20 0 CJADMO C[C@@H]([NH2+][C@H](c1ccc(F)cc1)C(C)(C)C)c1cscn1 ZINC000162398359 260313915 /nfs/dbraw/zinc/31/39/15/260313915.db2.gz BCDYQOREITTYPA-IAQYHMDHSA-N 1 1 292.423 4.720 20 0 CJADMO CCc1ccc([C@@H](C)[NH2+][C@@H](C)c2csc(CC)n2)s1 ZINC000162420345 261281091 /nfs/dbraw/zinc/28/10/91/261281091.db2.gz JRMMHVQIZIULQF-WDEREUQCSA-N 1 1 294.489 4.741 20 0 CJADMO CCc1ccc([C@H](C)[NH2+][C@@H](C)c2csc(CC)n2)s1 ZINC000162420501 261281415 /nfs/dbraw/zinc/28/14/15/261281415.db2.gz JRMMHVQIZIULQF-QWRGUYRKSA-N 1 1 294.489 4.741 20 0 CJADMO CCc1ccc([C@@H](C)[NH2+][C@H](C)c2csc(CC)n2)s1 ZINC000162420638 261281221 /nfs/dbraw/zinc/28/12/21/261281221.db2.gz JRMMHVQIZIULQF-GHMZBOCLSA-N 1 1 294.489 4.741 20 0 CJADMO CCc1ccc([C@H](C)[NH2+][C@H](C)c2csc(CC)n2)s1 ZINC000162420768 261281365 /nfs/dbraw/zinc/28/13/65/261281365.db2.gz JRMMHVQIZIULQF-MNOVXSKESA-N 1 1 294.489 4.741 20 0 CJADMO Cc1csc([C@H](C)[NH2+][C@H](C)c2cc(C)c(F)c(C)c2)n1 ZINC000162426830 330028161 /nfs/dbraw/zinc/02/81/61/330028161.db2.gz BABLPYMKRLPRJP-OLZOCXBDSA-N 1 1 292.423 4.619 20 0 CJADMO Cc1csc([C@H](C)[NH2+][C@@H](C)c2cc(C)c(F)c(C)c2)n1 ZINC000162426934 330028220 /nfs/dbraw/zinc/02/82/20/330028220.db2.gz BABLPYMKRLPRJP-STQMWFEESA-N 1 1 292.423 4.619 20 0 CJADMO Cc1csc([C@@H](C)[NH2+][C@H](C)c2cc(C)c(F)c(C)c2)n1 ZINC000162427033 330028281 /nfs/dbraw/zinc/02/82/81/330028281.db2.gz BABLPYMKRLPRJP-CHWSQXEVSA-N 1 1 292.423 4.619 20 0 CJADMO Cc1csc([C@@H](C)[NH2+][C@@H](C)c2cc(C)c(F)c(C)c2)n1 ZINC000162427165 330028290 /nfs/dbraw/zinc/02/82/90/330028290.db2.gz BABLPYMKRLPRJP-QWHCGFSZSA-N 1 1 292.423 4.619 20 0 CJADMO CC(C)c1ncc(C[N@H+]2CCC[C@@H]2c2cccs2)s1 ZINC000162684213 330109684 /nfs/dbraw/zinc/10/96/84/330109684.db2.gz CDOIRJYOUCQKFP-CYBMUJFWSA-N 1 1 292.473 4.665 20 0 CJADMO CC(C)c1ncc(C[N@H+]2CCC[C@H]2c2cccs2)s1 ZINC000162684360 330109698 /nfs/dbraw/zinc/10/96/98/330109698.db2.gz CDOIRJYOUCQKFP-ZDUSSCGKSA-N 1 1 292.473 4.665 20 0 CJADMO c1csc([C@H]2CCC[N@@H+]2Cc2ccc3ncccc3c2)c1 ZINC000162696455 330108234 /nfs/dbraw/zinc/10/82/34/330108234.db2.gz IBFDGBIGCSWPGI-QGZVFWFLSA-N 1 1 294.423 4.633 20 0 CJADMO c1csc([C@@H]2CCC[N@@H+]2Cc2ccc3ncccc3c2)c1 ZINC000162696575 330108338 /nfs/dbraw/zinc/10/83/38/330108338.db2.gz IBFDGBIGCSWPGI-KRWDZBQOSA-N 1 1 294.423 4.633 20 0 CJADMO CC[C@H]([NH2+][C@@H](C)c1ccc(C)o1)c1ccccc1F ZINC000163459370 331041450 /nfs/dbraw/zinc/04/14/50/331041450.db2.gz IMXYOTZDHHPBAM-WFASDCNBSA-N 1 1 261.340 4.529 20 0 CJADMO CC[C@@H]([NH2+][C@@H](C)c1ccc(C)o1)c1ccccc1F ZINC000163459450 331041516 /nfs/dbraw/zinc/04/15/16/331041516.db2.gz IMXYOTZDHHPBAM-SWLSCSKDSA-N 1 1 261.340 4.529 20 0 CJADMO CC[C@H]([NH2+][C@H](C)c1ccc(C)o1)c1ccccc1F ZINC000163459570 331041512 /nfs/dbraw/zinc/04/15/12/331041512.db2.gz IMXYOTZDHHPBAM-DOMZBBRYSA-N 1 1 261.340 4.529 20 0 CJADMO CC[C@@H]([NH2+][C@H](C)c1ccc(C)o1)c1ccccc1F ZINC000163459689 331041424 /nfs/dbraw/zinc/04/14/24/331041424.db2.gz IMXYOTZDHHPBAM-IUODEOHRSA-N 1 1 261.340 4.529 20 0 CJADMO C[C@H](CCCC(F)(F)F)Nc1cccc2cc[nH+]cc21 ZINC000163464865 334868565 /nfs/dbraw/zinc/86/85/65/334868565.db2.gz NVOAULMXDUDBTC-LLVKDONJSA-N 1 1 282.309 4.768 20 0 CJADMO Fc1ccc(CNc2cccc3cc[nH+]cc32)cc1Cl ZINC000163801496 334872657 /nfs/dbraw/zinc/87/26/57/334872657.db2.gz PEIHMOWOMRQARB-UHFFFAOYSA-N 1 1 286.737 4.639 20 0 CJADMO CC(C)Cn1ccnc1C[NH2+][C@H](C)c1ccc(C(C)C)cc1 ZINC000164746488 334886830 /nfs/dbraw/zinc/88/68/30/334886830.db2.gz XIPWOBUZFAHENB-MRXNPFEDSA-N 1 1 299.462 4.513 20 0 CJADMO Cc1ccc(C[NH2+][C@@H](C)c2ccco2)c(OC(C)(C)C)c1 ZINC000165909940 334903753 /nfs/dbraw/zinc/90/37/53/334903753.db2.gz YNKIYJBSFSUYBS-AWEZNQCLSA-N 1 1 287.403 4.616 20 0 CJADMO Cc1cc([C@@H](C)[NH2+]Cc2cccc(F)c2Cl)c(C)o1 ZINC000166351577 331307006 /nfs/dbraw/zinc/30/70/06/331307006.db2.gz BSGAEJVRFMPDKG-SNVBAGLBSA-N 1 1 281.758 4.540 20 0 CJADMO Cc1cc([C@H](C)[NH2+]Cc2cccc(F)c2Cl)c(C)o1 ZINC000166351686 331306956 /nfs/dbraw/zinc/30/69/56/331306956.db2.gz BSGAEJVRFMPDKG-JTQLQIEISA-N 1 1 281.758 4.540 20 0 CJADMO CC[C@H]([NH2+][C@@H](C)c1c(F)cccc1F)c1cccc(F)c1 ZINC000166522454 331307429 /nfs/dbraw/zinc/30/74/29/331307429.db2.gz CDCBFZWANYJNAV-ZBEGNZNMSA-N 1 1 293.332 4.906 20 0 CJADMO CC[C@@H]([NH2+][C@@H](C)c1c(F)cccc1F)c1cccc(F)c1 ZINC000166522575 331307458 /nfs/dbraw/zinc/30/74/58/331307458.db2.gz CDCBFZWANYJNAV-MEDUHNTESA-N 1 1 293.332 4.906 20 0 CJADMO CC[C@H]([NH2+][C@H](C)c1c(F)cccc1F)c1cccc(F)c1 ZINC000166522694 331307419 /nfs/dbraw/zinc/30/74/19/331307419.db2.gz CDCBFZWANYJNAV-BZNIZROVSA-N 1 1 293.332 4.906 20 0 CJADMO CC[C@@H]([NH2+][C@H](C)c1c(F)cccc1F)c1cccc(F)c1 ZINC000166522808 331307400 /nfs/dbraw/zinc/30/74/00/331307400.db2.gz CDCBFZWANYJNAV-BDJLRTHQSA-N 1 1 293.332 4.906 20 0 CJADMO C[C@H]([NH2+]Cc1ccsc1)c1cc(Cl)sc1Cl ZINC000166604388 331307436 /nfs/dbraw/zinc/30/74/36/331307436.db2.gz LDSDJYPQFDMGLF-ZETCQYMHSA-N 1 1 292.256 4.967 20 0 CJADMO C[C@@H]([NH2+]Cc1ccsc1)c1cc(Cl)sc1Cl ZINC000166604498 331307512 /nfs/dbraw/zinc/30/75/12/331307512.db2.gz LDSDJYPQFDMGLF-SSDOTTSWSA-N 1 1 292.256 4.967 20 0 CJADMO CC[C@H](Nc1cccc2cc[nH+]cc21)c1cccc(F)c1 ZINC000166630329 334915466 /nfs/dbraw/zinc/91/54/66/334915466.db2.gz HJVBJVIKQAFSFR-KRWDZBQOSA-N 1 1 280.346 4.937 20 0 CJADMO C[C@H]([NH2+][C@@H](c1ccccc1)c1cccc(F)c1)c1ccco1 ZINC000168551070 334979959 /nfs/dbraw/zinc/97/99/59/334979959.db2.gz XEFZRZNDWLNPGZ-LIRRHRJNSA-N 1 1 295.357 4.859 20 0 CJADMO C[C@@H]([NH2+][C@@H](c1ccccc1)c1cccc(F)c1)c1ccco1 ZINC000168551173 334979996 /nfs/dbraw/zinc/97/99/96/334979996.db2.gz XEFZRZNDWLNPGZ-KUHUBIRLSA-N 1 1 295.357 4.859 20 0 CJADMO C[C@H]([NH2+][C@H](c1ccccc1)c1cccc(F)c1)c1ccco1 ZINC000168551261 334980098 /nfs/dbraw/zinc/98/00/98/334980098.db2.gz XEFZRZNDWLNPGZ-IFXJQAMLSA-N 1 1 295.357 4.859 20 0 CJADMO CC[C@H]([NH2+][C@@H](C)c1ccc(F)cc1F)c1ccccc1F ZINC000168744630 260908601 /nfs/dbraw/zinc/90/86/01/260908601.db2.gz FPBRTSNONIRETK-GTNSWQLSSA-N 1 1 293.332 4.906 20 0 CJADMO Fc1ccccc1CNc1cc[nH+]c2ccc(Cl)cc12 ZINC000169932076 333424335 /nfs/dbraw/zinc/42/43/35/333424335.db2.gz SGSGBZPMGIUFAB-UHFFFAOYSA-N 1 1 286.737 4.639 20 0 CJADMO Fc1ccc(CNc2cc[nH+]c3ccc(Cl)cc23)cc1 ZINC000169932081 333424226 /nfs/dbraw/zinc/42/42/26/333424226.db2.gz CQXBRUCUPZGVJH-UHFFFAOYSA-N 1 1 286.737 4.639 20 0 CJADMO C[C@@H](c1nc2ccccc2s1)[N@@H+](C)Cc1cccs1 ZINC000171024126 330126071 /nfs/dbraw/zinc/12/60/71/330126071.db2.gz QLTNAYJILGSNQT-NSHDSACASA-N 1 1 288.441 4.551 20 0 CJADMO C[C@@H](c1nc2ccccc2s1)[N@H+](C)Cc1cccs1 ZINC000171024126 330126070 /nfs/dbraw/zinc/12/60/70/330126070.db2.gz QLTNAYJILGSNQT-NSHDSACASA-N 1 1 288.441 4.551 20 0 CJADMO C[C@H](c1nc2ccccc2s1)[N@@H+](C)Cc1cccs1 ZINC000171024129 330126082 /nfs/dbraw/zinc/12/60/82/330126082.db2.gz QLTNAYJILGSNQT-LLVKDONJSA-N 1 1 288.441 4.551 20 0 CJADMO C[C@H](c1nc2ccccc2s1)[N@H+](C)Cc1cccs1 ZINC000171024129 330126081 /nfs/dbraw/zinc/12/60/81/330126081.db2.gz QLTNAYJILGSNQT-LLVKDONJSA-N 1 1 288.441 4.551 20 0 CJADMO C[C@@H](c1nc2ccccc2s1)[N@@H+](C)Cc1ccsc1 ZINC000171118974 335055621 /nfs/dbraw/zinc/05/56/21/335055621.db2.gz LFKBCIPTCCUAFB-NSHDSACASA-N 1 1 288.441 4.551 20 0 CJADMO C[C@@H](c1nc2ccccc2s1)[N@H+](C)Cc1ccsc1 ZINC000171118974 335055620 /nfs/dbraw/zinc/05/56/20/335055620.db2.gz LFKBCIPTCCUAFB-NSHDSACASA-N 1 1 288.441 4.551 20 0 CJADMO C[C@H](c1nc2ccccc2s1)[N@@H+](C)Cc1ccsc1 ZINC000171118977 335055634 /nfs/dbraw/zinc/05/56/34/335055634.db2.gz LFKBCIPTCCUAFB-LLVKDONJSA-N 1 1 288.441 4.551 20 0 CJADMO C[C@H](c1nc2ccccc2s1)[N@H+](C)Cc1ccsc1 ZINC000171118977 335055633 /nfs/dbraw/zinc/05/56/33/335055633.db2.gz LFKBCIPTCCUAFB-LLVKDONJSA-N 1 1 288.441 4.551 20 0 CJADMO CCC[N@H+]1Cc2cccc(N[C@@H](C)c3ccccc3)c2C1 ZINC000171125303 335055896 /nfs/dbraw/zinc/05/58/96/335055896.db2.gz DPUBBBPIEOWBMT-HNNXBMFYSA-N 1 1 280.415 4.585 20 0 CJADMO Clc1ccc([C@@H]([NH2+]Cc2ccoc2)c2ccccc2)cc1 ZINC000171127151 327643735 /nfs/dbraw/zinc/64/37/35/327643735.db2.gz ZWANHNJHMFPTQQ-SFHVURJKSA-N 1 1 297.785 4.812 20 0 CJADMO c1ccc2sc([C@@H]3CCC[N@H+]3[C@H]3C=CCCC3)nc2c1 ZINC000171278407 330125732 /nfs/dbraw/zinc/12/57/32/330125732.db2.gz KSCCGDNMIHXMLK-ZFWWWQNUSA-N 1 1 284.428 4.542 20 0 CJADMO c1ccc2sc([C@H]3CCC[N@H+]3[C@H]3C=CCCC3)nc2c1 ZINC000171278413 330125755 /nfs/dbraw/zinc/12/57/55/330125755.db2.gz KSCCGDNMIHXMLK-DZGCQCFKSA-N 1 1 284.428 4.542 20 0 CJADMO Cc1cc(C[N@H+](C)[C@@H](C)c2sc(C)nc2C)c(C)s1 ZINC000171590931 329077749 /nfs/dbraw/zinc/07/77/49/329077749.db2.gz WAISFCBQEXDQQN-NSHDSACASA-N 1 1 294.489 4.631 20 0 CJADMO Cc1cc(C[N@H+](C)[C@H](C)c2sc(C)nc2C)c(C)s1 ZINC000171590935 329077659 /nfs/dbraw/zinc/07/76/59/329077659.db2.gz WAISFCBQEXDQQN-LLVKDONJSA-N 1 1 294.489 4.631 20 0 CJADMO CCCc1ccc(C[NH2+][C@@H](C)c2csc(CC)n2)cc1 ZINC000171786616 335079888 /nfs/dbraw/zinc/07/98/88/335079888.db2.gz OKHZIFRYJNZQTM-ZDUSSCGKSA-N 1 1 288.460 4.509 20 0 CJADMO CCCc1ccc(C[NH2+][C@H](C)c2csc(CC)n2)cc1 ZINC000171786619 335079945 /nfs/dbraw/zinc/07/99/45/335079945.db2.gz OKHZIFRYJNZQTM-CYBMUJFWSA-N 1 1 288.460 4.509 20 0 CJADMO C[C@@H](c1ccncc1)[N@@H+](C)Cc1ccc(Cl)cc1Cl ZINC000171912286 335084541 /nfs/dbraw/zinc/08/45/41/335084541.db2.gz WVGGPHRGWKHZBR-NSHDSACASA-N 1 1 295.213 4.581 20 0 CJADMO C[C@@H](c1ccncc1)[N@H+](C)Cc1ccc(Cl)cc1Cl ZINC000171912286 335084539 /nfs/dbraw/zinc/08/45/39/335084539.db2.gz WVGGPHRGWKHZBR-NSHDSACASA-N 1 1 295.213 4.581 20 0 CJADMO C[C@H](c1ccncc1)[N@@H+](C)Cc1ccc(Cl)cc1Cl ZINC000171912289 335084453 /nfs/dbraw/zinc/08/44/53/335084453.db2.gz WVGGPHRGWKHZBR-LLVKDONJSA-N 1 1 295.213 4.581 20 0 CJADMO C[C@H](c1ccncc1)[N@H+](C)Cc1ccc(Cl)cc1Cl ZINC000171912289 335084452 /nfs/dbraw/zinc/08/44/52/335084452.db2.gz WVGGPHRGWKHZBR-LLVKDONJSA-N 1 1 295.213 4.581 20 0 CJADMO C[C@@H](c1ccncc1)[N@@H+](C)Cc1cc(Cl)cc(Cl)c1 ZINC000171947190 335085961 /nfs/dbraw/zinc/08/59/61/335085961.db2.gz BNAHIRKWVQEYDF-NSHDSACASA-N 1 1 295.213 4.581 20 0 CJADMO C[C@H](c1ccncc1)[N@@H+](C)Cc1cc(Cl)cc(Cl)c1 ZINC000171947192 335086033 /nfs/dbraw/zinc/08/60/33/335086033.db2.gz BNAHIRKWVQEYDF-LLVKDONJSA-N 1 1 295.213 4.581 20 0 CJADMO C[C@@H](c1ccccc1)[N@H+](Cc1cscn1)CC1CCC1 ZINC000172553456 335109304 /nfs/dbraw/zinc/10/93/04/335109304.db2.gz CVXYXKSFXMDDSK-AWEZNQCLSA-N 1 1 286.444 4.506 20 0 CJADMO C[C@H](c1ccccc1)[N@H+](Cc1cscn1)CC1CCC1 ZINC000172553460 335109432 /nfs/dbraw/zinc/10/94/32/335109432.db2.gz CVXYXKSFXMDDSK-CQSZACIVSA-N 1 1 286.444 4.506 20 0 CJADMO CC(C)n1ccc(C[NH2+][C@@H](C)c2ccc(C(C)(C)C)cc2)n1 ZINC000173432146 335134657 /nfs/dbraw/zinc/13/46/57/335134657.db2.gz WCHLOFQISJIOEJ-HNNXBMFYSA-N 1 1 299.462 4.612 20 0 CJADMO CC(C)n1ccc(C[NH2+][C@H](C)c2ccc(C(C)(C)C)cc2)n1 ZINC000173432157 335134535 /nfs/dbraw/zinc/13/45/35/335134535.db2.gz WCHLOFQISJIOEJ-OAHLLOKOSA-N 1 1 299.462 4.612 20 0 CJADMO Cc1cnc(C[NH2+][C@@H](C)c2ccc(C(C)(C)C)cc2)s1 ZINC000173448590 261163985 /nfs/dbraw/zinc/16/39/85/261163985.db2.gz UZDAGPYPMSCLTL-ZDUSSCGKSA-N 1 1 288.460 4.600 20 0 CJADMO C[C@H]([NH2+][C@@H](C)c1ccccc1)c1ncc(-c2ccccc2)o1 ZINC000173791008 329152449 /nfs/dbraw/zinc/15/24/49/329152449.db2.gz HBTBNKFBWJMSNN-GJZGRUSLSA-N 1 1 292.382 4.753 20 0 CJADMO C[C@@H]([NH2+][C@@H](C)c1ncc(-c2ccccc2)o1)c1ccccc1 ZINC000173791020 329152441 /nfs/dbraw/zinc/15/24/41/329152441.db2.gz HBTBNKFBWJMSNN-CABCVRRESA-N 1 1 292.382 4.753 20 0 CJADMO C[C@@H]([NH2+][C@@H](C)c1ccccc1)c1ncc(-c2ccccc2)o1 ZINC000173791032 329152240 /nfs/dbraw/zinc/15/22/40/329152240.db2.gz HBTBNKFBWJMSNN-LSDHHAIUSA-N 1 1 292.382 4.753 20 0 CJADMO C[C@@H]([NH2+][C@H](C)c1ccccc1)c1ncc(-c2ccccc2)o1 ZINC000173791043 329152437 /nfs/dbraw/zinc/15/24/37/329152437.db2.gz HBTBNKFBWJMSNN-HUUCEWRRSA-N 1 1 292.382 4.753 20 0 CJADMO Cc1ccccc1C[NH2+][C@@H](C)c1ncc(-c2ccccc2)o1 ZINC000173816293 329152666 /nfs/dbraw/zinc/15/26/66/329152666.db2.gz GWMRPVNUULWFPR-HNNXBMFYSA-N 1 1 292.382 4.501 20 0 CJADMO Cc1ccccc1C[NH2+][C@H](C)c1ncc(-c2ccccc2)o1 ZINC000173816305 329152515 /nfs/dbraw/zinc/15/25/15/329152515.db2.gz GWMRPVNUULWFPR-OAHLLOKOSA-N 1 1 292.382 4.501 20 0 CJADMO Cc1cccc([C@@H](C)[NH2+]Cc2coc(-c3cccs3)n2)c1 ZINC000173847977 335141839 /nfs/dbraw/zinc/14/18/39/335141839.db2.gz IGNDIBMZNXAXCY-CYBMUJFWSA-N 1 1 298.411 4.562 20 0 CJADMO Cc1cccc([C@H](C)[NH2+]Cc2coc(-c3cccs3)n2)c1 ZINC000173847988 335141876 /nfs/dbraw/zinc/14/18/76/335141876.db2.gz IGNDIBMZNXAXCY-ZDUSSCGKSA-N 1 1 298.411 4.562 20 0 CJADMO Cc1cccc(C[NH2+][C@@H](C)c2ncc(-c3ccccc3)o2)c1 ZINC000173880467 329153292 /nfs/dbraw/zinc/15/32/92/329153292.db2.gz VWYSHNJTEPTKBI-HNNXBMFYSA-N 1 1 292.382 4.501 20 0 CJADMO Cc1cccc(C[NH2+][C@H](C)c2ncc(-c3ccccc3)o2)c1 ZINC000173880482 329153475 /nfs/dbraw/zinc/15/34/75/329153475.db2.gz VWYSHNJTEPTKBI-OAHLLOKOSA-N 1 1 292.382 4.501 20 0 CJADMO Cc1cccc([C@@H](C)[NH2+]Cc2coc(-c3ccccc3)n2)c1 ZINC000174178766 335150129 /nfs/dbraw/zinc/15/01/29/335150129.db2.gz HDOOLBMUEAMHFR-OAHLLOKOSA-N 1 1 292.382 4.501 20 0 CJADMO Cc1cccc([C@H](C)[NH2+]Cc2coc(-c3ccccc3)n2)c1 ZINC000174178777 335150078 /nfs/dbraw/zinc/15/00/78/335150078.db2.gz HDOOLBMUEAMHFR-HNNXBMFYSA-N 1 1 292.382 4.501 20 0 CJADMO C[C@@H](c1ncc(C(C)(C)C)o1)[N@H+]1CC[C@H](c2ccccc2)C1 ZINC000175137332 333015239 /nfs/dbraw/zinc/01/52/39/333015239.db2.gz FPNNBQBKXSFDEQ-HOCLYGCPSA-N 1 1 298.430 4.523 20 0 CJADMO C[C@H](c1ncc(C(C)(C)C)o1)[N@H+]1CC[C@H](c2ccccc2)C1 ZINC000175137349 333015355 /nfs/dbraw/zinc/01/53/55/333015355.db2.gz FPNNBQBKXSFDEQ-ZBFHGGJFSA-N 1 1 298.430 4.523 20 0 CJADMO CC[C@@H](C)[N@@H+](C)Cc1nc(C)c(-c2ccc(Cl)cc2)o1 ZINC000176854639 333049187 /nfs/dbraw/zinc/04/91/87/333049187.db2.gz VCSYUESTMWFKSA-LLVKDONJSA-N 1 1 292.810 4.534 20 0 CJADMO CC[C@H](C)[N@@H+](C)Cc1nc(C)c(-c2ccc(Cl)cc2)o1 ZINC000176854653 333049199 /nfs/dbraw/zinc/04/91/99/333049199.db2.gz VCSYUESTMWFKSA-NSHDSACASA-N 1 1 292.810 4.534 20 0 CJADMO C[C@@H](c1ccccn1)[N@@H+](C)Cc1ccc(Cl)c(Cl)c1 ZINC000176984706 335351986 /nfs/dbraw/zinc/35/19/86/335351986.db2.gz APKKPHHELHCIEY-NSHDSACASA-N 1 1 295.213 4.581 20 0 CJADMO C[C@H](c1ccccn1)[N@@H+](C)Cc1ccc(Cl)c(Cl)c1 ZINC000176984720 335351991 /nfs/dbraw/zinc/35/19/91/335351991.db2.gz APKKPHHELHCIEY-LLVKDONJSA-N 1 1 295.213 4.581 20 0 CJADMO CC(C)n1cc([C@@H](C)[NH2+][C@@H](C)c2ccccc2Cl)cn1 ZINC000177329446 327788861 /nfs/dbraw/zinc/78/88/61/327788861.db2.gz XWCMQUOSUAHWFH-OLZOCXBDSA-N 1 1 291.826 4.529 20 0 CJADMO CC(C)n1cc([C@H](C)[NH2+][C@@H](C)c2ccccc2Cl)cn1 ZINC000177329465 327788940 /nfs/dbraw/zinc/78/89/40/327788940.db2.gz XWCMQUOSUAHWFH-STQMWFEESA-N 1 1 291.826 4.529 20 0 CJADMO Cc1ccccc1[C@@H](C)[NH2+][C@@H](C)c1ncc(C(C)(C)C)o1 ZINC000177411246 261699953 /nfs/dbraw/zinc/69/99/53/261699953.db2.gz UADGXJDNTZQHKM-KGLIPLIRSA-N 1 1 286.419 4.692 20 0 CJADMO C[C@H]([NH2+][C@H](c1ccccc1)c1ccc(F)cc1)c1ccoc1 ZINC000177766697 335402306 /nfs/dbraw/zinc/40/23/06/335402306.db2.gz QAVZPTXQGRHTEV-IFXJQAMLSA-N 1 1 295.357 4.859 20 0 CJADMO C[C@H]([NH2+][C@@H](C)c1nc(C(C)(C)C)cs1)c1ccsc1 ZINC000177947367 333066108 /nfs/dbraw/zinc/06/61/08/333066108.db2.gz VDGPEQZQVXSNAL-QWRGUYRKSA-N 1 1 294.489 4.914 20 0 CJADMO C[C@@H]([NH2+][C@@H](C)c1nc(C(C)(C)C)cs1)c1ccsc1 ZINC000177947378 333066116 /nfs/dbraw/zinc/06/61/16/333066116.db2.gz VDGPEQZQVXSNAL-MNOVXSKESA-N 1 1 294.489 4.914 20 0 CJADMO C[C@@H]([NH2+][C@@H](C)c1ccsc1)c1nc(C(C)(C)C)cs1 ZINC000177947393 333066122 /nfs/dbraw/zinc/06/61/22/333066122.db2.gz VDGPEQZQVXSNAL-WDEREUQCSA-N 1 1 294.489 4.914 20 0 CJADMO C[C@@H]([NH2+][C@H](C)c1nc(C(C)(C)C)cs1)c1ccsc1 ZINC000177947408 333066027 /nfs/dbraw/zinc/06/60/27/333066027.db2.gz VDGPEQZQVXSNAL-GHMZBOCLSA-N 1 1 294.489 4.914 20 0 CJADMO C[C@H]([NH2+]Cc1ccccc1Cl)c1ccc2ccccc2n1 ZINC000178041943 333067180 /nfs/dbraw/zinc/06/71/80/333067180.db2.gz LOQPBDIDXIEKHM-ZDUSSCGKSA-N 1 1 296.801 4.739 20 0 CJADMO C[C@@H]([NH2+]Cc1ccccc1Cl)c1ccc2ccccc2n1 ZINC000178041956 333067132 /nfs/dbraw/zinc/06/71/32/333067132.db2.gz LOQPBDIDXIEKHM-CYBMUJFWSA-N 1 1 296.801 4.739 20 0 CJADMO Cc1ccc(C[NH2+][C@@H](C)c2ccoc2)c(OC(C)(C)C)c1 ZINC000178376863 335428090 /nfs/dbraw/zinc/42/80/90/335428090.db2.gz PCTQZNSHVBUXIR-AWEZNQCLSA-N 1 1 287.403 4.616 20 0 CJADMO C[C@H]([NH2+][C@@H](c1ccccc1)c1cccc(F)c1)c1ccoc1 ZINC000178433116 335432040 /nfs/dbraw/zinc/43/20/40/335432040.db2.gz JFZFIFUGIIOGNZ-LIRRHRJNSA-N 1 1 295.357 4.859 20 0 CJADMO C[C@@H]([NH2+][C@@H](c1ccccc1)c1cccc(F)c1)c1ccoc1 ZINC000178433129 335431997 /nfs/dbraw/zinc/43/19/97/335431997.db2.gz JFZFIFUGIIOGNZ-KUHUBIRLSA-N 1 1 295.357 4.859 20 0 CJADMO C[C@H]([NH2+][C@H](c1ccccc1)c1cccc(F)c1)c1ccoc1 ZINC000178433140 335432024 /nfs/dbraw/zinc/43/20/24/335432024.db2.gz JFZFIFUGIIOGNZ-IFXJQAMLSA-N 1 1 295.357 4.859 20 0 CJADMO CC[C@@H](C)Oc1cc(C)ccc1C[NH2+][C@@H](C)c1ccoc1 ZINC000178441917 335432235 /nfs/dbraw/zinc/43/22/35/335432235.db2.gz QHBVKYSGEACHEU-CABCVRRESA-N 1 1 287.403 4.616 20 0 CJADMO CC[C@H](C)Oc1cc(C)ccc1C[NH2+][C@@H](C)c1ccoc1 ZINC000178441929 335432296 /nfs/dbraw/zinc/43/22/96/335432296.db2.gz QHBVKYSGEACHEU-GJZGRUSLSA-N 1 1 287.403 4.616 20 0 CJADMO CC[C@H](C)Oc1cc(C)ccc1C[NH2+][C@H](C)c1ccoc1 ZINC000178441950 335432210 /nfs/dbraw/zinc/43/22/10/335432210.db2.gz QHBVKYSGEACHEU-LSDHHAIUSA-N 1 1 287.403 4.616 20 0 CJADMO C[C@@H]([NH2+][C@H](C)c1cccc(Cl)c1Cl)c1ccoc1 ZINC000178449696 335432465 /nfs/dbraw/zinc/43/24/65/335432465.db2.gz AAWQEAYTLGLROS-NXEZZACHSA-N 1 1 284.186 4.998 20 0 CJADMO CCC[C@H]([NH2+][C@@H](C)c1ccoc1)c1ccc(F)cc1F ZINC000178459648 335433082 /nfs/dbraw/zinc/43/30/82/335433082.db2.gz AVVWJDGEHDZMGD-ZBEGNZNMSA-N 1 1 279.330 4.750 20 0 CJADMO CCC[C@@H]([NH2+][C@H](C)c1ccoc1)c1ccc(F)cc1F ZINC000178459680 335432938 /nfs/dbraw/zinc/43/29/38/335432938.db2.gz AVVWJDGEHDZMGD-BDJLRTHQSA-N 1 1 279.330 4.750 20 0 CJADMO CC(C)Cc1ccc([C@@H](C)[NH2+]Cc2ccn(C(C)C)n2)cc1 ZINC000178508703 335434839 /nfs/dbraw/zinc/43/48/39/335434839.db2.gz YHNVDDXLNVHMLI-MRXNPFEDSA-N 1 1 299.462 4.513 20 0 CJADMO CC[C@@H]([NH2+][C@@H](C)c1ccccc1Cl)c1c(C)noc1C ZINC000179119263 335474007 /nfs/dbraw/zinc/47/40/07/335474007.db2.gz XRAANGGQBISQJZ-ZUZCIYMTSA-N 1 1 292.810 4.747 20 0 CJADMO CC(C)(C)C[C@@H]([NH2+]Cc1ccon1)c1ccc(Cl)cc1 ZINC000179710773 335510030 /nfs/dbraw/zinc/51/00/30/335510030.db2.gz RJLLPJLYWJUFFM-OAHLLOKOSA-N 1 1 292.810 4.595 20 0 CJADMO Cc1ccc([C@@H](C)[NH2+]C2(c3ccc(F)cc3F)CCC2)o1 ZINC000179755207 335514972 /nfs/dbraw/zinc/51/49/72/335514972.db2.gz CHSPVSDOSMNCCS-GFCCVEGCSA-N 1 1 291.341 4.596 20 0 CJADMO Cc1ccc([C@H](C)[NH2+]C2(c3ccc(F)cc3F)CCC2)o1 ZINC000179755220 335514983 /nfs/dbraw/zinc/51/49/83/335514983.db2.gz CHSPVSDOSMNCCS-LBPRGKRZSA-N 1 1 291.341 4.596 20 0 CJADMO CC(C)c1[nH+]ccn1Cc1cccc(N[C@@H](C)C(C)C)c1 ZINC000179926688 335532782 /nfs/dbraw/zinc/53/27/82/335532782.db2.gz XSVYJPSTACMVPF-HNNXBMFYSA-N 1 1 285.435 4.511 20 0 CJADMO CC(C)c1[nH+]ccn1Cc1cccc(N[C@H](C)C(C)C)c1 ZINC000179926704 335532764 /nfs/dbraw/zinc/53/27/64/335532764.db2.gz XSVYJPSTACMVPF-OAHLLOKOSA-N 1 1 285.435 4.511 20 0 CJADMO C[C@@H](c1ccc(Cl)cc1)[N@@H+](Cc1cncs1)C1CC1 ZINC000180024213 260089229 /nfs/dbraw/zinc/08/92/29/260089229.db2.gz GBXMDBDAHKAMSH-NSHDSACASA-N 1 1 292.835 4.522 20 0 CJADMO C[C@@H](c1ccc(Cl)cc1)[N@H+](Cc1cncs1)C1CC1 ZINC000180024213 260089228 /nfs/dbraw/zinc/08/92/28/260089228.db2.gz GBXMDBDAHKAMSH-NSHDSACASA-N 1 1 292.835 4.522 20 0 CJADMO C[C@H](c1ccc(Cl)cc1)[N@@H+](Cc1cncs1)C1CC1 ZINC000180024232 260089585 /nfs/dbraw/zinc/08/95/85/260089585.db2.gz GBXMDBDAHKAMSH-LLVKDONJSA-N 1 1 292.835 4.522 20 0 CJADMO C[C@H](c1ccc(Cl)cc1)[N@H+](Cc1cncs1)C1CC1 ZINC000180024232 260089583 /nfs/dbraw/zinc/08/95/83/260089583.db2.gz GBXMDBDAHKAMSH-LLVKDONJSA-N 1 1 292.835 4.522 20 0 CJADMO Cc1ccc([C@@H](C)[NH2+]Cc2ncc(Cl)cc2Cl)cc1 ZINC000180238407 335562309 /nfs/dbraw/zinc/56/23/09/335562309.db2.gz POWDCIXDRMWGHB-LLVKDONJSA-N 1 1 295.213 4.548 20 0 CJADMO Cc1ccc([C@H](C)[NH2+]Cc2ncc(Cl)cc2Cl)cc1 ZINC000180238421 335562323 /nfs/dbraw/zinc/56/23/23/335562323.db2.gz POWDCIXDRMWGHB-NSHDSACASA-N 1 1 295.213 4.548 20 0 CJADMO C[C@@H]([NH2+]C1(c2ccc(Cl)cc2)CCC1)c1nccs1 ZINC000180353752 261855570 /nfs/dbraw/zinc/85/55/70/261855570.db2.gz OAWCQYUYNHQDOJ-LLVKDONJSA-N 1 1 292.835 4.527 20 0 CJADMO C[C@@H]([NH2+][C@@H](C)c1nc(-c2ccccc2)cs1)c1ccoc1 ZINC000180686690 335617511 /nfs/dbraw/zinc/61/75/11/335617511.db2.gz OWIZIWMWSPTVJW-OLZOCXBDSA-N 1 1 298.411 4.815 20 0 CJADMO CC(C)C[C@@H]([NH2+]Cc1nc2ccccc2o1)c1ccccc1 ZINC000180763098 335622704 /nfs/dbraw/zinc/62/27/04/335622704.db2.gz ZVDNPLYFDKVRLZ-QGZVFWFLSA-N 1 1 294.398 4.705 20 0 CJADMO CC(C)[C@@H]([NH2+]Cc1ccco1)c1ccc(Cl)cc1F ZINC000181009164 335747574 /nfs/dbraw/zinc/74/75/74/335747574.db2.gz OAIONQVLJNQKEF-OAHLLOKOSA-N 1 1 281.758 4.559 20 0 CJADMO C[C@H]([NH2+]C(c1cccs1)c1cccs1)c1ccoc1 ZINC000181051094 329225411 /nfs/dbraw/zinc/22/54/11/329225411.db2.gz CUHZLKQFBSTBOE-NSHDSACASA-N 1 1 289.425 4.843 20 0 CJADMO C[C@@H]([NH2+]C(c1cccs1)c1cccs1)c1ccoc1 ZINC000181051113 329225569 /nfs/dbraw/zinc/22/55/69/329225569.db2.gz CUHZLKQFBSTBOE-LLVKDONJSA-N 1 1 289.425 4.843 20 0 CJADMO CC[C@H]([NH2+]Cc1nc2cc(F)ccc2o1)c1ccc(C)cc1 ZINC000181686435 335778508 /nfs/dbraw/zinc/77/85/08/335778508.db2.gz RNPANYWMRAQPPR-HNNXBMFYSA-N 1 1 298.361 4.516 20 0 CJADMO CC[C@@H]([NH2+]Cc1nc2cc(F)ccc2o1)c1ccc(C)cc1 ZINC000181686457 335778632 /nfs/dbraw/zinc/77/86/32/335778632.db2.gz RNPANYWMRAQPPR-OAHLLOKOSA-N 1 1 298.361 4.516 20 0 CJADMO CC(C)(C)c1ccc(C2([NH2+]Cc3ccon3)CCCC2)cc1 ZINC000181691134 335778842 /nfs/dbraw/zinc/77/88/42/335778842.db2.gz XXJROIHWAMBKKM-UHFFFAOYSA-N 1 1 298.430 4.531 20 0 CJADMO CCC[C@H]([NH2+]Cc1nc2cc(F)ccc2o1)c1ccccc1 ZINC000181769909 335784336 /nfs/dbraw/zinc/78/43/36/335784336.db2.gz HTLOVGTVBRWLAQ-HNNXBMFYSA-N 1 1 298.361 4.598 20 0 CJADMO Cc1nc(C[NH2+][C@H](CC2CCCC2)c2ccccc2)oc1C ZINC000181945440 335792034 /nfs/dbraw/zinc/79/20/34/335792034.db2.gz QYYDKPIHVMSGSO-GOSISDBHSA-N 1 1 298.430 4.703 20 0 CJADMO CC(C)(C)C[C@@H]([NH2+]Cc1cocn1)c1ccc(Cl)cc1 ZINC000182067243 261922464 /nfs/dbraw/zinc/92/24/64/261922464.db2.gz CGDYVTMPSOLLSF-OAHLLOKOSA-N 1 1 292.810 4.595 20 0 CJADMO C[C@H]([NH2+]C1(c2ccccc2F)CC1)c1ccc(Cl)s1 ZINC000182242315 335805844 /nfs/dbraw/zinc/80/58/44/335805844.db2.gz BIQLNKNDRLAQOO-JTQLQIEISA-N 1 1 295.810 4.881 20 0 CJADMO Cc1ccc([C@H](C)[NH2+]Cc2cc(-c3cccs3)on2)cc1 ZINC000182316410 335810231 /nfs/dbraw/zinc/81/02/31/335810231.db2.gz PFOFBSKCTCTQPY-ZDUSSCGKSA-N 1 1 298.411 4.562 20 0 CJADMO CCCCc1nc(C[NH2+][C@@H](C)c2ccc(C)cc2)cs1 ZINC000182327222 335810908 /nfs/dbraw/zinc/81/09/08/335810908.db2.gz OEAIIJAGIAFWBP-AWEZNQCLSA-N 1 1 288.460 4.645 20 0 CJADMO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2nc3ccccc3o2)cc1 ZINC000182433575 261938282 /nfs/dbraw/zinc/93/82/82/261938282.db2.gz KTVJQJVIZCDEKB-KBPBESRZSA-N 1 1 280.371 4.548 20 0 CJADMO Cc1cccc([C@@H](C)[NH2+][C@H](C)c2nc3ccccc3o2)c1C ZINC000182448236 261938299 /nfs/dbraw/zinc/93/82/99/261938299.db2.gz SZKGWNOGVMXPAO-HUUCEWRRSA-N 1 1 294.398 4.856 20 0 CJADMO Cc1cc[nH+]c(N[C@H](C)c2cccc(-c3ccncc3)c2)c1 ZINC000182639118 335832868 /nfs/dbraw/zinc/83/28/68/335832868.db2.gz HSONERCTBVYUMR-OAHLLOKOSA-N 1 1 289.382 4.625 20 0 CJADMO CC[N@H+](c1ccc(N[C@@H](C)c2nccs2)cc1)C(C)C ZINC000182772623 261950019 /nfs/dbraw/zinc/95/00/19/261950019.db2.gz GWRONNPMQRRXPU-ZDUSSCGKSA-N 1 1 289.448 4.551 20 0 CJADMO CCCc1nc(C[NH2+][C@@H](C)c2cc(C)cc(C)c2)cs1 ZINC000182873287 335848495 /nfs/dbraw/zinc/84/84/95/335848495.db2.gz NYXSBSHOUPPDHO-AWEZNQCLSA-N 1 1 288.460 4.563 20 0 CJADMO C[C@H]([NH2+][C@@H](C)c1cccc(F)c1F)c1cccc(F)c1F ZINC000183318963 335888364 /nfs/dbraw/zinc/88/83/64/335888364.db2.gz HZVJKOPJJDSLDK-UWVGGRQHSA-N 1 1 297.295 4.655 20 0 CJADMO C[C@@H]([NH2+][C@H](C)c1cccc(F)c1F)c1cccc(F)c1F ZINC000183318997 327819112 /nfs/dbraw/zinc/81/91/12/327819112.db2.gz HZVJKOPJJDSLDK-NXEZZACHSA-N 1 1 297.295 4.655 20 0 CJADMO C[C@H](c1cccs1)[N@@H+](C)Cc1ccc(C(F)F)cc1 ZINC000183926825 333123573 /nfs/dbraw/zinc/12/35/73/333123573.db2.gz CTXOPPYMQKLNSQ-LLVKDONJSA-N 1 1 281.371 4.879 20 0 CJADMO C[C@@H](c1cccc(O)c1)[N@@H+](C)Cc1ccc(C(F)F)cc1 ZINC000183967761 333124162 /nfs/dbraw/zinc/12/41/62/333124162.db2.gz DFWQDRYYUYFOSV-LBPRGKRZSA-N 1 1 291.341 4.523 20 0 CJADMO C[C@H](c1cccc(O)c1)[N@@H+](C)Cc1ccc(C(F)F)cc1 ZINC000183967783 333124251 /nfs/dbraw/zinc/12/42/51/333124251.db2.gz DFWQDRYYUYFOSV-GFCCVEGCSA-N 1 1 291.341 4.523 20 0 CJADMO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1ccc(C(F)F)cc1 ZINC000183983823 262003998 /nfs/dbraw/zinc/00/39/98/262003998.db2.gz IMNMBXUZCMALHI-INIZCTEOSA-N 1 1 290.357 4.602 20 0 CJADMO CC[C@H](c1ccncc1)[N@@H+](C)Cc1ccc(C(F)F)cc1 ZINC000183983840 262003583 /nfs/dbraw/zinc/00/35/83/262003583.db2.gz IMNMBXUZCMALHI-MRXNPFEDSA-N 1 1 290.357 4.602 20 0 CJADMO Cc1cncc([C@@H](C)[NH2+][C@@H](C)c2ccc(F)cc2Cl)c1 ZINC000184361753 262018528 /nfs/dbraw/zinc/01/85/28/262018528.db2.gz UOZGWMUEIOQKPX-NEPJUHHUSA-N 1 1 292.785 4.594 20 0 CJADMO Cc1cncc([C@H](C)[NH2+][C@@H](C)c2ccc(F)cc2Cl)c1 ZINC000184361770 262018102 /nfs/dbraw/zinc/01/81/02/262018102.db2.gz UOZGWMUEIOQKPX-RYUDHWBXSA-N 1 1 292.785 4.594 20 0 CJADMO Cc1cncc([C@@H](C)[NH2+][C@H](C)c2ccc(F)cc2Cl)c1 ZINC000184361788 262018434 /nfs/dbraw/zinc/01/84/34/262018434.db2.gz UOZGWMUEIOQKPX-VXGBXAGGSA-N 1 1 292.785 4.594 20 0 CJADMO Cc1cncc([C@H](C)[NH2+][C@H](C)c2ccc(F)cc2Cl)c1 ZINC000184361805 262018240 /nfs/dbraw/zinc/01/82/40/262018240.db2.gz UOZGWMUEIOQKPX-NWDGAFQWSA-N 1 1 292.785 4.594 20 0 CJADMO Cc1cncc([C@@H](C)[NH2+][C@@H](C)c2c(F)cccc2Cl)c1 ZINC000184411669 262018894 /nfs/dbraw/zinc/01/88/94/262018894.db2.gz SXHQVMCLIOINQX-NEPJUHHUSA-N 1 1 292.785 4.594 20 0 CJADMO Cc1cncc([C@H](C)[NH2+][C@@H](C)c2c(F)cccc2Cl)c1 ZINC000184411687 262019448 /nfs/dbraw/zinc/01/94/48/262019448.db2.gz SXHQVMCLIOINQX-RYUDHWBXSA-N 1 1 292.785 4.594 20 0 CJADMO Cc1cncc([C@@H](C)[NH2+][C@H](C)c2c(F)cccc2Cl)c1 ZINC000184411708 262019436 /nfs/dbraw/zinc/01/94/36/262019436.db2.gz SXHQVMCLIOINQX-VXGBXAGGSA-N 1 1 292.785 4.594 20 0 CJADMO Cc1cncc([C@H](C)[NH2+][C@H](C)c2c(F)cccc2Cl)c1 ZINC000184411727 262019439 /nfs/dbraw/zinc/01/94/39/262019439.db2.gz SXHQVMCLIOINQX-NWDGAFQWSA-N 1 1 292.785 4.594 20 0 CJADMO Fc1cccc(Cl)c1C[NH2+]Cc1ccc(C(F)F)cc1 ZINC000185172003 333136322 /nfs/dbraw/zinc/13/63/22/333136322.db2.gz KMSCKQFDFXSMMX-UHFFFAOYSA-N 1 1 299.723 4.707 20 0 CJADMO C[C@@H](c1ccco1)[N@@H+](C)CC1CCC(C(F)(F)F)CC1 ZINC000185494967 333141751 /nfs/dbraw/zinc/14/17/51/333141751.db2.gz YNDITSKAMBLMJG-HIFPTAJRSA-N 1 1 289.341 4.641 20 0 CJADMO C[C@H](c1ccco1)[N@@H+](C)CC1CCC(C(F)(F)F)CC1 ZINC000185494986 333141868 /nfs/dbraw/zinc/14/18/68/333141868.db2.gz YNDITSKAMBLMJG-PNESKVBLSA-N 1 1 289.341 4.641 20 0 CJADMO CC[C@H]([NH2+][C@@H](C)c1ccccn1)c1cccc(Cl)c1F ZINC000185975465 262074040 /nfs/dbraw/zinc/07/40/40/262074040.db2.gz IWGYBOBUMHLCGW-FZMZJTMJSA-N 1 1 292.785 4.676 20 0 CJADMO CC[C@@H]([NH2+][C@@H](C)c1ccccn1)c1cccc(Cl)c1F ZINC000185975487 262074529 /nfs/dbraw/zinc/07/45/29/262074529.db2.gz IWGYBOBUMHLCGW-SMDDNHRTSA-N 1 1 292.785 4.676 20 0 CJADMO CC[C@H]([NH2+][C@H](C)c1ccccn1)c1cccc(Cl)c1F ZINC000185975504 262074160 /nfs/dbraw/zinc/07/41/60/262074160.db2.gz IWGYBOBUMHLCGW-RISCZKNCSA-N 1 1 292.785 4.676 20 0 CJADMO CC[C@@H]([NH2+][C@H](C)c1ccccn1)c1cccc(Cl)c1F ZINC000185975525 262074327 /nfs/dbraw/zinc/07/43/27/262074327.db2.gz IWGYBOBUMHLCGW-BXUZGUMPSA-N 1 1 292.785 4.676 20 0 CJADMO CCc1ccccc1C[NH2+][C@@H](C)c1csc(C(C)C)n1 ZINC000186352542 333159145 /nfs/dbraw/zinc/15/91/45/333159145.db2.gz FFFWXMILJNCRAA-ZDUSSCGKSA-N 1 1 288.460 4.680 20 0 CJADMO CCc1ccccc1C[NH2+][C@H](C)c1csc(C(C)C)n1 ZINC000186352561 333159265 /nfs/dbraw/zinc/15/92/65/333159265.db2.gz FFFWXMILJNCRAA-CYBMUJFWSA-N 1 1 288.460 4.680 20 0 CJADMO CCCc1cccc(C[NH2+][C@@H](C)c2csc(CC)n2)c1 ZINC000187234723 333168892 /nfs/dbraw/zinc/16/88/92/333168892.db2.gz PPSJXYFERHKNOZ-ZDUSSCGKSA-N 1 1 288.460 4.509 20 0 CJADMO CCCc1cccc(C[NH2+][C@H](C)c2csc(CC)n2)c1 ZINC000187234744 333168856 /nfs/dbraw/zinc/16/88/56/333168856.db2.gz PPSJXYFERHKNOZ-CYBMUJFWSA-N 1 1 288.460 4.509 20 0 CJADMO CCCc1cccc(C[NH2+]Cc2nc(C(C)C)cs2)c1 ZINC000187305172 333169261 /nfs/dbraw/zinc/16/92/61/333169261.db2.gz FENOEZWOXIMCDY-UHFFFAOYSA-N 1 1 288.460 4.509 20 0 CJADMO C[C@@H]([NH2+][C@@H](C)c1cccc(Cl)c1F)c1cccc(O)c1 ZINC000187424758 262547551 /nfs/dbraw/zinc/54/75/51/262547551.db2.gz QBMTYZCOHNAILU-MNOVXSKESA-N 1 1 293.769 4.597 20 0 CJADMO CCC[C@H]([NH2+]Cc1ccc(Cl)cc1F)c1ccccn1 ZINC000187578700 263261770 /nfs/dbraw/zinc/26/17/70/263261770.db2.gz GCJVHFKGEJROSI-HNNXBMFYSA-N 1 1 292.785 4.505 20 0 CJADMO CCC[C@@H]([NH2+]Cc1ccc(Cl)cc1F)c1ccccn1 ZINC000187578716 263261754 /nfs/dbraw/zinc/26/17/54/263261754.db2.gz GCJVHFKGEJROSI-OAHLLOKOSA-N 1 1 292.785 4.505 20 0 CJADMO CCC[C@H]([NH2+][C@@H](C)c1nc(C)cs1)c1ccsc1 ZINC000187694557 328300862 /nfs/dbraw/zinc/30/08/62/328300862.db2.gz NKCZAZBIOVWVEX-AAEUAGOBSA-N 1 1 280.462 4.705 20 0 CJADMO CCC[C@@H]([NH2+][C@@H](C)c1nc(C)cs1)c1ccsc1 ZINC000187694576 328301072 /nfs/dbraw/zinc/30/10/72/328301072.db2.gz NKCZAZBIOVWVEX-WCQYABFASA-N 1 1 280.462 4.705 20 0 CJADMO CCC[C@H]([NH2+][C@H](C)c1nc(C)cs1)c1ccsc1 ZINC000187694597 328301064 /nfs/dbraw/zinc/30/10/64/328301064.db2.gz NKCZAZBIOVWVEX-YPMHNXCESA-N 1 1 280.462 4.705 20 0 CJADMO CCC[C@@H]([NH2+][C@H](C)c1nc(C)cs1)c1ccsc1 ZINC000187694612 328300820 /nfs/dbraw/zinc/30/08/20/328300820.db2.gz NKCZAZBIOVWVEX-DGCLKSJQSA-N 1 1 280.462 4.705 20 0 CJADMO C[C@@H]([NH2+]Cc1cccc(O)c1)c1cc(Cl)ccc1Cl ZINC000189273282 333188900 /nfs/dbraw/zinc/18/89/00/333188900.db2.gz QBRZYTKCRGRFLZ-SNVBAGLBSA-N 1 1 296.197 4.550 20 0 CJADMO C[C@H]([NH2+]Cc1cccc(O)c1)c1cc(Cl)ccc1Cl ZINC000189474278 333193428 /nfs/dbraw/zinc/19/34/28/333193428.db2.gz QBRZYTKCRGRFLZ-JTQLQIEISA-N 1 1 296.197 4.550 20 0 CJADMO Clc1ccc(/C=C/C[N@H+]2CCC[C@@H]2c2ccncc2)cc1 ZINC000189772910 333199097 /nfs/dbraw/zinc/19/90/97/333199097.db2.gz LBKIUSNHLDVMRW-ZDBPOJEVSA-N 1 1 298.817 4.585 20 0 CJADMO Clc1ccc(/C=C/C[N@H+]2CCC[C@H]2c2ccncc2)cc1 ZINC000189772929 333199090 /nfs/dbraw/zinc/19/90/90/333199090.db2.gz LBKIUSNHLDVMRW-FVIAUOKHSA-N 1 1 298.817 4.585 20 0 CJADMO Cc1nc([C@@H]2CCC[N@H+]2Cc2cc3ccccc3o2)cs1 ZINC000189832616 329389437 /nfs/dbraw/zinc/38/94/37/329389437.db2.gz FXBCRJWCGYUEEN-INIZCTEOSA-N 1 1 298.411 4.535 20 0 CJADMO Cc1nc([C@@H]2CCC[N@@H+]2Cc2cc3ccccc3o2)cs1 ZINC000189832616 329389436 /nfs/dbraw/zinc/38/94/36/329389436.db2.gz FXBCRJWCGYUEEN-INIZCTEOSA-N 1 1 298.411 4.535 20 0 CJADMO Cc1nc([C@H]2CCC[N@H+]2Cc2cc3ccccc3o2)cs1 ZINC000189832638 329389491 /nfs/dbraw/zinc/38/94/91/329389491.db2.gz FXBCRJWCGYUEEN-MRXNPFEDSA-N 1 1 298.411 4.535 20 0 CJADMO Cc1nc([C@H]2CCC[N@@H+]2Cc2cc3ccccc3o2)cs1 ZINC000189832638 329389490 /nfs/dbraw/zinc/38/94/90/329389490.db2.gz FXBCRJWCGYUEEN-MRXNPFEDSA-N 1 1 298.411 4.535 20 0 CJADMO C/C(=C\c1ccccc1)C[N@H+]1CCC[C@@H]1c1csc(C)n1 ZINC000189919212 264338879 /nfs/dbraw/zinc/33/88/79/264338879.db2.gz MPTNUQCECUXDLQ-GPZRYRNASA-N 1 1 298.455 4.692 20 0 CJADMO Cc1nc([C@@H]2CCC[N@H+]2Cc2coc3ccccc23)cs1 ZINC000189920508 329390252 /nfs/dbraw/zinc/39/02/52/329390252.db2.gz JIAIADMOZQAMSB-INIZCTEOSA-N 1 1 298.411 4.535 20 0 CJADMO Cc1nc([C@@H]2CCC[N@@H+]2Cc2coc3ccccc23)cs1 ZINC000189920508 329390251 /nfs/dbraw/zinc/39/02/51/329390251.db2.gz JIAIADMOZQAMSB-INIZCTEOSA-N 1 1 298.411 4.535 20 0 CJADMO Cc1nc([C@H]2CCC[N@H+]2Cc2coc3ccccc23)cs1 ZINC000189920528 329390114 /nfs/dbraw/zinc/39/01/14/329390114.db2.gz JIAIADMOZQAMSB-MRXNPFEDSA-N 1 1 298.411 4.535 20 0 CJADMO Cc1nc([C@H]2CCC[N@@H+]2Cc2coc3ccccc23)cs1 ZINC000189920528 329390112 /nfs/dbraw/zinc/39/01/12/329390112.db2.gz JIAIADMOZQAMSB-MRXNPFEDSA-N 1 1 298.411 4.535 20 0 CJADMO Cc1csc([C@H](C)[NH2+][C@H](C)c2csc(Cl)c2)n1 ZINC000191258522 226744349 /nfs/dbraw/zinc/74/43/49/226744349.db2.gz ZZPBUDTWZFXSJE-BDAKNGLRSA-N 1 1 286.853 4.578 20 0 CJADMO C[C@H]([NH2+]C1(c2ccccc2F)CC1)c1csc(Cl)c1 ZINC000191437024 333219678 /nfs/dbraw/zinc/21/96/78/333219678.db2.gz SRRXVGATMKICCR-JTQLQIEISA-N 1 1 295.810 4.881 20 0 CJADMO C[C@@H]([NH2+]C1(c2ccccc2F)CC1)c1csc(Cl)c1 ZINC000191437039 333219805 /nfs/dbraw/zinc/21/98/05/333219805.db2.gz SRRXVGATMKICCR-SNVBAGLBSA-N 1 1 295.810 4.881 20 0 CJADMO COc1cccc2cc([C@@H](C)[NH2+][C@@H](C)c3ccc(C)o3)oc21 ZINC000192735804 524259713 /nfs/dbraw/zinc/25/97/13/524259713.db2.gz KEBCWVDISLPBKS-QWHCGFSZSA-N 1 1 299.370 4.755 20 0 CJADMO Cc1ccc(-c2ccc(C[NH2+][C@@H](C)c3ccccn3)o2)cc1 ZINC000192934685 534187522 /nfs/dbraw/zinc/18/75/22/534187522.db2.gz URUMPVYZRKEJOU-HNNXBMFYSA-N 1 1 292.382 4.501 20 0 CJADMO Cc1ccc(-c2ccc(C[NH2+][C@H](C)c3ccccn3)o2)cc1 ZINC000192934699 534187029 /nfs/dbraw/zinc/18/70/29/534187029.db2.gz URUMPVYZRKEJOU-OAHLLOKOSA-N 1 1 292.382 4.501 20 0 CJADMO C[C@H]([NH2+]Cc1sccc1Cl)c1ccc(F)cc1F ZINC000192978481 333241002 /nfs/dbraw/zinc/24/10/02/333241002.db2.gz ONEZZJWCELYWOE-QMMMGPOBSA-N 1 1 287.762 4.531 20 0 CJADMO CCCc1nc(C[NH2+][C@H](C)c2cccc(Cl)c2)cs1 ZINC000193121770 333242898 /nfs/dbraw/zinc/24/28/98/333242898.db2.gz SJQADZLDGKIMQZ-LLVKDONJSA-N 1 1 294.851 4.600 20 0 CJADMO CCC(CC)c1cc(C[NH2+]Cc2cc(Cl)cs2)on1 ZINC000193127467 333243198 /nfs/dbraw/zinc/24/31/98/333243198.db2.gz SNMVZDAEEGDTAC-UHFFFAOYSA-N 1 1 298.839 4.583 20 0 CJADMO C[C@H]([NH2+]Cc1sccc1Cl)c1cccc(F)c1F ZINC000193198979 333244910 /nfs/dbraw/zinc/24/49/10/333244910.db2.gz QHSHFJLSCJVABF-QMMMGPOBSA-N 1 1 287.762 4.531 20 0 CJADMO C[C@@H]([NH2+]Cc1sccc1Cl)c1cccc(F)c1F ZINC000193198988 333244990 /nfs/dbraw/zinc/24/49/90/333244990.db2.gz QHSHFJLSCJVABF-MRVPVSSYSA-N 1 1 287.762 4.531 20 0 CJADMO C[C@@H](c1ccccc1)[N@@H+](C)Cc1cnc(-c2ccco2)s1 ZINC000194310294 333268707 /nfs/dbraw/zinc/26/87/07/333268707.db2.gz XGGUFFWOLWCGCD-ZDUSSCGKSA-N 1 1 298.411 4.596 20 0 CJADMO C[C@H](c1ccccc1)[N@@H+](C)Cc1cnc(-c2ccco2)s1 ZINC000194310307 333268717 /nfs/dbraw/zinc/26/87/17/333268717.db2.gz XGGUFFWOLWCGCD-CYBMUJFWSA-N 1 1 298.411 4.596 20 0 CJADMO CSc1ccccc1[C@H](C)[NH2+][C@H](C)c1nc(C)cs1 ZINC000194880397 331068495 /nfs/dbraw/zinc/06/84/95/331068495.db2.gz PYLJSTAJCZYQBC-NWDGAFQWSA-N 1 1 292.473 4.585 20 0 CJADMO CSc1ccccc1[C@H](C)[NH2+][C@@H](C)c1nc(C)cs1 ZINC000194880414 331068529 /nfs/dbraw/zinc/06/85/29/331068529.db2.gz PYLJSTAJCZYQBC-RYUDHWBXSA-N 1 1 292.473 4.585 20 0 CJADMO CSc1ccccc1[C@@H](C)[NH2+][C@H](C)c1nc(C)cs1 ZINC000194880431 331068523 /nfs/dbraw/zinc/06/85/23/331068523.db2.gz PYLJSTAJCZYQBC-VXGBXAGGSA-N 1 1 292.473 4.585 20 0 CJADMO CSc1ccccc1[C@@H](C)[NH2+][C@@H](C)c1nc(C)cs1 ZINC000194880440 331068508 /nfs/dbraw/zinc/06/85/08/331068508.db2.gz PYLJSTAJCZYQBC-NEPJUHHUSA-N 1 1 292.473 4.585 20 0 CJADMO C[C@H]([NH2+][C@@H](C)c1c(F)cccc1Cl)c1cccc(O)c1 ZINC000194928953 331078983 /nfs/dbraw/zinc/07/89/83/331078983.db2.gz CSNCYWTVHWFKNE-QWRGUYRKSA-N 1 1 293.769 4.597 20 0 CJADMO C[C@@H]([NH2+][C@@H](C)c1c(F)cccc1Cl)c1cccc(O)c1 ZINC000194928964 331078960 /nfs/dbraw/zinc/07/89/60/331078960.db2.gz CSNCYWTVHWFKNE-MNOVXSKESA-N 1 1 293.769 4.597 20 0 CJADMO C[C@@H]([NH2+][C@@H](C)c1cccc(O)c1)c1c(F)cccc1Cl ZINC000194928976 331078975 /nfs/dbraw/zinc/07/89/75/331078975.db2.gz CSNCYWTVHWFKNE-WDEREUQCSA-N 1 1 293.769 4.597 20 0 CJADMO C[C@@H]([NH2+][C@H](C)c1c(F)cccc1Cl)c1cccc(O)c1 ZINC000194928988 331078969 /nfs/dbraw/zinc/07/89/69/331078969.db2.gz CSNCYWTVHWFKNE-GHMZBOCLSA-N 1 1 293.769 4.597 20 0 CJADMO C[C@@H](c1ccco1)[N@@H+](C)Cc1cnc(-c2ccccc2)s1 ZINC000194982126 333280782 /nfs/dbraw/zinc/28/07/82/333280782.db2.gz WZNPKIJELKIPHJ-ZDUSSCGKSA-N 1 1 298.411 4.596 20 0 CJADMO C[C@@H](c1ccco1)[N@H+](C)Cc1cnc(-c2ccccc2)s1 ZINC000194982126 333280781 /nfs/dbraw/zinc/28/07/81/333280781.db2.gz WZNPKIJELKIPHJ-ZDUSSCGKSA-N 1 1 298.411 4.596 20 0 CJADMO C[C@H](c1ccco1)[N@@H+](C)Cc1cnc(-c2ccccc2)s1 ZINC000194982139 333280779 /nfs/dbraw/zinc/28/07/79/333280779.db2.gz WZNPKIJELKIPHJ-CYBMUJFWSA-N 1 1 298.411 4.596 20 0 CJADMO C[C@H](c1ccco1)[N@H+](C)Cc1cnc(-c2ccccc2)s1 ZINC000194982139 333280778 /nfs/dbraw/zinc/28/07/78/333280778.db2.gz WZNPKIJELKIPHJ-CYBMUJFWSA-N 1 1 298.411 4.596 20 0 CJADMO CC[C@H]([NH2+]Cc1ccc(C)c(Cl)c1)c1nc(C)cs1 ZINC000195441696 331173082 /nfs/dbraw/zinc/17/30/82/331173082.db2.gz PMMUHZDOQIRIQR-AWEZNQCLSA-N 1 1 294.851 4.654 20 0 CJADMO CC[C@@H]([NH2+]Cc1ccc(C)c(Cl)c1)c1nc(C)cs1 ZINC000195441703 331173043 /nfs/dbraw/zinc/17/30/43/331173043.db2.gz PMMUHZDOQIRIQR-CQSZACIVSA-N 1 1 294.851 4.654 20 0 CJADMO CCc1nc([C@@H](C)[NH2+]Cc2ccc(C)c(Cl)c2)cs1 ZINC000195442726 331174599 /nfs/dbraw/zinc/17/45/99/331174599.db2.gz LIWAZKZVJIMJCU-LLVKDONJSA-N 1 1 294.851 4.518 20 0 CJADMO CCc1nc([C@H](C)[NH2+]Cc2ccc(C)c(Cl)c2)cs1 ZINC000195442731 331174588 /nfs/dbraw/zinc/17/45/88/331174588.db2.gz LIWAZKZVJIMJCU-NSHDSACASA-N 1 1 294.851 4.518 20 0 CJADMO CC[C@](C)([NH2+]Cc1ccc(C)c(Cl)c1)c1nccs1 ZINC000195444181 331174662 /nfs/dbraw/zinc/17/46/62/331174662.db2.gz AEHAEJJPVGWOBV-HNNXBMFYSA-N 1 1 294.851 4.520 20 0 CJADMO CC[C@@](C)([NH2+]Cc1ccc(C)c(Cl)c1)c1nccs1 ZINC000195444184 331174578 /nfs/dbraw/zinc/17/45/78/331174578.db2.gz AEHAEJJPVGWOBV-OAHLLOKOSA-N 1 1 294.851 4.520 20 0 CJADMO Cc1ccc(C[NH2+]Cc2nc(C(C)C)cs2)cc1Cl ZINC000195446329 331174742 /nfs/dbraw/zinc/17/47/42/331174742.db2.gz YXFKTELJBPJRFE-UHFFFAOYSA-N 1 1 294.851 4.518 20 0 CJADMO C[C@H]([NH2+]Cc1cc(Cl)ccc1Cl)c1cccc(O)c1 ZINC000195454373 331173859 /nfs/dbraw/zinc/17/38/59/331173859.db2.gz XWMPFHAVOOXBAZ-JTQLQIEISA-N 1 1 296.197 4.550 20 0 CJADMO C[C@@H](C1CC1)[N@@H+](Cc1cnc(-c2ccccc2)s1)C1CC1 ZINC000195567013 333256075 /nfs/dbraw/zinc/25/60/75/333256075.db2.gz KIAUJDHJLICJMU-ZDUSSCGKSA-N 1 1 298.455 4.573 20 0 CJADMO C[C@H](C1CC1)[N@@H+](Cc1cnc(-c2ccccc2)s1)C1CC1 ZINC000195567015 333255918 /nfs/dbraw/zinc/25/59/18/333255918.db2.gz KIAUJDHJLICJMU-CYBMUJFWSA-N 1 1 298.455 4.573 20 0 CJADMO Cc1cccc(C[N@H+]2CCCCC[C@@H]2c2ccncc2)c1 ZINC000195587147 336057064 /nfs/dbraw/zinc/05/70/64/336057064.db2.gz JRICSMDKYSXWEU-LJQANCHMSA-N 1 1 280.415 4.507 20 0 CJADMO Cc1cccc(C[N@H+]2CCCCC[C@H]2c2ccncc2)c1 ZINC000195587148 336056989 /nfs/dbraw/zinc/05/69/89/336056989.db2.gz JRICSMDKYSXWEU-IBGZPJMESA-N 1 1 280.415 4.507 20 0 CJADMO Cc1ccccc1C[N@H+]1CCCCC[C@@H]1c1ccncc1 ZINC000195587150 336056924 /nfs/dbraw/zinc/05/69/24/336056924.db2.gz UUFSJRZUIAISSE-LJQANCHMSA-N 1 1 280.415 4.507 20 0 CJADMO Cc1ccccc1C[N@H+]1CCCCC[C@H]1c1ccncc1 ZINC000195587151 336057045 /nfs/dbraw/zinc/05/70/45/336057045.db2.gz UUFSJRZUIAISSE-IBGZPJMESA-N 1 1 280.415 4.507 20 0 CJADMO Cc1cc(C[N@H+]2CCC[C@@H]2c2ccccc2)c(C)s1 ZINC000195673943 333260442 /nfs/dbraw/zinc/26/04/42/333260442.db2.gz LVCROHCSSWSXOV-QGZVFWFLSA-N 1 1 271.429 4.702 20 0 CJADMO Cc1cc(C[N@H+]2CCC[C@H]2c2ccccc2)c(C)s1 ZINC000195673944 333260373 /nfs/dbraw/zinc/26/03/73/333260373.db2.gz LVCROHCSSWSXOV-KRWDZBQOSA-N 1 1 271.429 4.702 20 0 CJADMO COc1ccc([C@@H](C)[N@@H+](C)Cc2cc(C)sc2C)cc1 ZINC000195673994 333260316 /nfs/dbraw/zinc/26/03/16/333260316.db2.gz XKGBGMHIISZPCZ-CYBMUJFWSA-N 1 1 289.444 4.567 20 0 CJADMO COc1ccc([C@H](C)[N@@H+](C)Cc2cc(C)sc2C)cc1 ZINC000195673996 333260482 /nfs/dbraw/zinc/26/04/82/333260482.db2.gz XKGBGMHIISZPCZ-ZDUSSCGKSA-N 1 1 289.444 4.567 20 0 CJADMO Cc1cc(C[N@H+](C)[C@@H](C)c2cccs2)c(C)s1 ZINC000195674318 333260354 /nfs/dbraw/zinc/26/03/54/333260354.db2.gz UNBOBPYLMYBWHP-NSHDSACASA-N 1 1 265.447 4.619 20 0 CJADMO Cc1cc(C[N@H+](C)[C@H](C)c2cccs2)c(C)s1 ZINC000195674320 333260562 /nfs/dbraw/zinc/26/05/62/333260562.db2.gz UNBOBPYLMYBWHP-LLVKDONJSA-N 1 1 265.447 4.619 20 0 CJADMO Cc1cc(C[N@H+](C)[C@@H](C)c2cc(F)ccc2F)c(C)s1 ZINC000195674378 333260331 /nfs/dbraw/zinc/26/03/31/333260331.db2.gz UDEJNFWBQXBIGH-NSHDSACASA-N 1 1 295.398 4.836 20 0 CJADMO Cc1cc(C[N@@H+](C)[C@@H](C)c2cc(F)ccc2F)c(C)s1 ZINC000195674378 333260330 /nfs/dbraw/zinc/26/03/30/333260330.db2.gz UDEJNFWBQXBIGH-NSHDSACASA-N 1 1 295.398 4.836 20 0 CJADMO Cc1cc(C[N@H+](C)[C@H](C)c2cc(F)ccc2F)c(C)s1 ZINC000195674379 333260405 /nfs/dbraw/zinc/26/04/05/333260405.db2.gz UDEJNFWBQXBIGH-LLVKDONJSA-N 1 1 295.398 4.836 20 0 CJADMO Cc1cc(C[N@@H+](C)[C@H](C)c2cc(F)ccc2F)c(C)s1 ZINC000195674379 333260403 /nfs/dbraw/zinc/26/04/03/333260403.db2.gz UDEJNFWBQXBIGH-LLVKDONJSA-N 1 1 295.398 4.836 20 0 CJADMO CCCCC[N@@H+](Cc1cnc(C)s1)[C@@H](C)CCC ZINC000195675323 333260358 /nfs/dbraw/zinc/26/03/58/333260358.db2.gz GCMFTRQVTVXPPD-ZDUSSCGKSA-N 1 1 268.470 4.632 20 0 CJADMO CCCCC[N@@H+](Cc1cnc(C)s1)[C@H](C)CCC ZINC000195675324 333260326 /nfs/dbraw/zinc/26/03/26/333260326.db2.gz GCMFTRQVTVXPPD-CYBMUJFWSA-N 1 1 268.470 4.632 20 0 CJADMO C[C@@H](c1ccco1)[N@@H+](C)CCOc1cccc2ccccc21 ZINC000195732368 333262509 /nfs/dbraw/zinc/26/25/09/333262509.db2.gz IRDSMEMXNKBDMT-HNNXBMFYSA-N 1 1 295.382 4.505 20 0 CJADMO C[C@H](c1ccco1)[N@@H+](C)CCOc1cccc2ccccc21 ZINC000195732369 333262492 /nfs/dbraw/zinc/26/24/92/333262492.db2.gz IRDSMEMXNKBDMT-OAHLLOKOSA-N 1 1 295.382 4.505 20 0 CJADMO Cc1ncc(C[N@H+](C)[C@@H](C)c2ccc(C(C)C)cc2)s1 ZINC000195732479 333262914 /nfs/dbraw/zinc/26/29/14/333262914.db2.gz MOCXPLGFRFGTTL-ZDUSSCGKSA-N 1 1 288.460 4.768 20 0 CJADMO Cc1ncc(C[N@H+](C)[C@H](C)c2ccc(C(C)C)cc2)s1 ZINC000195732480 333262975 /nfs/dbraw/zinc/26/29/75/333262975.db2.gz MOCXPLGFRFGTTL-CYBMUJFWSA-N 1 1 288.460 4.768 20 0 CJADMO C[C@@H](C1CC1)[N@@H+](Cc1csc(C2CCCC2)n1)C1CC1 ZINC000195734962 333262759 /nfs/dbraw/zinc/26/27/59/333262759.db2.gz NBVCUKOIOCEIND-LBPRGKRZSA-N 1 1 290.476 4.564 20 0 CJADMO C[C@H](C1CC1)[N@@H+](Cc1csc(C2CCCC2)n1)C1CC1 ZINC000195734963 333262771 /nfs/dbraw/zinc/26/27/71/333262771.db2.gz NBVCUKOIOCEIND-GFCCVEGCSA-N 1 1 290.476 4.564 20 0 CJADMO Cc1csc([C@@H](C)[NH2+][C@@H](C)c2ccc(Cl)c(F)c2)n1 ZINC000212783772 330367398 /nfs/dbraw/zinc/36/73/98/330367398.db2.gz IYBDIGMHFPFOER-VHSXEESVSA-N 1 1 298.814 4.656 20 0 CJADMO Cc1csc([C@H](C)[NH2+][C@@H](C)c2ccc(Cl)c(F)c2)n1 ZINC000212783836 330367444 /nfs/dbraw/zinc/36/74/44/330367444.db2.gz IYBDIGMHFPFOER-UWVGGRQHSA-N 1 1 298.814 4.656 20 0 CJADMO Cc1csc([C@@H](C)[NH2+][C@H](C)c2ccc(Cl)c(F)c2)n1 ZINC000212783901 330367417 /nfs/dbraw/zinc/36/74/17/330367417.db2.gz IYBDIGMHFPFOER-NXEZZACHSA-N 1 1 298.814 4.656 20 0 CJADMO Cc1csc([C@H](C)[NH2+][C@H](C)c2ccc(Cl)c(F)c2)n1 ZINC000212783972 330367421 /nfs/dbraw/zinc/36/74/21/330367421.db2.gz IYBDIGMHFPFOER-ZJUUUORDSA-N 1 1 298.814 4.656 20 0 CJADMO C[C@H]([NH2+]Cc1cc(F)ccc1F)c1ccc(Cl)c(F)c1 ZINC000213711950 330370621 /nfs/dbraw/zinc/37/06/21/330370621.db2.gz KCFCQOKFVLKXJZ-VIFPVBQESA-N 1 1 299.723 4.608 20 0 CJADMO C[C@@H]([NH2+]Cc1cc(F)ccc1F)c1ccc(Cl)c(F)c1 ZINC000213712004 330370567 /nfs/dbraw/zinc/37/05/67/330370567.db2.gz KCFCQOKFVLKXJZ-SECBINFHSA-N 1 1 299.723 4.608 20 0 CJADMO Cc1cccc(C[N@H+](C)[C@@H](C)c2nc3ccccc3s2)c1 ZINC000215626568 330396685 /nfs/dbraw/zinc/39/66/85/330396685.db2.gz JIDGFXYLIYSPMA-AWEZNQCLSA-N 1 1 296.439 4.798 20 0 CJADMO Cc1cccc(C[N@@H+](C)[C@@H](C)c2nc3ccccc3s2)c1 ZINC000215626568 330396684 /nfs/dbraw/zinc/39/66/84/330396684.db2.gz JIDGFXYLIYSPMA-AWEZNQCLSA-N 1 1 296.439 4.798 20 0 CJADMO Cc1cccc(C[N@H+](C)[C@H](C)c2nc3ccccc3s2)c1 ZINC000215626620 330396752 /nfs/dbraw/zinc/39/67/52/330396752.db2.gz JIDGFXYLIYSPMA-CQSZACIVSA-N 1 1 296.439 4.798 20 0 CJADMO Cc1cccc(C[N@@H+](C)[C@H](C)c2nc3ccccc3s2)c1 ZINC000215626620 330396751 /nfs/dbraw/zinc/39/67/51/330396751.db2.gz JIDGFXYLIYSPMA-CQSZACIVSA-N 1 1 296.439 4.798 20 0 CJADMO CCc1cnc(C[NH2+][C@@H](CC)c2cccc(Cl)c2)s1 ZINC000219247559 326792316 /nfs/dbraw/zinc/79/23/16/326792316.db2.gz ZRXZFBHSMBMRNT-AWEZNQCLSA-N 1 1 294.851 4.600 20 0 CJADMO C[C@@H]([NH2+]Cc1ccc(F)cc1Cl)c1ccc(F)cc1F ZINC000219347213 333147687 /nfs/dbraw/zinc/14/76/87/333147687.db2.gz MOZAAULQEGQPEX-SECBINFHSA-N 1 1 299.723 4.608 20 0 CJADMO C[C@H]([NH2+]Cc1ccc(F)cc1Cl)c1ccc(F)cc1F ZINC000219347289 333147694 /nfs/dbraw/zinc/14/76/94/333147694.db2.gz MOZAAULQEGQPEX-VIFPVBQESA-N 1 1 299.723 4.608 20 0 CJADMO c1csc(C[N@@H+]2CC=C(c3c[nH]c4ccccc43)CC2)c1 ZINC000219692659 333155534 /nfs/dbraw/zinc/15/55/34/333155534.db2.gz SLQCIADZTNONHH-UHFFFAOYSA-N 1 1 294.423 4.519 20 0 CJADMO Cc1cnc([C@@H](C)[NH2+][C@@H](C)c2cccc3ccccc32)o1 ZINC000220890469 260140926 /nfs/dbraw/zinc/14/09/26/260140926.db2.gz DOWZUDXYBPQHKK-UONOGXRCSA-N 1 1 280.371 4.548 20 0 CJADMO Cc1cnc([C@H](C)[NH2+][C@@H](C)c2cccc3ccccc32)o1 ZINC000220890532 260140904 /nfs/dbraw/zinc/14/09/04/260140904.db2.gz DOWZUDXYBPQHKK-KBPBESRZSA-N 1 1 280.371 4.548 20 0 CJADMO Cc1cnc([C@@H](C)[NH2+][C@H](C)c2cccc3ccccc32)o1 ZINC000220890583 333170363 /nfs/dbraw/zinc/17/03/63/333170363.db2.gz DOWZUDXYBPQHKK-ZIAGYGMSSA-N 1 1 280.371 4.548 20 0 CJADMO Cc1cnc([C@H](C)[NH2+][C@H](C)c2cccc3ccccc32)o1 ZINC000220890643 333170387 /nfs/dbraw/zinc/17/03/87/333170387.db2.gz DOWZUDXYBPQHKK-KGLIPLIRSA-N 1 1 280.371 4.548 20 0 CJADMO C[C@@H]([NH2+]Cc1ccccc1)c1cc(Cl)sc1Cl ZINC000221726812 262292932 /nfs/dbraw/zinc/29/29/32/262292932.db2.gz UTGPBVIXURSJNQ-SECBINFHSA-N 1 1 286.227 4.906 20 0 CJADMO C[C@H]([NH2+]Cc1ccccc1)c1cc(Cl)sc1Cl ZINC000221726870 262293095 /nfs/dbraw/zinc/29/30/95/262293095.db2.gz UTGPBVIXURSJNQ-VIFPVBQESA-N 1 1 286.227 4.906 20 0 CJADMO Cc1ccc(F)c(C[NH2+][C@@H](C)c2ccccc2Cl)c1 ZINC000223621049 333210097 /nfs/dbraw/zinc/21/00/97/333210097.db2.gz YCQHYLGSNQFMOH-LBPRGKRZSA-N 1 1 277.770 4.638 20 0 CJADMO C[C@H]([NH2+]Cc1cc(F)c(F)cc1F)c1ccccc1Cl ZINC000223621308 333209916 /nfs/dbraw/zinc/20/99/16/333209916.db2.gz IETMFWABXQIZFP-VIFPVBQESA-N 1 1 299.723 4.608 20 0 CJADMO Cc1nc(C[NH2+][C@@H](CC(C)(C)C)c2ccccc2)oc1C ZINC000223658528 333210440 /nfs/dbraw/zinc/21/04/40/333210440.db2.gz NMPGMNXTNAJCSK-INIZCTEOSA-N 1 1 286.419 4.559 20 0 CJADMO Cc1nc(C[NH2+][C@H](CC(C)(C)C)c2ccccc2)oc1C ZINC000223658584 333210370 /nfs/dbraw/zinc/21/03/70/333210370.db2.gz NMPGMNXTNAJCSK-MRXNPFEDSA-N 1 1 286.419 4.559 20 0 CJADMO CCC[C@H]([NH2+]Cc1ncc(C)s1)c1ccc(Cl)cc1 ZINC000224185891 333429520 /nfs/dbraw/zinc/42/95/20/333429520.db2.gz GIBKRFRSGTWGGY-AWEZNQCLSA-N 1 1 294.851 4.736 20 0 CJADMO Cc1cc([C@@H](C)[NH2+][C@@H](C)c2cccc(F)c2F)c(C)o1 ZINC000224982137 333228253 /nfs/dbraw/zinc/22/82/53/333228253.db2.gz NFONDEVWYLDBDK-WDEREUQCSA-N 1 1 279.330 4.586 20 0 CJADMO Cc1cc([C@H](C)[NH2+][C@H](C)c2cccc(F)c2F)c(C)o1 ZINC000224982256 333228257 /nfs/dbraw/zinc/22/82/57/333228257.db2.gz NFONDEVWYLDBDK-MNOVXSKESA-N 1 1 279.330 4.586 20 0 CJADMO C[C@@H]([NH2+]Cc1cc(F)c(F)cc1F)c1ccccc1Cl ZINC000225245253 333234071 /nfs/dbraw/zinc/23/40/71/333234071.db2.gz IETMFWABXQIZFP-SECBINFHSA-N 1 1 299.723 4.608 20 0 CJADMO C[C@@H]([NH2+]Cc1cc(F)c(F)cc1F)c1cccc(Cl)c1 ZINC000225245308 333234190 /nfs/dbraw/zinc/23/41/90/333234190.db2.gz FONJJMQAZOKVHU-SECBINFHSA-N 1 1 299.723 4.608 20 0 CJADMO CC(C)c1ccc([C@@H](C)[NH2+]Cc2ncc(Cl)s2)cc1 ZINC000225296507 333235070 /nfs/dbraw/zinc/23/50/70/333235070.db2.gz SRLCSHZBVAZVDN-LLVKDONJSA-N 1 1 294.851 4.771 20 0 CJADMO CC(C)c1ccc([C@H](C)[NH2+]Cc2ncc(Cl)s2)cc1 ZINC000225296533 333234908 /nfs/dbraw/zinc/23/49/08/333234908.db2.gz SRLCSHZBVAZVDN-NSHDSACASA-N 1 1 294.851 4.771 20 0 CJADMO CC(C)C[C@@H]([NH2+]Cc1ncc(Cl)s1)c1ccccc1 ZINC000225300087 333235035 /nfs/dbraw/zinc/23/50/35/333235035.db2.gz AZVPFCLBSYYVEN-CYBMUJFWSA-N 1 1 294.851 4.674 20 0 CJADMO CC(C)C[C@H]([NH2+]Cc1ncc(Cl)s1)c1ccccc1 ZINC000225300121 333235050 /nfs/dbraw/zinc/23/50/50/333235050.db2.gz AZVPFCLBSYYVEN-ZDUSSCGKSA-N 1 1 294.851 4.674 20 0 CJADMO CC(C)(C)[C@@H]([NH2+]Cc1ncc(Cl)s1)c1ccccc1 ZINC000225312092 333234927 /nfs/dbraw/zinc/23/49/27/333234927.db2.gz KXUNDZPBKUAMIJ-AWEZNQCLSA-N 1 1 294.851 4.674 20 0 CJADMO CC(C)(C)[C@H]([NH2+]Cc1ncc(Cl)s1)c1ccccc1 ZINC000225312125 333234915 /nfs/dbraw/zinc/23/49/15/333234915.db2.gz KXUNDZPBKUAMIJ-CQSZACIVSA-N 1 1 294.851 4.674 20 0 CJADMO C[C@@H](Nc1cccc2cc[nH+]cc21)c1cccc(F)c1F ZINC000226056292 333247150 /nfs/dbraw/zinc/24/71/50/333247150.db2.gz DWJCBIVTSAXHFC-LLVKDONJSA-N 1 1 284.309 4.686 20 0 CJADMO C[C@H](Nc1cccc2cc[nH+]cc21)c1cccc(F)c1F ZINC000226056302 333247021 /nfs/dbraw/zinc/24/70/21/333247021.db2.gz DWJCBIVTSAXHFC-NSHDSACASA-N 1 1 284.309 4.686 20 0 CJADMO CCc1cnc(C[NH2+][C@@H](C)c2ccc3ccccc3c2)s1 ZINC000226329041 333257232 /nfs/dbraw/zinc/25/72/32/333257232.db2.gz GZLQXMSLXCNOPF-ZDUSSCGKSA-N 1 1 296.439 4.710 20 0 CJADMO CCc1cnc(C[NH2+][C@H](C)c2ccc3ccccc3c2)s1 ZINC000226329047 333257254 /nfs/dbraw/zinc/25/72/54/333257254.db2.gz GZLQXMSLXCNOPF-CYBMUJFWSA-N 1 1 296.439 4.710 20 0 CJADMO Fc1ccc(CNc2cccc3cc[nH+]cc32)c(Cl)c1 ZINC000226653739 333642093 /nfs/dbraw/zinc/64/20/93/333642093.db2.gz DLMIUDUWVMTAMN-UHFFFAOYSA-N 1 1 286.737 4.639 20 0 CJADMO Cc1ccc(F)c(C[NH2+][C@H](C)c2ccccc2Cl)c1 ZINC000227280851 333279436 /nfs/dbraw/zinc/27/94/36/333279436.db2.gz YCQHYLGSNQFMOH-GFCCVEGCSA-N 1 1 277.770 4.638 20 0 CJADMO C[C@@H]([NH2+]Cc1ccccc1F)c1cccc(Cl)c1Cl ZINC000227530165 333285100 /nfs/dbraw/zinc/28/51/00/333285100.db2.gz QMHQWUZRPIOGRH-SNVBAGLBSA-N 1 1 298.188 4.983 20 0 CJADMO C[C@H]([NH2+]Cc1ccccc1F)c1cccc(Cl)c1Cl ZINC000227530169 333285085 /nfs/dbraw/zinc/28/50/85/333285085.db2.gz QMHQWUZRPIOGRH-JTQLQIEISA-N 1 1 298.188 4.983 20 0 CJADMO Cc1cnc([C@@H](C)[NH2+]Cc2ccc(-c3ccccc3)s2)o1 ZINC000227556502 333285822 /nfs/dbraw/zinc/28/58/22/333285822.db2.gz OBTYAPOCFSODHI-CYBMUJFWSA-N 1 1 298.411 4.562 20 0 CJADMO Cc1cnc([C@H](C)[NH2+]Cc2ccc(-c3ccccc3)s2)o1 ZINC000227556506 333285767 /nfs/dbraw/zinc/28/57/67/333285767.db2.gz OBTYAPOCFSODHI-ZDUSSCGKSA-N 1 1 298.411 4.562 20 0 CJADMO COc1cccc(Cl)c1C[NH2+][C@H](C)c1ccc(C)cc1 ZINC000228743092 333296458 /nfs/dbraw/zinc/29/64/58/333296458.db2.gz KMFMHUHIKBJGET-CYBMUJFWSA-N 1 1 289.806 4.508 20 0 CJADMO COc1cccc(Cl)c1C[NH2+][C@H](C)c1cccc(C)c1 ZINC000228746478 333296499 /nfs/dbraw/zinc/29/64/99/333296499.db2.gz FPKZTIWBCOOMFP-CYBMUJFWSA-N 1 1 289.806 4.508 20 0 CJADMO Clc1ccc(Cl)c(C[NH2+][C@@H]2CCCc3occc32)c1 ZINC000229187755 333301284 /nfs/dbraw/zinc/30/12/84/333301284.db2.gz FSCMZJDZKOKGNE-CQSZACIVSA-N 1 1 296.197 4.754 20 0 CJADMO Clc1ccc(Cl)c(C[NH2+][C@H]2CCCc3occc32)c1 ZINC000229187765 333301380 /nfs/dbraw/zinc/30/13/80/333301380.db2.gz FSCMZJDZKOKGNE-AWEZNQCLSA-N 1 1 296.197 4.754 20 0 CJADMO C[C@@H]([NH2+]Cc1ccccc1Cl)c1csc(Cl)c1 ZINC000230406760 333317572 /nfs/dbraw/zinc/31/75/72/333317572.db2.gz PLGQQIMWIHQZCG-SECBINFHSA-N 1 1 286.227 4.906 20 0 CJADMO C[C@H]([NH2+]Cc1ccccc1Cl)c1csc(Cl)c1 ZINC000230406765 333317521 /nfs/dbraw/zinc/31/75/21/333317521.db2.gz PLGQQIMWIHQZCG-VIFPVBQESA-N 1 1 286.227 4.906 20 0 CJADMO C[C@@H]([NH2+]Cc1ccc(F)cc1F)c1csc(Cl)c1 ZINC000230408991 333318172 /nfs/dbraw/zinc/31/81/72/333318172.db2.gz OMUZWEGWYZGXCE-MRVPVSSYSA-N 1 1 287.762 4.531 20 0 CJADMO C[C@H]([NH2+]Cc1ccc(F)cc1F)c1csc(Cl)c1 ZINC000230408994 333318111 /nfs/dbraw/zinc/31/81/11/333318111.db2.gz OMUZWEGWYZGXCE-QMMMGPOBSA-N 1 1 287.762 4.531 20 0 CJADMO C[C@@H]([NH2+]Cc1ccc(Cl)s1)c1cccc(F)c1F ZINC000231632850 333326477 /nfs/dbraw/zinc/32/64/77/333326477.db2.gz JYZKJHHQEMPEAD-MRVPVSSYSA-N 1 1 287.762 4.531 20 0 CJADMO C[C@H]([NH2+]Cc1ccc(Cl)s1)c1cccc(F)c1F ZINC000231632854 333326533 /nfs/dbraw/zinc/32/65/33/333326533.db2.gz JYZKJHHQEMPEAD-QMMMGPOBSA-N 1 1 287.762 4.531 20 0 CJADMO C[C@@H]([NH2+]Cc1ccc(F)c(Cl)c1)c1cccc(F)c1F ZINC000231632926 333326527 /nfs/dbraw/zinc/32/65/27/333326527.db2.gz FZCIOKXUWNCFAF-SECBINFHSA-N 1 1 299.723 4.608 20 0 CJADMO C[C@H]([NH2+]Cc1ccc(F)c(Cl)c1)c1cccc(F)c1F ZINC000231632930 333326562 /nfs/dbraw/zinc/32/65/62/333326562.db2.gz FZCIOKXUWNCFAF-VIFPVBQESA-N 1 1 299.723 4.608 20 0 CJADMO C[C@@H](CC(F)(F)F)Nc1cc[nH+]c2cc(Cl)ccc12 ZINC000231748892 333329087 /nfs/dbraw/zinc/32/90/87/333329087.db2.gz VKXKYTDQGFNMJX-QMMMGPOBSA-N 1 1 288.700 4.641 20 0 CJADMO C[C@H](CC(F)(F)F)Nc1cc[nH+]c2cc(Cl)ccc12 ZINC000231748896 333329016 /nfs/dbraw/zinc/32/90/16/333329016.db2.gz VKXKYTDQGFNMJX-MRVPVSSYSA-N 1 1 288.700 4.641 20 0 CJADMO Cc1ccc(C[NH2+][C@H](C)c2c(F)cccc2F)cc1Cl ZINC000235224000 333366761 /nfs/dbraw/zinc/36/67/61/333366761.db2.gz WCZQZGBJUCNXSA-LLVKDONJSA-N 1 1 295.760 4.777 20 0 CJADMO Cc1ccc(C[NH2+][C@@H](C)c2c(F)cccc2F)cc1Cl ZINC000235521764 333370380 /nfs/dbraw/zinc/37/03/80/333370380.db2.gz WCZQZGBJUCNXSA-NSHDSACASA-N 1 1 295.760 4.777 20 0 CJADMO C(=C/c1ccccc1)\C[NH2+][C@H](c1ccco1)c1ccccc1 ZINC000236594234 333373851 /nfs/dbraw/zinc/37/38/51/333373851.db2.gz ULEQIRHDEAKNGR-OEMHODTASA-N 1 1 289.378 4.672 20 0 CJADMO C(=C/c1ccccc1)\C[NH2+][C@@H](c1ccco1)c1ccccc1 ZINC000236600653 333374012 /nfs/dbraw/zinc/37/40/12/333374012.db2.gz ULEQIRHDEAKNGR-WUTDNEBXSA-N 1 1 289.378 4.672 20 0 CJADMO c1coc(C[NH2+]Cc2ccccc2Sc2ccccc2)c1 ZINC000236774153 333375340 /nfs/dbraw/zinc/37/53/40/333375340.db2.gz LIHSYXFEODHLQQ-UHFFFAOYSA-N 1 1 295.407 4.721 20 0 CJADMO CCc1ccc(C[NH2+]C(c2ccccc2)c2ccccc2)o1 ZINC000237141087 333378052 /nfs/dbraw/zinc/37/80/52/333378052.db2.gz ZVCYGHLGFZOGER-UHFFFAOYSA-N 1 1 291.394 4.721 20 0 CJADMO CCc1ccc(C[NH2+][C@@H](c2ccco2)c2ccccc2)cc1 ZINC000237155306 333377967 /nfs/dbraw/zinc/37/79/67/333377967.db2.gz GFARVTWMHNVJPG-HXUWFJFHSA-N 1 1 291.394 4.721 20 0 CJADMO Cc1ccc(CNc2ccc(C[N@@H+]3CCCC[C@H]3C)cc2)o1 ZINC000237352074 333379048 /nfs/dbraw/zinc/37/90/48/333379048.db2.gz SFAWUXRFMYBBLY-OAHLLOKOSA-N 1 1 298.430 4.575 20 0 CJADMO C[C@@H]([NH2+]Cc1ccco1)c1ccccc1Oc1ccccc1 ZINC000237354371 333378922 /nfs/dbraw/zinc/37/89/22/333378922.db2.gz NGNLBIAHCZHURP-OAHLLOKOSA-N 1 1 293.366 4.923 20 0 CJADMO Cc1cc([NH+]2CCCC2)ccc1N[C@@H](C)CCc1ccco1 ZINC000237362293 334087431 /nfs/dbraw/zinc/08/74/31/334087431.db2.gz WOEAZUUMLIJUCL-INIZCTEOSA-N 1 1 298.430 4.621 20 0 CJADMO Cc1c2ccccc2oc1C[NH2+]Cc1ccc([C@H]2C[C@H]2C)o1 ZINC000237373623 334087669 /nfs/dbraw/zinc/08/76/69/334087669.db2.gz SVQBNWCOXOQIFQ-WBMJQRKESA-N 1 1 295.382 4.747 20 0 CJADMO Cc1c2ccccc2oc1C[NH2+]Cc1ccc([C@@H]2C[C@H]2C)o1 ZINC000237469432 334089680 /nfs/dbraw/zinc/08/96/80/334089680.db2.gz SVQBNWCOXOQIFQ-MLGOLLRUSA-N 1 1 295.382 4.747 20 0 CJADMO Cc1ccc(C[NH2+][C@H](C)c2c(F)cccc2Cl)cc1 ZINC000237482643 333379728 /nfs/dbraw/zinc/37/97/28/333379728.db2.gz GSHNIZVSXFGADO-GFCCVEGCSA-N 1 1 277.770 4.638 20 0 CJADMO C[C@H]([NH2+]Cc1ccco1)c1ccccc1Oc1ccccc1 ZINC000237510778 333379839 /nfs/dbraw/zinc/37/98/39/333379839.db2.gz NGNLBIAHCZHURP-HNNXBMFYSA-N 1 1 293.366 4.923 20 0 CJADMO Cc1cc([NH+]2CCCC2)ccc1N[C@H](C)CCc1ccco1 ZINC000237533857 334090772 /nfs/dbraw/zinc/09/07/72/334090772.db2.gz WOEAZUUMLIJUCL-MRXNPFEDSA-N 1 1 298.430 4.621 20 0 CJADMO Cc1ccccc1Oc1ccccc1C[NH2+]Cc1ccco1 ZINC000237572440 333380203 /nfs/dbraw/zinc/38/02/03/333380203.db2.gz YHHYPTQTKRIDRY-UHFFFAOYSA-N 1 1 293.366 4.670 20 0 CJADMO Cc1c2ccccc2oc1C[NH2+]Cc1ccc([C@H]2C[C@@H]2C)o1 ZINC000237575944 334091412 /nfs/dbraw/zinc/09/14/12/334091412.db2.gz SVQBNWCOXOQIFQ-LRDDRELGSA-N 1 1 295.382 4.747 20 0 CJADMO Cc1ccc(C[NH2+][C@@H](C)c2c(F)cccc2Cl)cc1 ZINC000237592007 333380329 /nfs/dbraw/zinc/38/03/29/333380329.db2.gz GSHNIZVSXFGADO-LBPRGKRZSA-N 1 1 277.770 4.638 20 0 CJADMO Cc1cc(F)ccc1CNc1ccc([NH+]2CCCC2)cc1C ZINC000237636182 333380625 /nfs/dbraw/zinc/38/06/25/333380625.db2.gz SBTQHOMHPNXWLY-UHFFFAOYSA-N 1 1 298.405 4.655 20 0 CJADMO Cc1cccc(C[NH2+][C@H](c2ccco2)c2ccccc2)c1C ZINC000237642239 333380877 /nfs/dbraw/zinc/38/08/77/333380877.db2.gz QOZTZTLYNOLDQB-FQEVSTJZSA-N 1 1 291.394 4.776 20 0 CJADMO Cc1c2ccccc2oc1C[NH2+]Cc1ccc([C@@H]2C[C@@H]2C)o1 ZINC000237669655 334094762 /nfs/dbraw/zinc/09/47/62/334094762.db2.gz SVQBNWCOXOQIFQ-BLLLJJGKSA-N 1 1 295.382 4.747 20 0 CJADMO Cc1ccc(C[NH2+]C(C)(c2ccccc2)c2ccccc2)o1 ZINC000237759039 333381529 /nfs/dbraw/zinc/38/15/29/333381529.db2.gz OWRYEGARSHWPMK-UHFFFAOYSA-N 1 1 291.394 4.641 20 0 CJADMO Cc1cccc(Oc2ccccc2C[NH2+]Cc2ccco2)c1 ZINC000237776565 333381321 /nfs/dbraw/zinc/38/13/21/333381321.db2.gz GABNSWWAURXFBB-UHFFFAOYSA-N 1 1 293.366 4.670 20 0 CJADMO Cc1ccc(C[NH2+][C@H](c2ccco2)c2ccccc2)c(C)c1 ZINC000237797478 333381350 /nfs/dbraw/zinc/38/13/50/333381350.db2.gz WFVYWRKSAZIZFI-FQEVSTJZSA-N 1 1 291.394 4.776 20 0 CJADMO Cc1ccc(C[NH2+][C@@H](c2ccco2)c2ccccc2)cc1C ZINC000237803818 333381806 /nfs/dbraw/zinc/38/18/06/333381806.db2.gz FXYCPVNRSKATRG-HXUWFJFHSA-N 1 1 291.394 4.776 20 0 CJADMO Cc1ccc(Oc2ccccc2C[NH2+]Cc2ccco2)cc1 ZINC000237808401 333381630 /nfs/dbraw/zinc/38/16/30/333381630.db2.gz IZFYORPXUKRJED-UHFFFAOYSA-N 1 1 293.366 4.670 20 0 CJADMO Fc1ccc(F)c(C[NH2+]Cc2ccc(-c3ccccc3)o2)c1 ZINC000237815487 333381649 /nfs/dbraw/zinc/38/16/49/333381649.db2.gz VPWHQAAJCSDTII-UHFFFAOYSA-N 1 1 299.320 4.515 20 0 CJADMO Clc1cccc(C2([NH2+]Cc3ccccc3Cl)CC2)c1 ZINC000237845637 334100378 /nfs/dbraw/zinc/10/03/78/334100378.db2.gz UUPIYUAPKFAGNB-UHFFFAOYSA-N 1 1 292.209 4.772 20 0 CJADMO Cc1cccc(C([NH2+]Cc2ccco2)c2cccc(C)c2)c1 ZINC000237924134 334102740 /nfs/dbraw/zinc/10/27/40/334102740.db2.gz FTONOIZLEBVOBE-UHFFFAOYSA-N 1 1 291.394 4.776 20 0 CJADMO C[C@H](c1ncc(C(C)(C)C)o1)[N@H+]1CC[C@@H](c2ccccc2)C1 ZINC000245461064 334195244 /nfs/dbraw/zinc/19/52/44/334195244.db2.gz FPNNBQBKXSFDEQ-GDBMZVCRSA-N 1 1 298.430 4.523 20 0 CJADMO C[C@@H](c1ncc(C(C)(C)C)o1)[N@H+]1CC[C@@H](c2ccccc2)C1 ZINC000245461066 334195173 /nfs/dbraw/zinc/19/51/73/334195173.db2.gz FPNNBQBKXSFDEQ-GOEBONIOSA-N 1 1 298.430 4.523 20 0 CJADMO C[C@H](c1nc2ccccc2o1)[N@H+]1C[C@@H](C)[C@@H]1c1ccccc1 ZINC000245545644 334202264 /nfs/dbraw/zinc/20/22/64/334202264.db2.gz LUMFYCZFWHGLIP-HBUWYVDXSA-N 1 1 292.382 4.582 20 0 CJADMO C[C@H](c1nc2ccccc2o1)[N@@H+]1C[C@@H](C)[C@@H]1c1ccccc1 ZINC000245545644 334202263 /nfs/dbraw/zinc/20/22/63/334202263.db2.gz LUMFYCZFWHGLIP-HBUWYVDXSA-N 1 1 292.382 4.582 20 0 CJADMO C[C@H](c1nc2ccccc2o1)[N@H+]1C[C@@H](C)[C@H]1c1ccccc1 ZINC000245545648 334202381 /nfs/dbraw/zinc/20/23/81/334202381.db2.gz LUMFYCZFWHGLIP-LBTNJELSSA-N 1 1 292.382 4.582 20 0 CJADMO C[C@H](c1nc2ccccc2o1)[N@@H+]1C[C@@H](C)[C@H]1c1ccccc1 ZINC000245545648 334202379 /nfs/dbraw/zinc/20/23/79/334202379.db2.gz LUMFYCZFWHGLIP-LBTNJELSSA-N 1 1 292.382 4.582 20 0 CJADMO C[C@@H](c1nc2ccccc2o1)[N@H+]1C[C@@H](C)[C@@H]1c1ccccc1 ZINC000245545652 334202339 /nfs/dbraw/zinc/20/23/39/334202339.db2.gz LUMFYCZFWHGLIP-QWQRMKEZSA-N 1 1 292.382 4.582 20 0 CJADMO C[C@@H](c1nc2ccccc2o1)[N@@H+]1C[C@@H](C)[C@@H]1c1ccccc1 ZINC000245545652 334202337 /nfs/dbraw/zinc/20/23/37/334202337.db2.gz LUMFYCZFWHGLIP-QWQRMKEZSA-N 1 1 292.382 4.582 20 0 CJADMO C[C@@H](c1nc2ccccc2o1)[N@H+]1CCC[C@H]1c1cccs1 ZINC000245560133 334203794 /nfs/dbraw/zinc/20/37/94/334203794.db2.gz WOSMHRXUKOJRGC-JSGCOSHPSA-N 1 1 298.411 4.787 20 0 CJADMO C[C@H](c1nc2ccccc2o1)[N@H+]1CCC[C@H]1c1cccs1 ZINC000245560134 334203941 /nfs/dbraw/zinc/20/39/41/334203941.db2.gz WOSMHRXUKOJRGC-OCCSQVGLSA-N 1 1 298.411 4.787 20 0 CJADMO c1ccc2sc([C@@H]3CCC[N@H+]3[C@@H]3C=CCCC3)nc2c1 ZINC000246107093 334233039 /nfs/dbraw/zinc/23/30/39/334233039.db2.gz KSCCGDNMIHXMLK-HIFRSBDPSA-N 1 1 284.428 4.542 20 0 CJADMO c1ccc2sc([C@H]3CCC[N@H+]3[C@@H]3C=CCCC3)nc2c1 ZINC000246107097 334233371 /nfs/dbraw/zinc/23/33/71/334233371.db2.gz KSCCGDNMIHXMLK-UKRRQHHQSA-N 1 1 284.428 4.542 20 0 CJADMO C[C@H](c1ncc(-c2ccc(Cl)cc2)o1)[N@H+]1CCC[C@@H]1C ZINC000246543651 334263945 /nfs/dbraw/zinc/26/39/45/334263945.db2.gz DBFLBJBBKJOTIT-NWDGAFQWSA-N 1 1 290.794 4.540 20 0 CJADMO C[C@H](c1ncc(-c2ccc(Cl)cc2)o1)[N@H+]1CCC[C@H]1C ZINC000246543658 334263978 /nfs/dbraw/zinc/26/39/78/334263978.db2.gz DBFLBJBBKJOTIT-VXGBXAGGSA-N 1 1 290.794 4.540 20 0 CJADMO Cc1c(Cl)c(C[N@@H+]2CCCC[C@@H]2C)nc2ccccc12 ZINC000247844737 334290863 /nfs/dbraw/zinc/29/08/63/334290863.db2.gz RWJJVEKCXGOCQJ-LBPRGKRZSA-N 1 1 288.822 4.571 20 0 CJADMO Cc1cccc(C[N@@H+](Cc2ccco2)Cc2cccs2)c1 ZINC000247894261 334291305 /nfs/dbraw/zinc/29/13/05/334291305.db2.gz GOZPCZXSKBZQAD-UHFFFAOYSA-N 1 1 297.423 4.852 20 0 CJADMO Cc1cccc(C[N@H+](Cc2ccco2)Cc2cccs2)c1 ZINC000247894261 334291304 /nfs/dbraw/zinc/29/13/04/334291304.db2.gz GOZPCZXSKBZQAD-UHFFFAOYSA-N 1 1 297.423 4.852 20 0 CJADMO c1coc(C[N@@H+](Cc2cccs2)Cc2ccccc2)c1 ZINC000247972158 334292688 /nfs/dbraw/zinc/29/26/88/334292688.db2.gz AYINAYFINSGCRZ-UHFFFAOYSA-N 1 1 283.396 4.544 20 0 CJADMO c1coc(C[N@H+](Cc2cccs2)Cc2ccccc2)c1 ZINC000247972158 334292686 /nfs/dbraw/zinc/29/26/86/334292686.db2.gz AYINAYFINSGCRZ-UHFFFAOYSA-N 1 1 283.396 4.544 20 0 CJADMO C[N@@H+](Cc1ccccc1Cl)Cc1cccc2cccnc21 ZINC000248014887 334293559 /nfs/dbraw/zinc/29/35/59/334293559.db2.gz CQXSNJXVCCQGOG-UHFFFAOYSA-N 1 1 296.801 4.520 20 0 CJADMO C[C@H](c1ccccc1Cl)[N@@H+](C)Cc1ccc(F)cc1 ZINC000248076172 334294278 /nfs/dbraw/zinc/29/42/78/334294278.db2.gz BWQMNHOHDQBDSR-GFCCVEGCSA-N 1 1 277.770 4.672 20 0 CJADMO C[C@H](c1ccccc1Cl)[N@H+](C)Cc1ccc(F)cc1 ZINC000248076172 334294277 /nfs/dbraw/zinc/29/42/77/334294277.db2.gz BWQMNHOHDQBDSR-GFCCVEGCSA-N 1 1 277.770 4.672 20 0 CJADMO Cc1ccc(C[N@@H+](Cc2ccco2)Cc2cccs2)cc1 ZINC000248107544 334294836 /nfs/dbraw/zinc/29/48/36/334294836.db2.gz PRDOJJSPNVKSBO-UHFFFAOYSA-N 1 1 297.423 4.852 20 0 CJADMO Cc1ccc(C[N@H+](Cc2ccco2)Cc2cccs2)cc1 ZINC000248107544 334294834 /nfs/dbraw/zinc/29/48/34/334294834.db2.gz PRDOJJSPNVKSBO-UHFFFAOYSA-N 1 1 297.423 4.852 20 0 CJADMO CC[N@@H+](Cc1cccs1)Cc1ccc(C(F)(F)F)cc1 ZINC000248244223 334297601 /nfs/dbraw/zinc/29/76/01/334297601.db2.gz ITMQZQICSVGFOD-UHFFFAOYSA-N 1 1 299.361 4.789 20 0 CJADMO CC[N@@H+](CCSc1ccccc1F)Cc1cccs1 ZINC000248254949 334297528 /nfs/dbraw/zinc/29/75/28/334297528.db2.gz NYLTXUNGXGXKLO-UHFFFAOYSA-N 1 1 295.448 4.501 20 0 CJADMO CCOc1ccc([C@H]2CCC[N@H+]2Cc2ccc(F)cc2)cc1 ZINC000248376662 334299570 /nfs/dbraw/zinc/29/95/70/334299570.db2.gz DEPCDAZFZQKSKG-LJQANCHMSA-N 1 1 299.389 4.562 20 0 CJADMO C[C@H](c1cccc(Cl)c1)[N@H+](C)C[C@H](C)c1nccs1 ZINC000248469138 334303199 /nfs/dbraw/zinc/30/31/99/334303199.db2.gz UOCMGJAKJLDVKS-NWDGAFQWSA-N 1 1 294.851 4.593 20 0 CJADMO C[C@H](C[N@@H+](C)[C@H](C)c1cccc(Cl)c1)c1nccs1 ZINC000248469140 334303278 /nfs/dbraw/zinc/30/32/78/334303278.db2.gz UOCMGJAKJLDVKS-VXGBXAGGSA-N 1 1 294.851 4.593 20 0 CJADMO C[C@H](c1ccccc1Cl)[N@H+](C)C[C@H](C)c1nccs1 ZINC000248472708 334303450 /nfs/dbraw/zinc/30/34/50/334303450.db2.gz WJOPPHNGJWFOHX-NWDGAFQWSA-N 1 1 294.851 4.593 20 0 CJADMO C[C@H](C[N@@H+](C)[C@H](C)c1ccccc1Cl)c1nccs1 ZINC000248472709 334303513 /nfs/dbraw/zinc/30/35/13/334303513.db2.gz WJOPPHNGJWFOHX-VXGBXAGGSA-N 1 1 294.851 4.593 20 0 CJADMO C[C@@H](C[N@@H+](C)[C@H](C)c1ccncc1)c1cccc(Cl)c1 ZINC000249776218 334340360 /nfs/dbraw/zinc/34/03/60/334340360.db2.gz KIOGYQMFGBHZAI-UONOGXRCSA-N 1 1 288.822 4.532 20 0 CJADMO C[C@H](c1ccncc1)[N@H+](C)C[C@@H](C)c1cccc(Cl)c1 ZINC000249776221 334340409 /nfs/dbraw/zinc/34/04/09/334340409.db2.gz KIOGYQMFGBHZAI-ZIAGYGMSSA-N 1 1 288.822 4.532 20 0 CJADMO C[C@@H](C[N@@H+](C)[C@H](C)c1cccnc1)c1cccc(Cl)c1 ZINC000249966738 334342252 /nfs/dbraw/zinc/34/22/52/334342252.db2.gz XBJFKNROWQUMRO-UONOGXRCSA-N 1 1 288.822 4.532 20 0 CJADMO C[C@H](c1cccnc1)[N@H+](C)C[C@@H](C)c1cccc(Cl)c1 ZINC000249966741 334342248 /nfs/dbraw/zinc/34/22/48/334342248.db2.gz XBJFKNROWQUMRO-ZIAGYGMSSA-N 1 1 288.822 4.532 20 0 CJADMO C[C@@H](C[N@@H+](C)[C@H](C)c1ccccn1)c1cccc(Cl)c1 ZINC000249990791 334342555 /nfs/dbraw/zinc/34/25/55/334342555.db2.gz ZSFOXVILAGUCKQ-UONOGXRCSA-N 1 1 288.822 4.532 20 0 CJADMO C[C@H](c1ccccn1)[N@H+](C)C[C@@H](C)c1cccc(Cl)c1 ZINC000249990796 334342625 /nfs/dbraw/zinc/34/26/25/334342625.db2.gz ZSFOXVILAGUCKQ-ZIAGYGMSSA-N 1 1 288.822 4.532 20 0 CJADMO C[C@@H](c1ccccc1)[N@@H+](C)Cc1ccc(C(F)(F)F)cc1 ZINC000252010571 334372885 /nfs/dbraw/zinc/37/28/85/334372885.db2.gz RTAVTIZLSYCBKT-ZDUSSCGKSA-N 1 1 293.332 4.898 20 0 CJADMO CC(C)c1nc([C@@H](C)[NH2+]C/C=C\c2ccccc2)cs1 ZINC000255770483 327014504 /nfs/dbraw/zinc/01/45/04/327014504.db2.gz KKNAEYCCLWZATM-JKEYDSJLSA-N 1 1 286.444 4.631 20 0 CJADMO CC(C)c1nc([C@H](C)[NH2+]C/C=C\c2ccccc2)cs1 ZINC000255770515 327014443 /nfs/dbraw/zinc/01/44/43/327014443.db2.gz KKNAEYCCLWZATM-YHAOYDPOSA-N 1 1 286.444 4.631 20 0 CJADMO CCCO[C@H]1CCC[N@H+]([C@H](C)c2ccccc2Cl)CC1 ZINC000255961242 327042820 /nfs/dbraw/zinc/04/28/20/327042820.db2.gz XDPJYNYYHUIAOU-CABCVRRESA-N 1 1 295.854 4.682 20 0 CJADMO CCCO[C@@H]1CCC[N@H+]([C@H](C)c2ccccc2Cl)CC1 ZINC000255961243 327042998 /nfs/dbraw/zinc/04/29/98/327042998.db2.gz XDPJYNYYHUIAOU-HUUCEWRRSA-N 1 1 295.854 4.682 20 0 CJADMO Cc1nc([C@@H](C)[NH2+][C@H]2CC(C)(C)c3ccccc32)cs1 ZINC000268959894 328187367 /nfs/dbraw/zinc/18/73/67/328187367.db2.gz WZYOATAGVOCNCA-ABAIWWIYSA-N 1 1 286.444 4.525 20 0 CJADMO Cc1nc([C@@H](C)[NH2+][C@@H]2CC(C)(C)c3ccccc32)cs1 ZINC000268959896 328187231 /nfs/dbraw/zinc/18/72/31/328187231.db2.gz WZYOATAGVOCNCA-IAQYHMDHSA-N 1 1 286.444 4.525 20 0 CJADMO Cc1nc([C@H](C)[NH2+][C@H]2CC(C)(C)c3ccccc32)cs1 ZINC000268959897 328187444 /nfs/dbraw/zinc/18/74/44/328187444.db2.gz WZYOATAGVOCNCA-NHYWBVRUSA-N 1 1 286.444 4.525 20 0 CJADMO Cc1nc([C@H](C)[NH2+][C@@H]2CC(C)(C)c3ccccc32)cs1 ZINC000268959899 328187400 /nfs/dbraw/zinc/18/74/00/328187400.db2.gz WZYOATAGVOCNCA-XHDPSFHLSA-N 1 1 286.444 4.525 20 0 CJADMO Cc1cccc([C@@H]([NH2+][C@H](C)c2cscn2)C(C)(C)C)c1 ZINC000271176588 524838421 /nfs/dbraw/zinc/83/84/21/524838421.db2.gz VBWWVMDIDCXCAM-CZUORRHYSA-N 1 1 288.460 4.890 20 0 CJADMO C[C@H]([NH2+][C@@H]1CCC(C)(C)c2ccccc21)c1cscn1 ZINC000271415192 525551487 /nfs/dbraw/zinc/55/14/87/525551487.db2.gz AQNHDUYDZNPSNR-SWLSCSKDSA-N 1 1 286.444 4.606 20 0 CJADMO Cc1ccncc1[C@H](C)[NH2+][C@@H](C)c1c(F)cccc1Cl ZINC000271432379 525768595 /nfs/dbraw/zinc/76/85/95/525768595.db2.gz CDZRMXDIPSEXMR-RYUDHWBXSA-N 1 1 292.785 4.594 20 0 CJADMO Cc1cnc(C(C)(C)[NH2+][C@H](C)c2ccc(Cl)cc2)s1 ZINC000272285277 328199730 /nfs/dbraw/zinc/19/97/30/328199730.db2.gz PHNQEIMUWPVWSL-LLVKDONJSA-N 1 1 294.851 4.691 20 0 CJADMO Cc1cnc(C(C)(C)[NH2+][C@@H](C)c2ccc(Cl)cc2)s1 ZINC000272285279 328199566 /nfs/dbraw/zinc/19/95/66/328199566.db2.gz PHNQEIMUWPVWSL-NSHDSACASA-N 1 1 294.851 4.691 20 0 CJADMO C[C@@H]([NH2+][C@H](CC1CCC1)c1ccccc1)c1cscn1 ZINC000272562703 525667254 /nfs/dbraw/zinc/66/72/54/525667254.db2.gz FCFDFAFNKJDUTR-CZUORRHYSA-N 1 1 286.444 4.725 20 0 CJADMO Cc1cncc([C@@H](C)[NH2+]Cc2ccc(Cl)cc2Cl)c1 ZINC000274593859 526211404 /nfs/dbraw/zinc/21/14/04/526211404.db2.gz KININLOHRWHJOE-LLVKDONJSA-N 1 1 295.213 4.548 20 0 CJADMO C[C@H]([NH2+][C@@H](C)c1ccccc1Cl)c1ccc(Cl)cn1 ZINC000274815442 525533659 /nfs/dbraw/zinc/53/36/59/525533659.db2.gz ZCBWIXSTOUIFPF-QWRGUYRKSA-N 1 1 295.213 4.800 20 0 CJADMO C[C@@H]([NH2+][C@@H](C)c1ccccc1Cl)c1ccc(Cl)cn1 ZINC000274815443 525615262 /nfs/dbraw/zinc/61/52/62/525615262.db2.gz ZCBWIXSTOUIFPF-WDEREUQCSA-N 1 1 295.213 4.800 20 0 CJADMO CC(C)c1ccc2c(c1)[C@H]([NH2+][C@@H](C)c1cscn1)CC2 ZINC000275123053 519840620 /nfs/dbraw/zinc/84/06/20/519840620.db2.gz LLENDWKCALCOOV-BLLLJJGKSA-N 1 1 286.444 4.605 20 0 CJADMO CC(C)c1ccc2c(c1)[C@@H]([NH2+][C@@H](C)c1cscn1)CC2 ZINC000275123055 519840588 /nfs/dbraw/zinc/84/05/88/519840588.db2.gz LLENDWKCALCOOV-LRDDRELGSA-N 1 1 286.444 4.605 20 0 CJADMO CC(C)c1ccc2c(c1)[C@H]([NH2+][C@H](C)c1cscn1)CC2 ZINC000275123057 519840678 /nfs/dbraw/zinc/84/06/78/519840678.db2.gz LLENDWKCALCOOV-MLGOLLRUSA-N 1 1 286.444 4.605 20 0 CJADMO CC(C)c1ccc2c(c1)[C@@H]([NH2+][C@H](C)c1cscn1)CC2 ZINC000275123058 519840661 /nfs/dbraw/zinc/84/06/61/519840661.db2.gz LLENDWKCALCOOV-WBMJQRKESA-N 1 1 286.444 4.605 20 0 CJADMO C[C@H]([NH2+]C1CC(F)(F)C1)c1cc(Cl)sc1Cl ZINC000277022626 334808973 /nfs/dbraw/zinc/80/89/73/334808973.db2.gz DKBKTSCOHJYOSG-YFKPBYRVSA-N 1 1 286.174 4.503 20 0 CJADMO Cc1nc([C@@H](C)[NH2+]Cc2ccc(C3CCC3)cc2)cs1 ZINC000277211392 527032201 /nfs/dbraw/zinc/03/22/01/527032201.db2.gz KYTBNPHGUBKHMV-GFCCVEGCSA-N 1 1 286.444 4.570 20 0 CJADMO Cc1nc([C@H](C)[NH2+]Cc2ccc(C3CCC3)cc2)cs1 ZINC000277211394 527063930 /nfs/dbraw/zinc/06/39/30/527063930.db2.gz KYTBNPHGUBKHMV-LBPRGKRZSA-N 1 1 286.444 4.570 20 0 CJADMO CCC(CC)c1cc(C[NH2+][C@H](C)c2cc(C)oc2C)on1 ZINC000278701782 521633999 /nfs/dbraw/zinc/63/39/99/521633999.db2.gz LCRVDKBGEKFTLS-GFCCVEGCSA-N 1 1 290.407 4.639 20 0 CJADMO CCC(CC)c1cc(C[NH2+][C@@H](C)c2cc(C)oc2C)on1 ZINC000278701787 521633470 /nfs/dbraw/zinc/63/34/70/521633470.db2.gz LCRVDKBGEKFTLS-LBPRGKRZSA-N 1 1 290.407 4.639 20 0 CJADMO CC[C@@H]([NH2+]Cc1cccc(C(F)F)c1)c1nc(C)cs1 ZINC000279690071 522880461 /nfs/dbraw/zinc/88/04/61/522880461.db2.gz HTEQYGZBGPFJTP-CYBMUJFWSA-N 1 1 296.386 4.630 20 0 CJADMO CC[C@H]([NH2+]Cc1cccc(C(F)F)c1)c1nc(C)cs1 ZINC000279690076 522651212 /nfs/dbraw/zinc/65/12/12/522651212.db2.gz HTEQYGZBGPFJTP-ZDUSSCGKSA-N 1 1 296.386 4.630 20 0 CJADMO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1cccc(C(F)F)c1 ZINC000279728567 523120753 /nfs/dbraw/zinc/12/07/53/523120753.db2.gz NKQORSBRWVUYHX-INIZCTEOSA-N 1 1 290.357 4.602 20 0 CJADMO CC[C@H](c1ccncc1)[N@@H+](C)Cc1cccc(C(F)F)c1 ZINC000279728569 522967134 /nfs/dbraw/zinc/96/71/34/522967134.db2.gz NKQORSBRWVUYHX-MRXNPFEDSA-N 1 1 290.357 4.602 20 0 CJADMO CC(C)[C@H]1C[C@@H]([NH2+][C@@H](C)c2nccs2)c2ccccc21 ZINC000280079469 519827402 /nfs/dbraw/zinc/82/74/02/519827402.db2.gz MTDPSILIRFFZRU-APHBMKBZSA-N 1 1 286.444 4.678 20 0 CJADMO CC(C)[C@H]1C[C@@H]([NH2+][C@H](C)c2nccs2)c2ccccc21 ZINC000280079477 519827446 /nfs/dbraw/zinc/82/74/46/519827446.db2.gz MTDPSILIRFFZRU-DAXOMENPSA-N 1 1 286.444 4.678 20 0 CJADMO CC(C)[C@H]1C[C@@H]([NH2+][C@@H](C)c2cscn2)c2ccccc21 ZINC000280157561 519827399 /nfs/dbraw/zinc/82/73/99/519827399.db2.gz SCCIFGRDIGKIOW-APHBMKBZSA-N 1 1 286.444 4.678 20 0 CJADMO CC(C)[C@H]1C[C@@H]([NH2+][C@H](C)c2cscn2)c2ccccc21 ZINC000280157564 519827448 /nfs/dbraw/zinc/82/74/48/519827448.db2.gz SCCIFGRDIGKIOW-DAXOMENPSA-N 1 1 286.444 4.678 20 0 CJADMO Cc1cc([C@@H](C)[NH2+]Cc2cc(C(C)(C)C)on2)c(C)s1 ZINC000280913229 525465124 /nfs/dbraw/zinc/46/51/24/525465124.db2.gz FSYJAUCNRTVQFK-LLVKDONJSA-N 1 1 292.448 4.501 20 0 CJADMO Cc1cc([C@H](C)[NH2+]Cc2cc(C(C)(C)C)on2)c(C)s1 ZINC000280913235 525520521 /nfs/dbraw/zinc/52/05/21/525520521.db2.gz FSYJAUCNRTVQFK-NSHDSACASA-N 1 1 292.448 4.501 20 0 CJADMO CSc1ccccc1[C@@H](C)[NH2+][C@H](C)c1csc(C)n1 ZINC000282455082 526188406 /nfs/dbraw/zinc/18/84/06/526188406.db2.gz FREAMDYLCXUIDE-GHMZBOCLSA-N 1 1 292.473 4.585 20 0 CJADMO Cc1cc([C@H](C)[NH2+][C@@H]2C[C@H](C(C)C)c3ccccc32)no1 ZINC000285048319 263089488 /nfs/dbraw/zinc/08/94/88/263089488.db2.gz IIQBKAQMPVMMIV-FDQGKXFDSA-N 1 1 284.403 4.518 20 0 CJADMO Cc1cc([C@@H](C)[NH2+][C@@H]2C[C@H](C(C)C)c3ccccc32)no1 ZINC000285048324 263089494 /nfs/dbraw/zinc/08/94/94/263089494.db2.gz IIQBKAQMPVMMIV-MZMPZRCHSA-N 1 1 284.403 4.518 20 0 CJADMO CCC[C@H]([NH2+][C@@H](C)c1c(F)cncc1F)c1ccccc1 ZINC000285788989 521169885 /nfs/dbraw/zinc/16/98/85/521169885.db2.gz VCVHQQNAXWBFNX-LRDDRELGSA-N 1 1 290.357 4.552 20 0 CJADMO Cc1ccccc1[C@H]([NH2+]Cc1cc(C(C)(C)C)on1)C1CC1 ZINC000289312542 263109120 /nfs/dbraw/zinc/10/91/20/263109120.db2.gz CWMILDACJJJVAY-GOSISDBHSA-N 1 1 298.430 4.521 20 0 CJADMO Cc1ccccc1[C@@H]([NH2+]Cc1cc(C(C)(C)C)on1)C1CC1 ZINC000289312554 263108941 /nfs/dbraw/zinc/10/89/41/263108941.db2.gz CWMILDACJJJVAY-SFHVURJKSA-N 1 1 298.430 4.521 20 0 CJADMO Cc1cc([C@H](C)[NH2+][C@H](c2ccc(F)cc2)C(C)(C)C)no1 ZINC000289596137 525530174 /nfs/dbraw/zinc/53/01/74/525530174.db2.gz FRWOWGGMSXOEPF-BLLLJJGKSA-N 1 1 290.382 4.560 20 0 CJADMO Cc1cc([C@H](C)[NH2+][C@@H](c2ccc(F)cc2)C(C)(C)C)no1 ZINC000289596144 525524844 /nfs/dbraw/zinc/52/48/44/525524844.db2.gz FRWOWGGMSXOEPF-LRDDRELGSA-N 1 1 290.382 4.560 20 0 CJADMO Cc1cc([C@@H](C)[NH2+][C@H](c2ccc(F)cc2)C(C)(C)C)no1 ZINC000289596149 525473333 /nfs/dbraw/zinc/47/33/33/525473333.db2.gz FRWOWGGMSXOEPF-MLGOLLRUSA-N 1 1 290.382 4.560 20 0 CJADMO Cc1cc([C@@H](C)[NH2+][C@@H](c2ccc(F)cc2)C(C)(C)C)no1 ZINC000289596154 525471640 /nfs/dbraw/zinc/47/16/40/525471640.db2.gz FRWOWGGMSXOEPF-WBMJQRKESA-N 1 1 290.382 4.560 20 0 CJADMO Cc1cc([C@@H](C)[NH2+][C@H](CC(C)C)c2ccccc2C)no1 ZINC000289973955 525474498 /nfs/dbraw/zinc/47/44/98/525474498.db2.gz XMDSOAIIHRSMHL-CRAIPNDOSA-N 1 1 286.419 4.729 20 0 CJADMO Cc1cc([C@H](C)[NH2+][C@H](CC(C)C)c2ccccc2C)no1 ZINC000289973962 525530424 /nfs/dbraw/zinc/53/04/24/525530424.db2.gz XMDSOAIIHRSMHL-MAUKXSAKSA-N 1 1 286.419 4.729 20 0 CJADMO Cc1cc([C@@H](C)[NH2+][C@@H](CC(C)C)c2ccccc2C)no1 ZINC000289973968 525471010 /nfs/dbraw/zinc/47/10/10/525471010.db2.gz XMDSOAIIHRSMHL-QAPCUYQASA-N 1 1 286.419 4.729 20 0 CJADMO Cc1cc([C@H](C)[NH2+][C@@H](CC(C)C)c2ccccc2C)no1 ZINC000289973972 525526352 /nfs/dbraw/zinc/52/63/52/525526352.db2.gz XMDSOAIIHRSMHL-YJBOKZPZSA-N 1 1 286.419 4.729 20 0 CJADMO Cc1nc([C@H](C)[NH2+]Cc2ccc3sccc3c2)cs1 ZINC000289986588 527064095 /nfs/dbraw/zinc/06/40/95/527064095.db2.gz YDVKRDWPQCTARA-JTQLQIEISA-N 1 1 288.441 4.517 20 0 CJADMO Cc1nc([C@@H](C)[NH2+]Cc2ccc3sccc3c2)cs1 ZINC000289986592 527032906 /nfs/dbraw/zinc/03/29/06/527032906.db2.gz YDVKRDWPQCTARA-SNVBAGLBSA-N 1 1 288.441 4.517 20 0 CJADMO C[C@@H](Nc1cc(C2CC2)cc[nH+]1)c1nccc2ccccc21 ZINC000290059403 525696921 /nfs/dbraw/zinc/69/69/21/525696921.db2.gz FLZAUWZNAYZZSO-CYBMUJFWSA-N 1 1 289.382 4.680 20 0 CJADMO C[C@H](Nc1cc(C2CC2)cc[nH+]1)c1nccc2ccccc21 ZINC000290059407 525643597 /nfs/dbraw/zinc/64/35/97/525643597.db2.gz FLZAUWZNAYZZSO-ZDUSSCGKSA-N 1 1 289.382 4.680 20 0 CJADMO Cc1ccccc1[C@@H]([NH2+]Cc1csc(Cl)n1)C(C)C ZINC000290112788 525374335 /nfs/dbraw/zinc/37/43/35/525374335.db2.gz SVNXPXVJAWNIRA-AWEZNQCLSA-N 1 1 294.851 4.592 20 0 CJADMO Cc1ccccc1[C@H]([NH2+]Cc1csc(Cl)n1)C(C)C ZINC000290112794 525429973 /nfs/dbraw/zinc/42/99/73/525429973.db2.gz SVNXPXVJAWNIRA-CQSZACIVSA-N 1 1 294.851 4.592 20 0 CJADMO CC(C)(C)[C@H]([NH2+]Cc1csc(Cl)n1)c1ccccc1 ZINC000290128823 518968033 /nfs/dbraw/zinc/96/80/33/518968033.db2.gz UXFRAZLIRVPCIE-CYBMUJFWSA-N 1 1 294.851 4.674 20 0 CJADMO CC(C)(C)[C@@H]([NH2+]Cc1csc(Cl)n1)c1ccccc1 ZINC000290128827 518928466 /nfs/dbraw/zinc/92/84/66/518928466.db2.gz UXFRAZLIRVPCIE-ZDUSSCGKSA-N 1 1 294.851 4.674 20 0 CJADMO Cc1cc([C@@H](C)[NH2+][C@@H](c2ccccc2C)C(C)(C)C)no1 ZINC000290783761 525471664 /nfs/dbraw/zinc/47/16/64/525471664.db2.gz UCPCCJJEVCCCPA-PBHICJAKSA-N 1 1 286.419 4.729 20 0 CJADMO Cc1cc([C@@H](C)[NH2+][C@H](c2ccccc2C)C(C)(C)C)no1 ZINC000290783765 525475104 /nfs/dbraw/zinc/47/51/04/525475104.db2.gz UCPCCJJEVCCCPA-RHSMWYFYSA-N 1 1 286.419 4.729 20 0 CJADMO Cc1cc([C@H](C)[NH2+][C@H](c2ccccc2C)C(C)(C)C)no1 ZINC000290783767 525530206 /nfs/dbraw/zinc/53/02/06/525530206.db2.gz UCPCCJJEVCCCPA-WMLDXEAASA-N 1 1 286.419 4.729 20 0 CJADMO Cc1cc([C@H](C)[NH2+][C@@H](c2ccccc2C)C(C)(C)C)no1 ZINC000290783769 525527957 /nfs/dbraw/zinc/52/79/57/525527957.db2.gz UCPCCJJEVCCCPA-YOEHRIQHSA-N 1 1 286.419 4.729 20 0 CJADMO CC(C)[N@@H+](Cc1ncc(C2CC2)o1)[C@@H](C)c1ccccc1 ZINC000292239225 519663947 /nfs/dbraw/zinc/66/39/47/519663947.db2.gz QCVJEXHLJKCFPC-AWEZNQCLSA-N 1 1 284.403 4.524 20 0 CJADMO CC(C)[N@H+](Cc1ncc(C2CC2)o1)[C@@H](C)c1ccccc1 ZINC000292239225 519663946 /nfs/dbraw/zinc/66/39/46/519663946.db2.gz QCVJEXHLJKCFPC-AWEZNQCLSA-N 1 1 284.403 4.524 20 0 CJADMO CC(C)[N@@H+](Cc1ncc(C2CC2)o1)[C@H](C)c1ccccc1 ZINC000292239228 519663549 /nfs/dbraw/zinc/66/35/49/519663549.db2.gz QCVJEXHLJKCFPC-CQSZACIVSA-N 1 1 284.403 4.524 20 0 CJADMO CC(C)[N@H+](Cc1ncc(C2CC2)o1)[C@H](C)c1ccccc1 ZINC000292239228 519663546 /nfs/dbraw/zinc/66/35/46/519663546.db2.gz QCVJEXHLJKCFPC-CQSZACIVSA-N 1 1 284.403 4.524 20 0 CJADMO c1sc(C[NH2+]Cc2ccc(C3CCC3)cc2)nc1C1CC1 ZINC000293291958 526632612 /nfs/dbraw/zinc/63/26/12/526632612.db2.gz OXBFZCWVHFJFCS-UHFFFAOYSA-N 1 1 298.455 4.578 20 0 CJADMO C[C@@H]([NH2+][C@@H]1CCCc2sc(Cl)cc21)c1cscn1 ZINC000293327315 525640653 /nfs/dbraw/zinc/64/06/53/525640653.db2.gz FUPBYFDPFAHTIO-PSASIEDQSA-N 1 1 298.864 4.586 20 0 CJADMO C[C@@H]([NH2+][C@H]1CCCc2sc(Cl)cc21)c1cscn1 ZINC000293327321 525682353 /nfs/dbraw/zinc/68/23/53/525682353.db2.gz FUPBYFDPFAHTIO-SCZZXKLOSA-N 1 1 298.864 4.586 20 0 CJADMO C[C@H]([NH2+][C@@H]1CCCc2sc(Cl)cc21)c1cscn1 ZINC000293327325 525563455 /nfs/dbraw/zinc/56/34/55/525563455.db2.gz FUPBYFDPFAHTIO-WCBMZHEXSA-N 1 1 298.864 4.586 20 0 CJADMO C[C@H]([NH2+][C@H]1CCCc2sc(Cl)cc21)c1cscn1 ZINC000293327329 525613982 /nfs/dbraw/zinc/61/39/82/525613982.db2.gz FUPBYFDPFAHTIO-WPRPVWTQSA-N 1 1 298.864 4.586 20 0 CJADMO CCCc1nc(C)c(C[NH2+][C@@H](C)c2ccc(Cl)s2)o1 ZINC000293380399 521497956 /nfs/dbraw/zinc/49/79/56/521497956.db2.gz IGLKCRZDOBRIGS-JTQLQIEISA-N 1 1 298.839 4.501 20 0 CJADMO CCCc1nc(C)c(C[NH2+][C@H](C)c2ccc(Cl)s2)o1 ZINC000293380403 521499362 /nfs/dbraw/zinc/49/93/62/521499362.db2.gz IGLKCRZDOBRIGS-SNVBAGLBSA-N 1 1 298.839 4.501 20 0 CJADMO CCn1ccnc1[C@@H](C)[NH2+][C@H](C)c1ccc(C(C)(C)C)cc1 ZINC000296189414 523553234 /nfs/dbraw/zinc/55/32/34/523553234.db2.gz YNZRYUNSZHIKEY-HUUCEWRRSA-N 1 1 299.462 4.612 20 0 CJADMO c1ccc(C[N@H+]2CCC[C@H]2c2nc3ccccc3s2)cc1 ZINC000301603587 333330876 /nfs/dbraw/zinc/33/08/76/333330876.db2.gz CBDOOSWFHZTLPY-INIZCTEOSA-N 1 1 294.423 4.633 20 0 CJADMO c1ccc(C[N@H+]2CCC[C@@H]2c2nc3ccccc3s2)cc1 ZINC000301603588 333330924 /nfs/dbraw/zinc/33/09/24/333330924.db2.gz CBDOOSWFHZTLPY-MRXNPFEDSA-N 1 1 294.423 4.633 20 0 CJADMO COc1ccc2oc([C@@H](C)Nc3cccc(C)[nH+]3)c(C)c2c1 ZINC000302022566 533358985 /nfs/dbraw/zinc/35/89/85/533358985.db2.gz OOZMLHWBUYJEQQ-CYBMUJFWSA-N 1 1 296.370 4.626 20 0 CJADMO CCSc1ccc([C@@H](C)Nc2cccc(C)[nH+]2)cc1 ZINC000302031134 529246803 /nfs/dbraw/zinc/24/68/03/529246803.db2.gz SCIZBHALDIYXEF-CYBMUJFWSA-N 1 1 272.417 4.675 20 0 CJADMO Cc1ccc(C[N@H+](C)[C@@H](C)c2nc3ccccc3s2)cc1 ZINC000302593341 328309582 /nfs/dbraw/zinc/30/95/82/328309582.db2.gz BATSYDDOGGOLQD-AWEZNQCLSA-N 1 1 296.439 4.798 20 0 CJADMO Cc1ccc(C[N@@H+](C)[C@@H](C)c2nc3ccccc3s2)cc1 ZINC000302593341 328309581 /nfs/dbraw/zinc/30/95/81/328309581.db2.gz BATSYDDOGGOLQD-AWEZNQCLSA-N 1 1 296.439 4.798 20 0 CJADMO Cc1ccccc1C[N@H+](C)[C@@H](C)c1nc2ccccc2s1 ZINC000302595480 328309467 /nfs/dbraw/zinc/30/94/67/328309467.db2.gz DHKNPAHFWFASJE-AWEZNQCLSA-N 1 1 296.439 4.798 20 0 CJADMO Cc1ccccc1C[N@H+](C)[C@H](C)c1nc2ccccc2s1 ZINC000302595483 328309559 /nfs/dbraw/zinc/30/95/59/328309559.db2.gz DHKNPAHFWFASJE-CQSZACIVSA-N 1 1 296.439 4.798 20 0 CJADMO CCC[N@@H+](Cc1ccccc1)Cc1ccc2ccccc2n1 ZINC000302760337 333335204 /nfs/dbraw/zinc/33/52/04/333335204.db2.gz VFRIFJQWLIROHI-UHFFFAOYSA-N 1 1 290.410 4.647 20 0 CJADMO C[C@@H](c1nc2ccccc2s1)[N@@H+](C)CCc1ccccc1 ZINC000302769634 328319302 /nfs/dbraw/zinc/31/93/02/328319302.db2.gz XTRLNVPCOMIPJQ-AWEZNQCLSA-N 1 1 296.439 4.532 20 0 CJADMO C[C@H](c1nc2ccccc2s1)[N@@H+](C)CCc1ccccc1 ZINC000302769636 328319081 /nfs/dbraw/zinc/31/90/81/328319081.db2.gz XTRLNVPCOMIPJQ-CQSZACIVSA-N 1 1 296.439 4.532 20 0 CJADMO C[C@H](c1ccc(F)cc1)[N@@H+](C)Cc1cccc(Cl)c1 ZINC000302807391 333335346 /nfs/dbraw/zinc/33/53/46/333335346.db2.gz FHZROPNUTZJEHY-GFCCVEGCSA-N 1 1 277.770 4.672 20 0 CJADMO C[C@@H](c1ccc(F)cc1)[N@@H+](C)Cc1cccc(Cl)c1 ZINC000302807392 333335331 /nfs/dbraw/zinc/33/53/31/333335331.db2.gz FHZROPNUTZJEHY-LBPRGKRZSA-N 1 1 277.770 4.672 20 0 CJADMO C[C@H](c1ccc(F)cc1)[N@H+]1CCC[C@H]1c1cccs1 ZINC000302819173 328314272 /nfs/dbraw/zinc/31/42/72/328314272.db2.gz VFMHJBJXOYWICV-DOMZBBRYSA-N 1 1 275.392 4.785 20 0 CJADMO C[C@H](c1ccc(F)cc1)[N@H+]1CCC[C@@H]1c1cccs1 ZINC000302819176 328314449 /nfs/dbraw/zinc/31/44/49/328314449.db2.gz VFMHJBJXOYWICV-IUODEOHRSA-N 1 1 275.392 4.785 20 0 CJADMO C[C@@H](c1ccc(F)cc1)[N@H+]1CCC[C@@H]1c1cccs1 ZINC000302819178 328314337 /nfs/dbraw/zinc/31/43/37/328314337.db2.gz VFMHJBJXOYWICV-SWLSCSKDSA-N 1 1 275.392 4.785 20 0 CJADMO C[C@@H](c1ccc(F)cc1)[N@H+]1CCC[C@H]1c1cccs1 ZINC000302819181 328314293 /nfs/dbraw/zinc/31/42/93/328314293.db2.gz VFMHJBJXOYWICV-WFASDCNBSA-N 1 1 275.392 4.785 20 0 CJADMO CC(C)[N@@H+](Cc1ccccc1)Cc1ccc2ccccc2n1 ZINC000302832360 333335649 /nfs/dbraw/zinc/33/56/49/333335649.db2.gz HNAHLRXPKVLAAY-UHFFFAOYSA-N 1 1 290.410 4.645 20 0 CJADMO c1coc(C[N@H+](CCc2ccccc2)Cc2cccs2)c1 ZINC000302836473 333335615 /nfs/dbraw/zinc/33/56/15/333335615.db2.gz GKKVSNLVOHTPCD-UHFFFAOYSA-N 1 1 297.423 4.586 20 0 CJADMO CC[C@H]1c2ccsc2CC[N@@H+]1Cc1ccc(F)c(F)c1 ZINC000302856497 333335683 /nfs/dbraw/zinc/33/56/83/333335683.db2.gz NFJNMHUUHGKSJZ-HNNXBMFYSA-N 1 1 293.382 4.536 20 0 CJADMO CC[C@H]1c2ccsc2CC[N@H+]1Cc1ccc(F)c(F)c1 ZINC000302856497 333335682 /nfs/dbraw/zinc/33/56/82/333335682.db2.gz NFJNMHUUHGKSJZ-HNNXBMFYSA-N 1 1 293.382 4.536 20 0 CJADMO CC[C@@H]1c2ccsc2CC[N@@H+]1Cc1ccc(F)c(F)c1 ZINC000302856499 333335697 /nfs/dbraw/zinc/33/56/97/333335697.db2.gz NFJNMHUUHGKSJZ-OAHLLOKOSA-N 1 1 293.382 4.536 20 0 CJADMO CC[C@@H]1c2ccsc2CC[N@H+]1Cc1ccc(F)c(F)c1 ZINC000302856499 333335696 /nfs/dbraw/zinc/33/56/96/333335696.db2.gz NFJNMHUUHGKSJZ-OAHLLOKOSA-N 1 1 293.382 4.536 20 0 CJADMO C[C@H](Nc1cc[nH+]c2cc(Cl)ccc12)c1cccc(O)c1 ZINC000302900676 261355805 /nfs/dbraw/zinc/35/58/05/261355805.db2.gz SSTYDXMZNRRHCK-NSHDSACASA-N 1 1 298.773 4.767 20 0 CJADMO C[N@@H+](Cc1ccco1)Cc1sc2ccccc2c1Cl ZINC000302907001 333335855 /nfs/dbraw/zinc/33/58/55/333335855.db2.gz BEGLWOFWRPXLNK-UHFFFAOYSA-N 1 1 291.803 4.780 20 0 CJADMO C[N@H+](Cc1ccco1)Cc1sc2ccccc2c1Cl ZINC000302907001 333335854 /nfs/dbraw/zinc/33/58/54/333335854.db2.gz BEGLWOFWRPXLNK-UHFFFAOYSA-N 1 1 291.803 4.780 20 0 CJADMO CCCO[C@H]1CCC[N@@H+](Cc2cccc3ccccc32)CC1 ZINC000303366055 328341938 /nfs/dbraw/zinc/34/19/38/328341938.db2.gz INXDOKYYUNTCFE-IBGZPJMESA-N 1 1 297.442 4.621 20 0 CJADMO CCCO[C@@H]1CCC[N@@H+](Cc2cccc3ccccc32)CC1 ZINC000303366056 328341857 /nfs/dbraw/zinc/34/18/57/328341857.db2.gz INXDOKYYUNTCFE-LJQANCHMSA-N 1 1 297.442 4.621 20 0 CJADMO CCCO[C@H]1CCC[N@H+]([C@H](C)c2cccc(Cl)c2)CC1 ZINC000303388566 328349683 /nfs/dbraw/zinc/34/96/83/328349683.db2.gz OGUGZQFIEFGPNQ-PBHICJAKSA-N 1 1 295.854 4.682 20 0 CJADMO CCCO[C@@H]1CCC[N@H+]([C@H](C)c2cccc(Cl)c2)CC1 ZINC000303388569 328349665 /nfs/dbraw/zinc/34/96/65/328349665.db2.gz OGUGZQFIEFGPNQ-RHSMWYFYSA-N 1 1 295.854 4.682 20 0 CJADMO CCCO[C@@H]1CCC[N@H+]([C@@H](C)c2cccc(Cl)c2)CC1 ZINC000303388572 328349808 /nfs/dbraw/zinc/34/98/08/328349808.db2.gz OGUGZQFIEFGPNQ-WMLDXEAASA-N 1 1 295.854 4.682 20 0 CJADMO CCCO[C@H]1CCC[N@H+]([C@@H](C)c2cccc(Cl)c2)CC1 ZINC000303388575 328349904 /nfs/dbraw/zinc/34/99/04/328349904.db2.gz OGUGZQFIEFGPNQ-YOEHRIQHSA-N 1 1 295.854 4.682 20 0 CJADMO CC[N@@H+](Cc1csc(-c2ccoc2)n1)C1CCCCC1 ZINC000303424258 333342015 /nfs/dbraw/zinc/34/20/15/333342015.db2.gz ZFZMUDUKFUEUPX-UHFFFAOYSA-N 1 1 290.432 4.558 20 0 CJADMO C[C@H](c1ccccc1)[N@H+]1CCC[C@@]2(CC=CCC2)C1 ZINC000303503838 333343147 /nfs/dbraw/zinc/34/31/47/333343147.db2.gz ADWCCKLDIYQPDO-AEFFLSMTSA-N 1 1 255.405 4.570 20 0 CJADMO C[C@@H](c1ccccc1)[N@H+]1CCC[C@]2(CC=CCC2)C1 ZINC000303503839 333343100 /nfs/dbraw/zinc/34/31/00/333343100.db2.gz ADWCCKLDIYQPDO-FUHWJXTLSA-N 1 1 255.405 4.570 20 0 CJADMO C[C@H](c1ccccc1)[N@H+]1CCC[C@]2(CC=CCC2)C1 ZINC000303503840 333343021 /nfs/dbraw/zinc/34/30/21/333343021.db2.gz ADWCCKLDIYQPDO-SJLPKXTDSA-N 1 1 255.405 4.570 20 0 CJADMO C[C@@H](c1ccccc1)[N@H+]1CCC[C@@]2(CC=CCC2)C1 ZINC000303503841 333343054 /nfs/dbraw/zinc/34/30/54/333343054.db2.gz ADWCCKLDIYQPDO-WMZOPIPTSA-N 1 1 255.405 4.570 20 0 CJADMO CCCC[N@@H+](CC1CCOCC1)[C@@H](CC)c1ccccc1 ZINC000303569626 333343916 /nfs/dbraw/zinc/34/39/16/333343916.db2.gz BIOBVAADNKGFOK-IBGZPJMESA-N 1 1 289.463 4.666 20 0 CJADMO CCCC[N@@H+](CC1CCOCC1)[C@H](CC)c1ccccc1 ZINC000303569627 333343936 /nfs/dbraw/zinc/34/39/36/333343936.db2.gz BIOBVAADNKGFOK-LJQANCHMSA-N 1 1 289.463 4.666 20 0 CJADMO COc1cccc(CNc2cc[nH+]c3ccc(Cl)cc23)c1 ZINC000303579174 333344007 /nfs/dbraw/zinc/34/40/07/333344007.db2.gz OKZOXYWNUGJOCM-UHFFFAOYSA-N 1 1 298.773 4.509 20 0 CJADMO CCCC[N@@H+](Cc1cccnc1)[C@@H](CC)c1ccccc1 ZINC000303649090 333345081 /nfs/dbraw/zinc/34/50/81/333345081.db2.gz SZDOTPSGUALLOM-IBGZPJMESA-N 1 1 282.431 4.835 20 0 CJADMO CCCC[N@@H+](Cc1cccnc1)[C@H](CC)c1ccccc1 ZINC000303649092 333345015 /nfs/dbraw/zinc/34/50/15/333345015.db2.gz SZDOTPSGUALLOM-LJQANCHMSA-N 1 1 282.431 4.835 20 0 CJADMO CCCC[N@@H+](Cc1cc(C)on1)[C@H](CC)c1ccccc1 ZINC000303671478 333345197 /nfs/dbraw/zinc/34/51/97/333345197.db2.gz YSPBZNARFGGPGT-GOSISDBHSA-N 1 1 286.419 4.736 20 0 CJADMO CCCC[N@@H+](Cc1cc(C)on1)[C@@H](CC)c1ccccc1 ZINC000303671481 333345290 /nfs/dbraw/zinc/34/52/90/333345290.db2.gz YSPBZNARFGGPGT-SFHVURJKSA-N 1 1 286.419 4.736 20 0 CJADMO Fc1ccccc1C[N@H+]1CCCCC[C@H]1c1ccco1 ZINC000303700282 333345394 /nfs/dbraw/zinc/34/53/94/333345394.db2.gz AYVPCTDGTVECDJ-INIZCTEOSA-N 1 1 273.351 4.536 20 0 CJADMO Fc1ccccc1C[N@H+]1CCCCC[C@@H]1c1ccco1 ZINC000303700284 333345481 /nfs/dbraw/zinc/34/54/81/333345481.db2.gz AYVPCTDGTVECDJ-MRXNPFEDSA-N 1 1 273.351 4.536 20 0 CJADMO CCCO[C@@H]1CCC[N@H+]([C@@H](CC)c2ccc(F)cc2)CC1 ZINC000303739555 328357974 /nfs/dbraw/zinc/35/79/74/328357974.db2.gz HYJXCKWGAOKIGI-MSOLQXFVSA-N 1 1 293.426 4.558 20 0 CJADMO CCCO[C@@H]1CCC[N@H+]([C@H](CC)c2ccc(F)cc2)CC1 ZINC000303739556 328357876 /nfs/dbraw/zinc/35/78/76/328357876.db2.gz HYJXCKWGAOKIGI-QZTJIDSGSA-N 1 1 293.426 4.558 20 0 CJADMO CCCO[C@H]1CCC[N@H+]([C@@H](CC)c2ccc(F)cc2)CC1 ZINC000303739557 328357942 /nfs/dbraw/zinc/35/79/42/328357942.db2.gz HYJXCKWGAOKIGI-ROUUACIJSA-N 1 1 293.426 4.558 20 0 CJADMO CCCO[C@H]1CCC[N@H+]([C@H](CC)c2ccc(F)cc2)CC1 ZINC000303739558 328358021 /nfs/dbraw/zinc/35/80/21/328358021.db2.gz HYJXCKWGAOKIGI-ZWKOTPCHSA-N 1 1 293.426 4.558 20 0 CJADMO CCSCC[N@@H+]([C@H](C)c1ccccc1Cl)C1CC1 ZINC000303749627 328358013 /nfs/dbraw/zinc/35/80/13/328358013.db2.gz HJWSDTCTIUZVMR-GFCCVEGCSA-N 1 1 283.868 4.619 20 0 CJADMO CCSCC[N@@H+]([C@@H](C)c1ccccc1Cl)C1CC1 ZINC000303749629 328357860 /nfs/dbraw/zinc/35/78/60/328357860.db2.gz HJWSDTCTIUZVMR-LBPRGKRZSA-N 1 1 283.868 4.619 20 0 CJADMO CCSCC[N@@H+](C)Cc1ccccc1-c1ccccc1 ZINC000303796222 328356706 /nfs/dbraw/zinc/35/67/06/328356706.db2.gz RMXOHHDGAJFPHN-UHFFFAOYSA-N 1 1 285.456 4.539 20 0 CJADMO CCc1nc(C)c([C@H](C)[N@@H+](C)Cc2ccccc2C)s1 ZINC000303867477 328362081 /nfs/dbraw/zinc/36/20/81/328362081.db2.gz HNGABZPWURYKLP-AWEZNQCLSA-N 1 1 288.460 4.515 20 0 CJADMO CCc1nc(C)c([C@@H](C)[N@@H+](C)Cc2ccccc2C)s1 ZINC000303867480 328362152 /nfs/dbraw/zinc/36/21/52/328362152.db2.gz HNGABZPWURYKLP-CQSZACIVSA-N 1 1 288.460 4.515 20 0 CJADMO CC(C)(C)c1nc(C[N@H+]2CCC3(C2)CCCCC3)cs1 ZINC000303882381 333347846 /nfs/dbraw/zinc/34/78/46/333347846.db2.gz JFAQWSFPFHZRHJ-UHFFFAOYSA-N 1 1 292.492 4.597 20 0 CJADMO CCc1nc(C)c([C@@H](C)[N@@H+](C)CC2CCCCC2)s1 ZINC000303961605 328371941 /nfs/dbraw/zinc/37/19/41/328371941.db2.gz ZTZVICYTMLMTRD-CYBMUJFWSA-N 1 1 280.481 4.587 20 0 CJADMO CCc1nc(C)c([C@H](C)[N@@H+](C)CC2CCCCC2)s1 ZINC000303961607 328371945 /nfs/dbraw/zinc/37/19/45/328371945.db2.gz ZTZVICYTMLMTRD-ZDUSSCGKSA-N 1 1 280.481 4.587 20 0 CJADMO Cc1cscc1C[NH2+]Cc1csc(Cl)c1Cl ZINC000309701905 260186094 /nfs/dbraw/zinc/18/60/94/260186094.db2.gz MZSIHTDJBFVJGS-UHFFFAOYSA-N 1 1 292.256 4.715 20 0 CJADMO C[C@@H]([NH2+]Cc1cc(Cl)sc1Cl)c1cccs1 ZINC000309786289 333049406 /nfs/dbraw/zinc/04/94/06/333049406.db2.gz ODLMHUVYXAASOD-SSDOTTSWSA-N 1 1 292.256 4.967 20 0 CJADMO C[C@H]([NH2+]Cc1cc(Cl)sc1Cl)c1cccs1 ZINC000309786290 333049411 /nfs/dbraw/zinc/04/94/11/333049411.db2.gz ODLMHUVYXAASOD-ZETCQYMHSA-N 1 1 292.256 4.967 20 0 CJADMO C[C@@H]([NH2+]Cc1sccc1Cl)c1ccccc1Cl ZINC000310196442 333055292 /nfs/dbraw/zinc/05/52/92/333055292.db2.gz FUZPYSAKWGZMLA-SECBINFHSA-N 1 1 286.227 4.906 20 0 CJADMO CC(C)([NH2+]Cc1c(F)cccc1Cl)c1ccccc1 ZINC000311928378 333074743 /nfs/dbraw/zinc/07/47/43/333074743.db2.gz HVRVEISJWDFNEQ-UHFFFAOYSA-N 1 1 277.770 4.504 20 0 CJADMO Cc1sccc1CNc1ccc([NH+]2CCCC2)cc1C ZINC000312416307 260008073 /nfs/dbraw/zinc/00/80/73/260008073.db2.gz QUXIJNMZHGIRNX-UHFFFAOYSA-N 1 1 286.444 4.577 20 0 CJADMO C[C@@H]([NH2+]Cc1ccsc1Cl)c1cccc(Cl)c1 ZINC000312554525 260148213 /nfs/dbraw/zinc/14/82/13/260148213.db2.gz JKOWYAQZQOCKGQ-SECBINFHSA-N 1 1 286.227 4.906 20 0 CJADMO Cc1ccccc1C[NH2+]Cc1cc(Cl)sc1Cl ZINC000312555576 334749821 /nfs/dbraw/zinc/74/98/21/334749821.db2.gz HGIFRZZBJJTYOC-UHFFFAOYSA-N 1 1 286.227 4.653 20 0 CJADMO Clc1sccc1CNc1cccc2cc[nH+]cc21 ZINC000312561358 327530006 /nfs/dbraw/zinc/53/00/06/327530006.db2.gz UAQWIWRQDVWXDK-UHFFFAOYSA-N 1 1 274.776 4.562 20 0 CJADMO C[C@@H]([NH2+]Cc1ccsc1Cl)c1ccccc1Cl ZINC000312563356 260149473 /nfs/dbraw/zinc/14/94/73/260149473.db2.gz WCTMEHJZCHFEOC-SECBINFHSA-N 1 1 286.227 4.906 20 0 CJADMO C[C@H]([NH2+]Cc1ccsc1Cl)c1ccccc1Cl ZINC000312563359 260149580 /nfs/dbraw/zinc/14/95/80/260149580.db2.gz WCTMEHJZCHFEOC-VIFPVBQESA-N 1 1 286.227 4.906 20 0 CJADMO C[C@@H]([NH2+]Cc1cc(Cl)sc1Cl)c1ccccc1 ZINC000312563890 327530011 /nfs/dbraw/zinc/53/00/11/327530011.db2.gz SMHBFLHSBLHZES-SECBINFHSA-N 1 1 286.227 4.906 20 0 CJADMO Cc1cccc(C[NH2+]Cc2cc(Cl)sc2Cl)c1 ZINC000312575437 334750016 /nfs/dbraw/zinc/75/00/16/334750016.db2.gz FDSLMBUSJSHQPM-UHFFFAOYSA-N 1 1 286.227 4.653 20 0 CJADMO C[C@@H]([NH2+]Cc1ccsc1Cl)c1ccc(F)cc1F ZINC000312589993 260163177 /nfs/dbraw/zinc/16/31/77/260163177.db2.gz WENJLJDPBMMBMU-MRVPVSSYSA-N 1 1 287.762 4.531 20 0 CJADMO C[C@H]([NH2+]Cc1ccsc1Cl)c1ccc(F)cc1F ZINC000312589995 260163083 /nfs/dbraw/zinc/16/30/83/260163083.db2.gz WENJLJDPBMMBMU-QMMMGPOBSA-N 1 1 287.762 4.531 20 0 CJADMO Clc1cc(C[NH2+][C@@H]2CCc3ccccc32)c(Cl)s1 ZINC000312606331 327535378 /nfs/dbraw/zinc/53/53/78/327535378.db2.gz RGXQWCLLTBCRFY-GFCCVEGCSA-N 1 1 298.238 4.832 20 0 CJADMO Cc1cscc1C[NH2+]Cc1cc(Cl)sc1Cl ZINC000312607961 260179743 /nfs/dbraw/zinc/17/97/43/260179743.db2.gz DRYYVJBRSZWEIU-UHFFFAOYSA-N 1 1 292.256 4.715 20 0 CJADMO C[C@H]([NH2+]Cc1ccsc1Cl)c1cc2ccccc2o1 ZINC000312620349 260183781 /nfs/dbraw/zinc/18/37/81/260183781.db2.gz VENGXLBSAWIYPW-JTQLQIEISA-N 1 1 291.803 4.999 20 0 CJADMO C[C@@H]([NH2+]Cc1ccsc1Cl)c1cc2ccccc2o1 ZINC000312620352 260183952 /nfs/dbraw/zinc/18/39/52/260183952.db2.gz VENGXLBSAWIYPW-SNVBAGLBSA-N 1 1 291.803 4.999 20 0 CJADMO COc1ccc(C)cc1[C@H](C)[NH2+]Cc1ccsc1Cl ZINC000312685620 326940814 /nfs/dbraw/zinc/94/08/14/326940814.db2.gz QNPWGLRLHITEIP-NSHDSACASA-N 1 1 295.835 4.569 20 0 CJADMO Cc1ccc(C)c(C[NH2+][C@@H](c2ccco2)c2ccccc2)c1 ZINC000314998327 330470310 /nfs/dbraw/zinc/47/03/10/330470310.db2.gz DBOUHEIUFHALKC-HXUWFJFHSA-N 1 1 291.394 4.776 20 0 CJADMO Cc1cc([NH+]2CCCC2)ccc1N[C@@H](C)c1ccc(F)cc1 ZINC000315881270 333384079 /nfs/dbraw/zinc/38/40/79/333384079.db2.gz OHFLMUXPQNKJRR-HNNXBMFYSA-N 1 1 298.405 4.907 20 0 CJADMO Cc1cc([NH+]2CCCC2)ccc1N[C@H](C)c1ccc(F)cc1 ZINC000315881273 333384156 /nfs/dbraw/zinc/38/41/56/333384156.db2.gz OHFLMUXPQNKJRR-OAHLLOKOSA-N 1 1 298.405 4.907 20 0 CJADMO COc1ccc(C)cc1[C@H](C)[NH2+]Cc1ccc([C@H]2C[C@@H]2C)o1 ZINC000315941502 333384686 /nfs/dbraw/zinc/38/46/86/333384686.db2.gz XDRSXYHCYIVFKD-DZKIICNBSA-N 1 1 299.414 4.571 20 0 CJADMO COc1ccc(C)cc1[C@H](C)[NH2+]Cc1ccc([C@@H]2C[C@H]2C)o1 ZINC000315941503 333384631 /nfs/dbraw/zinc/38/46/31/333384631.db2.gz XDRSXYHCYIVFKD-IJEWVQPXSA-N 1 1 299.414 4.571 20 0 CJADMO COc1ccc(C)cc1[C@H](C)[NH2+]Cc1ccc([C@@H]2C[C@@H]2C)o1 ZINC000315941504 333384667 /nfs/dbraw/zinc/38/46/67/333384667.db2.gz XDRSXYHCYIVFKD-OFQRWUPVSA-N 1 1 299.414 4.571 20 0 CJADMO COc1ccc(C)cc1[C@H](C)[NH2+]Cc1ccc([C@H]2C[C@H]2C)o1 ZINC000315941505 333384623 /nfs/dbraw/zinc/38/46/23/333384623.db2.gz XDRSXYHCYIVFKD-YCPHGPKFSA-N 1 1 299.414 4.571 20 0 CJADMO CCCOc1ccc(CNc2cccc3cc[nH+]cc32)cc1 ZINC000316270295 334818912 /nfs/dbraw/zinc/81/89/12/334818912.db2.gz GPYKOCRQLIDUFY-UHFFFAOYSA-N 1 1 292.382 4.636 20 0 CJADMO Cc1cc([NH+]2CCCC2)ccc1N[C@@H]1CCCc2occc21 ZINC000316441132 333393822 /nfs/dbraw/zinc/39/38/22/333393822.db2.gz DHFVYCDVAZRYSE-GOSISDBHSA-N 1 1 296.414 4.678 20 0 CJADMO Cc1cc([NH+]2CCCC2)ccc1N[C@H]1CCCc2occc21 ZINC000316441135 333393768 /nfs/dbraw/zinc/39/37/68/333393768.db2.gz DHFVYCDVAZRYSE-SFHVURJKSA-N 1 1 296.414 4.678 20 0 CJADMO COc1cc(C)ccc1[C@H](C)Nc1cccc2cc[nH+]cc21 ZINC000316481819 334822112 /nfs/dbraw/zinc/82/21/12/334822112.db2.gz WNIURDJSHRDDIP-AWEZNQCLSA-N 1 1 292.382 4.725 20 0 CJADMO COc1cc(C)ccc1[C@@H](C)Nc1cccc2cc[nH+]cc21 ZINC000316481821 334822049 /nfs/dbraw/zinc/82/20/49/334822049.db2.gz WNIURDJSHRDDIP-CQSZACIVSA-N 1 1 292.382 4.725 20 0 CJADMO COc1ccc([C@@H](C)Nc2cccc3cc[nH+]cc32)cc1F ZINC000316562613 327175552 /nfs/dbraw/zinc/17/55/52/327175552.db2.gz OBLUTNVBXPLMCN-GFCCVEGCSA-N 1 1 296.345 4.556 20 0 CJADMO COc1ccc([C@H](C)Nc2cccc3cc[nH+]cc32)cc1F ZINC000316562619 327175527 /nfs/dbraw/zinc/17/55/27/327175527.db2.gz OBLUTNVBXPLMCN-LBPRGKRZSA-N 1 1 296.345 4.556 20 0 CJADMO CCOc1ccc([C@H](C)Nc2cccc3cc[nH+]cc32)cc1 ZINC000316587508 327175965 /nfs/dbraw/zinc/17/59/65/327175965.db2.gz RYYFULCPPCXGSJ-AWEZNQCLSA-N 1 1 292.382 4.807 20 0 CJADMO CCOc1ccc([C@@H](C)Nc2cccc3cc[nH+]cc32)cc1 ZINC000316587509 327175950 /nfs/dbraw/zinc/17/59/50/327175950.db2.gz RYYFULCPPCXGSJ-CQSZACIVSA-N 1 1 292.382 4.807 20 0 CJADMO CC[C@@H](Nc1cccc2cc[nH+]cc21)c1ccc(OC)cc1 ZINC000316622317 327178556 /nfs/dbraw/zinc/17/85/56/327178556.db2.gz XUBGQLVTCAOOMV-GOSISDBHSA-N 1 1 292.382 4.807 20 0 CJADMO CC[C@H](Nc1cccc2cc[nH+]cc21)c1ccc(OC)cc1 ZINC000316622319 327178491 /nfs/dbraw/zinc/17/84/91/327178491.db2.gz XUBGQLVTCAOOMV-SFHVURJKSA-N 1 1 292.382 4.807 20 0 CJADMO CC(C)Oc1ccc(CNc2cccc3cc[nH+]cc32)cc1 ZINC000316929563 327543235 /nfs/dbraw/zinc/54/32/35/327543235.db2.gz LMMNUTSNNDOHIA-UHFFFAOYSA-N 1 1 292.382 4.634 20 0 CJADMO CCOc1ccccc1[C@@H](C)Nc1cccc2cc[nH+]cc21 ZINC000316956268 327545809 /nfs/dbraw/zinc/54/58/09/327545809.db2.gz NYUNFDWWYZSOQE-CQSZACIVSA-N 1 1 292.382 4.807 20 0 CJADMO COc1cc([C@@H](C)Nc2cccc3cc[nH+]cc32)ccc1F ZINC000317035469 327550544 /nfs/dbraw/zinc/55/05/44/327550544.db2.gz AMPMSRRPFXFZLT-GFCCVEGCSA-N 1 1 296.345 4.556 20 0 CJADMO COc1cc([C@H](C)Nc2cccc3cc[nH+]cc32)ccc1F ZINC000317035471 327550628 /nfs/dbraw/zinc/55/06/28/327550628.db2.gz AMPMSRRPFXFZLT-LBPRGKRZSA-N 1 1 296.345 4.556 20 0 CJADMO Cc1ccc(C)c([C@@H]([NH2+]Cc2ccoc2)c2ccccc2)c1 ZINC000317207082 260129149 /nfs/dbraw/zinc/12/91/49/260129149.db2.gz QVLADQDDIMCILE-FQEVSTJZSA-N 1 1 291.394 4.776 20 0 CJADMO Cc1ccc(C)c([C@H]([NH2+]Cc2ccoc2)c2ccccc2)c1 ZINC000317207083 260129215 /nfs/dbraw/zinc/12/92/15/260129215.db2.gz QVLADQDDIMCILE-HXUWFJFHSA-N 1 1 291.394 4.776 20 0 CJADMO Cc1ccc2cc(CNc3cccc4cc[nH+]cc43)ccc2n1 ZINC000322658087 327194558 /nfs/dbraw/zinc/19/45/58/327194558.db2.gz MBZPKMIGJVVNMW-UHFFFAOYSA-N 1 1 299.377 4.704 20 0 CJADMO C[C@@H]([NH2+]Cc1cccc(O)c1Cl)c1ccc(Cl)cc1 ZINC000328442105 333532903 /nfs/dbraw/zinc/53/29/03/333532903.db2.gz FDLRQEHSZQVNSU-SNVBAGLBSA-N 1 1 296.197 4.550 20 0 CJADMO C[C@@H]([NH2+]Cc1cccc(O)c1Cl)c1cccc(Cl)c1 ZINC000328500523 333533524 /nfs/dbraw/zinc/53/35/24/333533524.db2.gz XBEOQLJTZAFALH-SNVBAGLBSA-N 1 1 296.197 4.550 20 0 CJADMO Cc1cc(C[NH2+][C@H](c2ccco2)c2ccccc2)cs1 ZINC000328566978 333535131 /nfs/dbraw/zinc/53/51/31/333535131.db2.gz NGRPEQGUPBUZAY-KRWDZBQOSA-N 1 1 283.396 4.529 20 0 CJADMO Cc1cc(C[NH2+][C@@H](c2ccco2)c2ccccc2)cs1 ZINC000328566979 333535151 /nfs/dbraw/zinc/53/51/51/333535151.db2.gz NGRPEQGUPBUZAY-QGZVFWFLSA-N 1 1 283.396 4.529 20 0 CJADMO c1cc([C@H]2CCC[N@@H+]2Cc2cnc3ccccc3c2)cs1 ZINC000337144327 526437667 /nfs/dbraw/zinc/43/76/67/526437667.db2.gz ZURPCDIGVLIJFB-GOSISDBHSA-N 1 1 294.423 4.633 20 0 CJADMO c1cc([C@@H]2CCC[N@@H+]2Cc2cnc3ccccc3c2)cs1 ZINC000337144328 526436643 /nfs/dbraw/zinc/43/66/43/526436643.db2.gz ZURPCDIGVLIJFB-SFHVURJKSA-N 1 1 294.423 4.633 20 0 CJADMO Cc1csc([C@@H](C)[NH2+]Cc2ccc(C3CCC3)cc2)n1 ZINC000339226443 526412989 /nfs/dbraw/zinc/41/29/89/526412989.db2.gz RRMZSAYSIIUVAL-CYBMUJFWSA-N 1 1 286.444 4.570 20 0 CJADMO Cc1csc([C@H](C)[NH2+]Cc2ccc(C3CCC3)cc2)n1 ZINC000339226444 526435869 /nfs/dbraw/zinc/43/58/69/526435869.db2.gz RRMZSAYSIIUVAL-ZDUSSCGKSA-N 1 1 286.444 4.570 20 0 CJADMO c1sc(C2CC2)nc1C[NH2+]Cc1ccc(C2CCC2)cc1 ZINC000339251432 526631080 /nfs/dbraw/zinc/63/10/80/526631080.db2.gz ANIUMEFEOBUFFB-UHFFFAOYSA-N 1 1 298.455 4.578 20 0 CJADMO Cc1cnc([C@@H](C)[NH2+]Cc2ccc(C3CCC3)cc2)s1 ZINC000339292992 328004462 /nfs/dbraw/zinc/00/44/62/328004462.db2.gz IESMCZCAKHECNR-CYBMUJFWSA-N 1 1 286.444 4.570 20 0 CJADMO Cc1cnc([C@H](C)[NH2+]Cc2ccc(C3CCC3)cc2)s1 ZINC000339292993 328004485 /nfs/dbraw/zinc/00/44/85/328004485.db2.gz IESMCZCAKHECNR-ZDUSSCGKSA-N 1 1 286.444 4.570 20 0 CJADMO FC(F)(F)c1cscc1CNc1cccc(C2CC2)[nH+]1 ZINC000339428088 527689977 /nfs/dbraw/zinc/68/99/77/527689977.db2.gz JEJYKSZAFQDGOY-UHFFFAOYSA-N 1 1 298.333 4.651 20 0 CJADMO c1nc(C2CCCC2)sc1CNc1cccc(C2CC2)[nH+]1 ZINC000339430121 328010508 /nfs/dbraw/zinc/01/05/08/328010508.db2.gz QARONQVKRMBOEO-UHFFFAOYSA-N 1 1 299.443 4.685 20 0 CJADMO Clc1ccsc1CNc1ccc(C2CCC2)c[nH+]1 ZINC000339572911 328011897 /nfs/dbraw/zinc/01/18/97/328011897.db2.gz SUJDTRRDZVRWRT-UHFFFAOYSA-N 1 1 278.808 4.676 20 0 CJADMO c1sc(C2CC2)nc1C[N@H+]1CCCC2(CCCCC2)C1 ZINC000340198771 263090624 /nfs/dbraw/zinc/09/06/24/263090624.db2.gz RJXMUAMWRMLLFN-UHFFFAOYSA-N 1 1 290.476 4.567 20 0 CJADMO Cc1nc(C[N@@H+](Cc2cccc(Cl)c2)C(C)C)cs1 ZINC000340663342 526848964 /nfs/dbraw/zinc/84/89/64/526848964.db2.gz WAYPFRHYNPYRDH-UHFFFAOYSA-N 1 1 294.851 4.516 20 0 CJADMO Cc1nc(C[N@H+](Cc2cccc(Cl)c2)C(C)C)cs1 ZINC000340663342 526848956 /nfs/dbraw/zinc/84/89/56/526848956.db2.gz WAYPFRHYNPYRDH-UHFFFAOYSA-N 1 1 294.851 4.516 20 0 CJADMO CCc1ccc([C@H]2C[C@H](C)CC[N@H+]2Cc2cccc(C)n2)o1 ZINC000342600203 263460112 /nfs/dbraw/zinc/46/01/12/263460112.db2.gz JVQDOTUSVHEWDU-RDTXWAMCSA-N 1 1 298.430 4.519 20 0 CJADMO Cc1ccc([C@@H]2CCC[N@H+]2Cc2nc(C3CC3)cs2)cc1 ZINC000342700646 263465986 /nfs/dbraw/zinc/46/59/86/263465986.db2.gz XWMQCIZPFDGGKE-KRWDZBQOSA-N 1 1 298.455 4.666 20 0 CJADMO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2nc(C3CC3)cs2)cc1 ZINC000342700646 263465985 /nfs/dbraw/zinc/46/59/85/263465985.db2.gz XWMQCIZPFDGGKE-KRWDZBQOSA-N 1 1 298.455 4.666 20 0 CJADMO Cc1[nH+]ccn1CCCS[C@@H](C)c1ccccc1Cl ZINC000342709209 263476736 /nfs/dbraw/zinc/47/67/36/263476736.db2.gz KXXYMHHSOKHXJM-LBPRGKRZSA-N 1 1 294.851 4.729 20 0 CJADMO c1sc(C2CCCC2)nc1C[N@H+]1CCC[C@@H]1C1CCC1 ZINC000343011919 263563623 /nfs/dbraw/zinc/56/36/23/263563623.db2.gz WCGGDGDNGXCMDL-MRXNPFEDSA-N 1 1 290.476 4.565 20 0 CJADMO Cc1[nH+]ccn1CCCS[C@H](C)c1cccc(Cl)c1 ZINC000344478946 328558128 /nfs/dbraw/zinc/55/81/28/328558128.db2.gz CGSNSEUMPUZCQT-GFCCVEGCSA-N 1 1 294.851 4.729 20 0 CJADMO Cc1[nH+]ccn1CCCS[C@@H](C)c1cccc(Cl)c1 ZINC000344478952 328558008 /nfs/dbraw/zinc/55/80/08/328558008.db2.gz CGSNSEUMPUZCQT-LBPRGKRZSA-N 1 1 294.851 4.729 20 0 CJADMO Cc1cscc1N[C@H](C)c1ccc(-n2cc[nH+]c2C)cc1 ZINC000347165765 226065608 /nfs/dbraw/zinc/06/56/08/226065608.db2.gz ZYPZVTUVJDMBFQ-CYBMUJFWSA-N 1 1 297.427 4.724 20 0 CJADMO Cc1cscc1N[C@@H](C)c1ccc(-n2cc[nH+]c2C)cc1 ZINC000347165771 226065100 /nfs/dbraw/zinc/06/51/00/226065100.db2.gz ZYPZVTUVJDMBFQ-ZDUSSCGKSA-N 1 1 297.427 4.724 20 0 CJADMO Cc1ncc(C[N@@H+](Cc2cccc(Cl)c2)C(C)C)s1 ZINC000347272644 226108095 /nfs/dbraw/zinc/10/80/95/226108095.db2.gz YRLCSDYSMRVKNX-UHFFFAOYSA-N 1 1 294.851 4.516 20 0 CJADMO Cc1[nH+]ccn1CCCCS[C@H](C)c1ccc(F)cc1 ZINC000347739052 534769265 /nfs/dbraw/zinc/76/92/65/534769265.db2.gz QDIBZRVNTMTTKM-CYBMUJFWSA-N 1 1 292.423 4.605 20 0 CJADMO Cc1[nH+]ccn1CCCCS[C@@H](C)c1ccc(F)cc1 ZINC000347739060 534769686 /nfs/dbraw/zinc/76/96/86/534769686.db2.gz QDIBZRVNTMTTKM-ZDUSSCGKSA-N 1 1 292.423 4.605 20 0 CJADMO Cc1[nH+]ccn1CCCCSc1ccc(F)c(Cl)c1 ZINC000347742365 534769470 /nfs/dbraw/zinc/76/94/70/534769470.db2.gz XNJWQSCBASVEBR-UHFFFAOYSA-N 1 1 298.814 4.557 20 0 CJADMO Cc1[nH+]ccn1CCCCSCc1cccc(Cl)c1 ZINC000347745299 534769966 /nfs/dbraw/zinc/76/99/66/534769966.db2.gz LFQXSLHXHLYDOV-UHFFFAOYSA-N 1 1 294.851 4.559 20 0 CJADMO CCc1ccc(C[N@@H+](Cc2ccoc2)C2CCCCC2)cn1 ZINC000347877029 529638600 /nfs/dbraw/zinc/63/86/00/529638600.db2.gz YDHFNRJPHIEGCT-UHFFFAOYSA-N 1 1 298.430 4.572 20 0 CJADMO Cc1[nH+]ccn1CCCCSc1cc(Cl)ccc1F ZINC000349832073 534768360 /nfs/dbraw/zinc/76/83/60/534768360.db2.gz MQCWJQKLDGXHEZ-UHFFFAOYSA-N 1 1 298.814 4.557 20 0 CJADMO c1sc(C2CCCCC2)nc1C[N@H+]1CCCC2(CC2)C1 ZINC000352267455 228210978 /nfs/dbraw/zinc/21/09/78/228210978.db2.gz UEPZNOCSEVFFCU-UHFFFAOYSA-N 1 1 290.476 4.567 20 0 CJADMO c1sc(C2CCCCC2)nc1C[N@@H+]1CCCC2(CC2)C1 ZINC000352267455 228210977 /nfs/dbraw/zinc/21/09/77/228210977.db2.gz UEPZNOCSEVFFCU-UHFFFAOYSA-N 1 1 290.476 4.567 20 0 CJADMO c1nc(C2CCC2)sc1C[N@H+]1CCC[C@H]1C1CCCC1 ZINC000352651098 227140788 /nfs/dbraw/zinc/14/07/88/227140788.db2.gz DMVQRHAANFFSEM-INIZCTEOSA-N 1 1 290.476 4.565 20 0 CJADMO c1nc(C2CCC2)sc1C[N@H+]1CCC[C@@H]1C1CCCC1 ZINC000352651101 227140368 /nfs/dbraw/zinc/14/03/68/227140368.db2.gz DMVQRHAANFFSEM-MRXNPFEDSA-N 1 1 290.476 4.565 20 0 CJADMO Cc1cc(C[N@H+]([C@H](C)c2ccco2)C2CC2)c(C)s1 ZINC000352697759 227165608 /nfs/dbraw/zinc/16/56/08/227165608.db2.gz HNKDVUFKBMESQY-GFCCVEGCSA-N 1 1 275.417 4.684 20 0 CJADMO Cc1cc(C[N@H+]([C@@H](C)c2ccco2)C2CC2)c(C)s1 ZINC000352697760 227166506 /nfs/dbraw/zinc/16/65/06/227166506.db2.gz HNKDVUFKBMESQY-LBPRGKRZSA-N 1 1 275.417 4.684 20 0 CJADMO Cc1ccc(C[N@@H+](Cc2sc(C)nc2C)C(C)C)s1 ZINC000352718573 533906657 /nfs/dbraw/zinc/90/66/57/533906657.db2.gz HCKSGXGESQYQNE-UHFFFAOYSA-N 1 1 294.489 4.540 20 0 CJADMO C[C@H](c1ccccc1)[N@@H+](Cc1nc(C2CC2)cs1)C1CC1 ZINC000352832818 227308410 /nfs/dbraw/zinc/30/84/10/227308410.db2.gz QEOIOHLMGMLCBV-CYBMUJFWSA-N 1 1 298.455 4.746 20 0 CJADMO C[C@H](c1ccccc1)[N@H+](Cc1nc(C2CC2)cs1)C1CC1 ZINC000352832818 227308404 /nfs/dbraw/zinc/30/84/04/227308404.db2.gz QEOIOHLMGMLCBV-CYBMUJFWSA-N 1 1 298.455 4.746 20 0 CJADMO C[C@@H](c1ccccc1)[N@@H+](Cc1nc(C2CC2)cs1)C1CC1 ZINC000352832819 534104942 /nfs/dbraw/zinc/10/49/42/534104942.db2.gz QEOIOHLMGMLCBV-ZDUSSCGKSA-N 1 1 298.455 4.746 20 0 CJADMO C[C@@H](c1ccccc1)[N@H+](Cc1nc(C2CC2)cs1)C1CC1 ZINC000352832819 534104935 /nfs/dbraw/zinc/10/49/35/534104935.db2.gz QEOIOHLMGMLCBV-ZDUSSCGKSA-N 1 1 298.455 4.746 20 0 CJADMO FC(F)(F)c1ccccc1CNc1cc(C2CC2)cc[nH+]1 ZINC000353083238 228038316 /nfs/dbraw/zinc/03/83/16/228038316.db2.gz QUMKJIIUBURDDV-UHFFFAOYSA-N 1 1 292.304 4.590 20 0 CJADMO FC(F)(F)c1cccc(CNc2cc(C3CC3)cc[nH+]2)c1 ZINC000353083790 228039182 /nfs/dbraw/zinc/03/91/82/228039182.db2.gz RKLYBBDWUFDOIY-UHFFFAOYSA-N 1 1 292.304 4.590 20 0 CJADMO CC[N@H+](Cc1ccsc1C)Cc1c[nH]c2ccccc12 ZINC000353123763 528864041 /nfs/dbraw/zinc/86/40/41/528864041.db2.gz XMPQPMOUWKQYED-UHFFFAOYSA-N 1 1 284.428 4.560 20 0 CJADMO c1nc(C2CCCC2)sc1CNc1cc(C2CC2)cc[nH+]1 ZINC000353138601 228062710 /nfs/dbraw/zinc/06/27/10/228062710.db2.gz YLRKBASMJJKOLN-UHFFFAOYSA-N 1 1 299.443 4.685 20 0 CJADMO FC(F)(F)c1ccc(CNc2cc(C3CC3)cc[nH+]2)cc1 ZINC000353156366 527682076 /nfs/dbraw/zinc/68/20/76/527682076.db2.gz SDQZJJUEEXEHDV-UHFFFAOYSA-N 1 1 292.304 4.590 20 0 CJADMO C[C@@H]1c2ccccc2CC[N@@H+]1Cc1cnc(C2CCC2)s1 ZINC000353410351 228098072 /nfs/dbraw/zinc/09/80/72/228098072.db2.gz WRBWJJNAXSRDRJ-CYBMUJFWSA-N 1 1 298.455 4.530 20 0 CJADMO C[C@H]1c2ccccc2CC[N@@H+]1Cc1cnc(C2CCC2)s1 ZINC000353410353 534150859 /nfs/dbraw/zinc/15/08/59/534150859.db2.gz WRBWJJNAXSRDRJ-ZDUSSCGKSA-N 1 1 298.455 4.530 20 0 CJADMO c1ccc(C[N@H+](Cc2ccc(C3CCC3)cc2)C2CC2)nc1 ZINC000353513584 228113114 /nfs/dbraw/zinc/11/31/14/228113114.db2.gz AHLSIRPGESOSDW-UHFFFAOYSA-N 1 1 292.426 4.514 20 0 CJADMO c1cncc(C[N@H+](Cc2ccc(C3CCC3)cc2)C2CC2)c1 ZINC000353519546 534508028 /nfs/dbraw/zinc/50/80/28/534508028.db2.gz NPAFSAAGMMWZFT-UHFFFAOYSA-N 1 1 292.426 4.514 20 0 CJADMO CC(C)CC[C@H]([NH2+]Cc1ccc(F)cc1F)c1ccoc1 ZINC000353520251 527848689 /nfs/dbraw/zinc/84/86/89/527848689.db2.gz NOMZGSDDTCIULD-KRWDZBQOSA-N 1 1 293.357 4.825 20 0 CJADMO CC(C)CC[C@@H]([NH2+]Cc1ccc(F)cc1F)c1ccoc1 ZINC000353520252 527810313 /nfs/dbraw/zinc/81/03/13/527810313.db2.gz NOMZGSDDTCIULD-QGZVFWFLSA-N 1 1 293.357 4.825 20 0 CJADMO CC(C)CC[C@H]([NH2+]Cc1cc(F)ccc1F)c1ccoc1 ZINC000353520652 527848704 /nfs/dbraw/zinc/84/87/04/527848704.db2.gz OIXMPMVVDBGRHD-KRWDZBQOSA-N 1 1 293.357 4.825 20 0 CJADMO CC(C)CC[C@@H]([NH2+]Cc1cc(F)ccc1F)c1ccoc1 ZINC000353520653 527811190 /nfs/dbraw/zinc/81/11/90/527811190.db2.gz OIXMPMVVDBGRHD-QGZVFWFLSA-N 1 1 293.357 4.825 20 0 CJADMO CCc1cnc(C[NH2+][C@@H](CCC(C)C)c2ccoc2)s1 ZINC000353521563 529653974 /nfs/dbraw/zinc/65/39/74/529653974.db2.gz QCWMMQURGRKYDC-HNNXBMFYSA-N 1 1 292.448 4.566 20 0 CJADMO CCc1cnc(C[NH2+][C@H](CCC(C)C)c2ccoc2)s1 ZINC000353521564 529653657 /nfs/dbraw/zinc/65/36/57/529653657.db2.gz QCWMMQURGRKYDC-OAHLLOKOSA-N 1 1 292.448 4.566 20 0 CJADMO CCc1nc([C@H](C)[NH2+][C@H](CC)c2cccc(C)c2)cs1 ZINC000353528596 529747040 /nfs/dbraw/zinc/74/70/40/529747040.db2.gz NUVBRBBCNHUUDD-DZGCQCFKSA-N 1 1 288.460 4.816 20 0 CJADMO CCc1nc([C@@H](C)[NH2+][C@@H](CC)c2cccc(C)c2)cs1 ZINC000353528597 529745311 /nfs/dbraw/zinc/74/53/11/529745311.db2.gz NUVBRBBCNHUUDD-HIFRSBDPSA-N 1 1 288.460 4.816 20 0 CJADMO CCc1nc([C@@H](C)[NH2+][C@H](CC)c2cccc(C)c2)cs1 ZINC000353528598 529745396 /nfs/dbraw/zinc/74/53/96/529745396.db2.gz NUVBRBBCNHUUDD-UKRRQHHQSA-N 1 1 288.460 4.816 20 0 CJADMO CCc1nc([C@H](C)[NH2+][C@@H](CC)c2cccc(C)c2)cs1 ZINC000353528599 529746999 /nfs/dbraw/zinc/74/69/99/529746999.db2.gz NUVBRBBCNHUUDD-ZFWWWQNUSA-N 1 1 288.460 4.816 20 0 CJADMO Cc1ccsc1[C@@H](C)Nc1cc(C2CC2)cc[nH+]1 ZINC000353536765 534480717 /nfs/dbraw/zinc/48/07/17/534480717.db2.gz CCAQAONMYVTUID-LLVKDONJSA-N 1 1 258.390 4.502 20 0 CJADMO Cc1ccsc1[C@H](C)Nc1cc(C2CC2)cc[nH+]1 ZINC000353536767 228116476 /nfs/dbraw/zinc/11/64/76/228116476.db2.gz CCAQAONMYVTUID-NSHDSACASA-N 1 1 258.390 4.502 20 0 CJADMO Cc1cc([C@@H](C)Nc2cc(C3CC3)cc[nH+]2)c(C)s1 ZINC000353541235 228117223 /nfs/dbraw/zinc/11/72/23/228117223.db2.gz RGZZFZWSZOXPMO-LLVKDONJSA-N 1 1 272.417 4.810 20 0 CJADMO Cc1cc([C@H](C)Nc2cc(C3CC3)cc[nH+]2)c(C)s1 ZINC000353541236 228116738 /nfs/dbraw/zinc/11/67/38/228116738.db2.gz RGZZFZWSZOXPMO-NSHDSACASA-N 1 1 272.417 4.810 20 0 CJADMO CC(C)c1nc([C@@H](C)Nc2cc(C3CC3)cc[nH+]2)cs1 ZINC000353544536 528301980 /nfs/dbraw/zinc/30/19/80/528301980.db2.gz CHADIKOWICOKCN-LLVKDONJSA-N 1 1 287.432 4.712 20 0 CJADMO CC(C)c1nc([C@H](C)Nc2cc(C3CC3)cc[nH+]2)cs1 ZINC000353544541 528315506 /nfs/dbraw/zinc/31/55/06/528315506.db2.gz CHADIKOWICOKCN-NSHDSACASA-N 1 1 287.432 4.712 20 0 CJADMO CC(C)C[C@H](Nc1cc(C2CC2)cc[nH+]1)c1ccccn1 ZINC000353549487 528574093 /nfs/dbraw/zinc/57/40/93/528574093.db2.gz OMTJRNKUSRRZQV-KRWDZBQOSA-N 1 1 281.403 4.553 20 0 CJADMO CC(C)C[C@@H](Nc1cc(C2CC2)cc[nH+]1)c1ccccn1 ZINC000353549491 528362037 /nfs/dbraw/zinc/36/20/37/528362037.db2.gz OMTJRNKUSRRZQV-QGZVFWFLSA-N 1 1 281.403 4.553 20 0 CJADMO C[C@@H]1C[C@H](Nc2cc(C3CC3)cc[nH+]2)c2ccccc21 ZINC000353550882 228118899 /nfs/dbraw/zinc/11/88/99/228118899.db2.gz SDVNQHVOESBNIJ-PXAZEXFGSA-N 1 1 264.372 4.619 20 0 CJADMO C[C@H]1C[C@H](Nc2cc(C3CC3)cc[nH+]2)c2ccccc21 ZINC000353550885 228118866 /nfs/dbraw/zinc/11/88/66/228118866.db2.gz SDVNQHVOESBNIJ-SJCJKPOMSA-N 1 1 264.372 4.619 20 0 CJADMO C[C@@H]1C[C@@H](Nc2cc(C3CC3)cc[nH+]2)c2ccccc21 ZINC000353550886 228118714 /nfs/dbraw/zinc/11/87/14/228118714.db2.gz SDVNQHVOESBNIJ-SJKOYZFVSA-N 1 1 264.372 4.619 20 0 CJADMO C[C@H]1C[C@@H](Nc2cc(C3CC3)cc[nH+]2)c2ccccc21 ZINC000353550887 228118924 /nfs/dbraw/zinc/11/89/24/228118924.db2.gz SDVNQHVOESBNIJ-YVEFUNNKSA-N 1 1 264.372 4.619 20 0 CJADMO C[C@@H](Nc1cc(C2CC2)cc[nH+]1)c1ccc2ccccc2n1 ZINC000353555051 533551839 /nfs/dbraw/zinc/55/18/39/533551839.db2.gz BGSOJHHPEDTPPG-CYBMUJFWSA-N 1 1 289.382 4.680 20 0 CJADMO C[C@H](Nc1cc(C2CC2)cc[nH+]1)c1ccc2ccccc2n1 ZINC000353555057 534015728 /nfs/dbraw/zinc/01/57/28/534015728.db2.gz BGSOJHHPEDTPPG-ZDUSSCGKSA-N 1 1 289.382 4.680 20 0 CJADMO C[C@@H](Nc1cc(C2CC2)cc[nH+]1)C1CCC(F)(F)CC1 ZINC000353555068 533551213 /nfs/dbraw/zinc/55/12/13/533551213.db2.gz BHKGQANYVYSGLC-LLVKDONJSA-N 1 1 280.362 4.585 20 0 CJADMO C[C@H](Nc1cc(C2CC2)cc[nH+]1)C1CCC(F)(F)CC1 ZINC000353555076 534015877 /nfs/dbraw/zinc/01/58/77/534015877.db2.gz BHKGQANYVYSGLC-NSHDSACASA-N 1 1 280.362 4.585 20 0 CJADMO c1cc2c(s1)CCC[C@@H]2Nc1cc(C2CC2)cc[nH+]1 ZINC000353557732 228120512 /nfs/dbraw/zinc/12/05/12/228120512.db2.gz IKHNLXPFXOEVLC-AWEZNQCLSA-N 1 1 270.401 4.510 20 0 CJADMO c1cc2c(s1)CCC[C@H]2Nc1cc(C2CC2)cc[nH+]1 ZINC000353557733 228120712 /nfs/dbraw/zinc/12/07/12/228120712.db2.gz IKHNLXPFXOEVLC-CQSZACIVSA-N 1 1 270.401 4.510 20 0 CJADMO Cc1ccc([C@@H](C)Nc2cc(C3CC3)cc[nH+]2)s1 ZINC000353617331 228132189 /nfs/dbraw/zinc/13/21/89/228132189.db2.gz DEIDUVPNLIFSIS-LLVKDONJSA-N 1 1 258.390 4.502 20 0 CJADMO Cc1ccc([C@H](C)Nc2cc(C3CC3)cc[nH+]2)s1 ZINC000353617334 228131981 /nfs/dbraw/zinc/13/19/81/228131981.db2.gz DEIDUVPNLIFSIS-NSHDSACASA-N 1 1 258.390 4.502 20 0 CJADMO Cc1nc(C)c([C@@H](C)[N@@H+](C)Cc2ccccc2Cl)s1 ZINC000353624274 228134172 /nfs/dbraw/zinc/13/41/72/228134172.db2.gz TYTXSRSKEWJTQP-LLVKDONJSA-N 1 1 294.851 4.606 20 0 CJADMO Cc1nc(C)c([C@@H](C)[N@H+](C)Cc2ccccc2Cl)s1 ZINC000353624274 228134171 /nfs/dbraw/zinc/13/41/71/228134171.db2.gz TYTXSRSKEWJTQP-LLVKDONJSA-N 1 1 294.851 4.606 20 0 CJADMO Cc1nc(C)c([C@H](C)[N@@H+](C)Cc2ccccc2Cl)s1 ZINC000353624284 228134132 /nfs/dbraw/zinc/13/41/32/228134132.db2.gz TYTXSRSKEWJTQP-NSHDSACASA-N 1 1 294.851 4.606 20 0 CJADMO Cc1nc(C)c([C@H](C)[N@H+](C)Cc2ccccc2Cl)s1 ZINC000353624284 228134130 /nfs/dbraw/zinc/13/41/30/228134130.db2.gz TYTXSRSKEWJTQP-NSHDSACASA-N 1 1 294.851 4.606 20 0 CJADMO c1ccc2c(c1)SCC[C@@H]2Nc1cc(C2CC2)cc[nH+]1 ZINC000353627501 534503292 /nfs/dbraw/zinc/50/32/92/534503292.db2.gz WIYHKOJRZLHZKY-HNNXBMFYSA-N 1 1 282.412 4.608 20 0 CJADMO c1ccc2c(c1)SCC[C@H]2Nc1cc(C2CC2)cc[nH+]1 ZINC000353627503 534503649 /nfs/dbraw/zinc/50/36/49/534503649.db2.gz WIYHKOJRZLHZKY-OAHLLOKOSA-N 1 1 282.412 4.608 20 0 CJADMO C[C@@H](Nc1cc(C2CC2)cc[nH+]1)c1cnc2ccsc2c1 ZINC000353629941 533551485 /nfs/dbraw/zinc/55/14/85/533551485.db2.gz ZNFBPYDVHWIOGM-LLVKDONJSA-N 1 1 295.411 4.742 20 0 CJADMO C[C@H](Nc1cc(C2CC2)cc[nH+]1)c1cnc2ccsc2c1 ZINC000353629942 534015493 /nfs/dbraw/zinc/01/54/93/534015493.db2.gz ZNFBPYDVHWIOGM-NSHDSACASA-N 1 1 295.411 4.742 20 0 CJADMO Cc1cc([C@H](C)[NH2+][C@H](CC2CCC2)c2ccccc2)no1 ZINC000353676414 228143867 /nfs/dbraw/zinc/14/38/67/228143867.db2.gz JNWKWAIICIJXAH-KBXCAEBGSA-N 1 1 284.403 4.565 20 0 CJADMO Cc1cc([C@@H](C)[NH2+][C@@H](CC2CCC2)c2ccccc2)no1 ZINC000353676415 228143740 /nfs/dbraw/zinc/14/37/40/228143740.db2.gz JNWKWAIICIJXAH-KDOFPFPSSA-N 1 1 284.403 4.565 20 0 CJADMO Cc1cc([C@H](C)[NH2+][C@@H](CC2CCC2)c2ccccc2)no1 ZINC000353676416 228143660 /nfs/dbraw/zinc/14/36/60/228143660.db2.gz JNWKWAIICIJXAH-KSSFIOAISA-N 1 1 284.403 4.565 20 0 CJADMO Cc1cc([C@@H](C)[NH2+][C@H](CC2CCC2)c2ccccc2)no1 ZINC000353676417 228144036 /nfs/dbraw/zinc/14/40/36/228144036.db2.gz JNWKWAIICIJXAH-RDTXWAMCSA-N 1 1 284.403 4.565 20 0 CJADMO CCc1nc(C)c([C@@H](C)[N@@H+](C)Cc2ccc(C)s2)s1 ZINC000353747500 529728860 /nfs/dbraw/zinc/72/88/60/529728860.db2.gz MRZANFGGFFJHJY-GFCCVEGCSA-N 1 1 294.489 4.577 20 0 CJADMO CCc1nc(C)c([C@H](C)[N@@H+](C)Cc2ccc(C)s2)s1 ZINC000353747501 529729611 /nfs/dbraw/zinc/72/96/11/529729611.db2.gz MRZANFGGFFJHJY-LBPRGKRZSA-N 1 1 294.489 4.577 20 0 CJADMO CC(C)[N@@H+](Cc1cnc(C2CCCC2)s1)C1CCC1 ZINC000353767472 528964644 /nfs/dbraw/zinc/96/46/44/528964644.db2.gz LLEBVVVPJOOMOB-UHFFFAOYSA-N 1 1 278.465 4.564 20 0 CJADMO CC(C)[N@@H+](Cc1nc(-c2ccccc2)cs1)C1CCC1 ZINC000353783491 264367715 /nfs/dbraw/zinc/36/77/15/264367715.db2.gz XPHMSWZNZOJIJV-UHFFFAOYSA-N 1 1 286.444 4.573 20 0 CJADMO CSc1cccc(F)c1C[NH2+][C@H](C)c1cc(C)oc1C ZINC000353855462 533016995 /nfs/dbraw/zinc/01/69/95/533016995.db2.gz NFYGCSBNGKRABI-LLVKDONJSA-N 1 1 293.407 4.608 20 0 CJADMO CSc1cccc(F)c1C[NH2+][C@@H](C)c1cc(C)oc1C ZINC000353855463 533017019 /nfs/dbraw/zinc/01/70/19/533017019.db2.gz NFYGCSBNGKRABI-NSHDSACASA-N 1 1 293.407 4.608 20 0 CJADMO Cc1nc(C[N@@H+](Cc2ccccc2)C(C)(C)C)sc1C ZINC000354485638 534349171 /nfs/dbraw/zinc/34/91/71/534349171.db2.gz AJXLTYHHZMFHQZ-UHFFFAOYSA-N 1 1 288.460 4.561 20 0 CJADMO FC(F)C1CCC(Nc2ccc(C3CCC3)c[nH+]2)CC1 ZINC000354572837 227036209 /nfs/dbraw/zinc/03/62/09/227036209.db2.gz SQMBPRIZBPMQDI-UHFFFAOYSA-N 1 1 280.362 4.585 20 0 CJADMO C[C@H]([N@@H+](C)Cc1ccc(-c2ccncc2)cc1F)C1(C)CC1 ZINC000355082360 227380991 /nfs/dbraw/zinc/38/09/91/227380991.db2.gz GLVOTBFYHMVTFO-AWEZNQCLSA-N 1 1 298.405 4.508 20 0 CJADMO C[C@@H]([N@@H+](C)Cc1ccc(-c2ccncc2)cc1F)C1(C)CC1 ZINC000355082361 534285099 /nfs/dbraw/zinc/28/50/99/534285099.db2.gz GLVOTBFYHMVTFO-CQSZACIVSA-N 1 1 298.405 4.508 20 0 CJADMO C[C@@H]([N@@H+](C)Cc1cc(Cl)cc2cccnc21)C1(C)CC1 ZINC000355085828 534284939 /nfs/dbraw/zinc/28/49/39/534284939.db2.gz ZCSPLDKYVPHAQX-GFCCVEGCSA-N 1 1 288.822 4.509 20 0 CJADMO C[C@H]([N@@H+](C)Cc1cc(Cl)cc2cccnc21)C1(C)CC1 ZINC000355085853 227385352 /nfs/dbraw/zinc/38/53/52/227385352.db2.gz ZCSPLDKYVPHAQX-LBPRGKRZSA-N 1 1 288.822 4.509 20 0 CJADMO CC(C)[N@@H+](Cc1cscc1C(F)(F)F)C1CCC1 ZINC000356128252 528965483 /nfs/dbraw/zinc/96/54/83/528965483.db2.gz OUZCEGMMHBWWQF-UHFFFAOYSA-N 1 1 277.355 4.530 20 0 CJADMO c1cc(C[N@@H+]2CC=C(c3c[nH]c4ccccc43)CC2)cs1 ZINC000356985071 266225700 /nfs/dbraw/zinc/22/57/00/266225700.db2.gz RXTHFFJANBNVHH-UHFFFAOYSA-N 1 1 294.423 4.519 20 0 CJADMO Cc1cnc(C[N@@H+](Cc2cccc(Cl)c2)C(C)C)s1 ZINC000357303081 260177793 /nfs/dbraw/zinc/17/77/93/260177793.db2.gz HVOZRZWVYBDAHD-UHFFFAOYSA-N 1 1 294.851 4.516 20 0 CJADMO Cc1cnc(C[N@H+](Cc2cccc(Cl)c2)C(C)C)s1 ZINC000357303081 260177792 /nfs/dbraw/zinc/17/77/92/260177792.db2.gz HVOZRZWVYBDAHD-UHFFFAOYSA-N 1 1 294.851 4.516 20 0 CJADMO CC(C)[N@@H+](Cc1csc2ccccc12)Cc1cccnc1 ZINC000357609820 266335561 /nfs/dbraw/zinc/33/55/61/266335561.db2.gz JTOZGJRLWRBXHK-UHFFFAOYSA-N 1 1 296.439 4.707 20 0 CJADMO CC[C@@H](C)[N@@H+](Cc1nc(C)c(C)s1)Cc1ccccc1 ZINC000357701574 266348799 /nfs/dbraw/zinc/34/87/99/266348799.db2.gz BLSZYRYANSQGCW-CYBMUJFWSA-N 1 1 288.460 4.561 20 0 CJADMO CC[C@H](C)[N@@H+](Cc1nc(C)c(C)s1)Cc1ccccc1 ZINC000357701580 266348377 /nfs/dbraw/zinc/34/83/77/266348377.db2.gz BLSZYRYANSQGCW-ZDUSSCGKSA-N 1 1 288.460 4.561 20 0 CJADMO CC[C@H]([NH2+][C@H](C)c1cc(C)oc1C)c1cc(F)ccc1F ZINC000360857559 266748624 /nfs/dbraw/zinc/74/86/24/266748624.db2.gz JLJKHNKXNZTJEQ-DIFFPNOSSA-N 1 1 293.357 4.977 20 0 CJADMO Cn1cc[nH+]c1[C@H](C1CC1)[C@@H]1C[C@@H]2CCCc3cccc1c32 ZINC000362374861 266973517 /nfs/dbraw/zinc/97/35/17/266973517.db2.gz DWMFQFJGKIMYHL-KVSKMBFKSA-N 1 1 292.426 4.521 20 0 CJADMO C[C@H](F)CC[N@H+]1CCC[C@H]1c1nc(C2CCCCC2)co1 ZINC000367552338 267099405 /nfs/dbraw/zinc/09/94/05/267099405.db2.gz FNCQOSXLKZTSNQ-BBRMVZONSA-N 1 1 294.414 4.607 20 0 CJADMO C[C@@H](F)CC[N@H+]1CCC[C@H]1c1nc(C2CCCCC2)co1 ZINC000367552339 267099902 /nfs/dbraw/zinc/09/99/02/267099902.db2.gz FNCQOSXLKZTSNQ-CJNGLKHVSA-N 1 1 294.414 4.607 20 0 CJADMO C[C@@H](F)CC[N@H+]1CCC[C@@H]1c1nc(C2CCCCC2)co1 ZINC000367552340 524974116 /nfs/dbraw/zinc/97/41/16/524974116.db2.gz FNCQOSXLKZTSNQ-CZUORRHYSA-N 1 1 294.414 4.607 20 0 CJADMO C[C@H](F)CC[N@H+]1CCC[C@@H]1c1nc(C2CCCCC2)co1 ZINC000367552341 524805893 /nfs/dbraw/zinc/80/58/93/524805893.db2.gz FNCQOSXLKZTSNQ-XJKSGUPXSA-N 1 1 294.414 4.607 20 0 CJADMO FCCCC[N@H+]1CCC[C@H]1c1nc(C2CCCCC2)co1 ZINC000367555010 267099204 /nfs/dbraw/zinc/09/92/04/267099204.db2.gz XWCBCBOQDDZIAT-INIZCTEOSA-N 1 1 294.414 4.609 20 0 CJADMO FCCCC[N@H+]1CCC[C@@H]1c1nc(C2CCCCC2)co1 ZINC000367555011 267099717 /nfs/dbraw/zinc/09/97/17/267099717.db2.gz XWCBCBOQDDZIAT-MRXNPFEDSA-N 1 1 294.414 4.609 20 0 CJADMO C[C@@H]([NH2+][C@@H]1CCC[C@@H]1F)c1cc(Cl)sc1Cl ZINC000378830996 327760516 /nfs/dbraw/zinc/76/05/16/327760516.db2.gz RXJONQRYKRTMMT-BWVDBABLSA-N 1 1 282.211 4.596 20 0 CJADMO C[C@H]([NH2+][C@@H]1CCC[C@@H]1F)c1cc(Cl)sc1Cl ZINC000378830997 327760460 /nfs/dbraw/zinc/76/04/60/327760460.db2.gz RXJONQRYKRTMMT-CNUIFLNQSA-N 1 1 282.211 4.596 20 0 CJADMO Cc1sccc1C[NH2+][C@H](c1ccco1)c1ccccc1 ZINC000380818461 336033073 /nfs/dbraw/zinc/03/30/73/336033073.db2.gz PAYJRKFGMVWCTR-KRWDZBQOSA-N 1 1 283.396 4.529 20 0 CJADMO Cc1sccc1C[NH2+][C@@H](c1ccco1)c1ccccc1 ZINC000380818490 336033089 /nfs/dbraw/zinc/03/30/89/336033089.db2.gz PAYJRKFGMVWCTR-QGZVFWFLSA-N 1 1 283.396 4.529 20 0 CJADMO Cc1ccoc1C[NH2+][C@@H](C)c1cc(Cl)ccc1Cl ZINC000380934525 336039999 /nfs/dbraw/zinc/03/99/99/336039999.db2.gz JEBNJFZEJBVJMH-JTQLQIEISA-N 1 1 284.186 4.746 20 0 CJADMO Cc1ccoc1C[NH2+][C@H](C)c1cc(Cl)ccc1Cl ZINC000380934532 336039957 /nfs/dbraw/zinc/03/99/57/336039957.db2.gz JEBNJFZEJBVJMH-SNVBAGLBSA-N 1 1 284.186 4.746 20 0 CJADMO C[C@@H]([NH2+][C@@H]1CCc2ccccc21)c1c(F)cccc1Cl ZINC000380970595 336041437 /nfs/dbraw/zinc/04/14/37/336041437.db2.gz YGKOIWZATDPTRJ-BDJLRTHQSA-N 1 1 289.781 4.817 20 0 CJADMO C[C@@H]([NH2+][C@H]1CCc2ccccc21)c1c(F)cccc1Cl ZINC000380970612 336041620 /nfs/dbraw/zinc/04/16/20/336041620.db2.gz YGKOIWZATDPTRJ-BZNIZROVSA-N 1 1 289.781 4.817 20 0 CJADMO C[C@H]([NH2+][C@@H]1CCc2ccccc21)c1c(F)cccc1Cl ZINC000380970617 336041514 /nfs/dbraw/zinc/04/15/14/336041514.db2.gz YGKOIWZATDPTRJ-MEDUHNTESA-N 1 1 289.781 4.817 20 0 CJADMO C[C@H]([NH2+][C@H]1CCc2ccccc21)c1c(F)cccc1Cl ZINC000380970619 336041420 /nfs/dbraw/zinc/04/14/20/336041420.db2.gz YGKOIWZATDPTRJ-ZBEGNZNMSA-N 1 1 289.781 4.817 20 0 CJADMO Cc1cc(C[NH2+][C@@H](C)c2c(F)cccc2Cl)cs1 ZINC000381205140 336054664 /nfs/dbraw/zinc/05/46/64/336054664.db2.gz WNIJJWWCEPBIAS-JTQLQIEISA-N 1 1 283.799 4.700 20 0 CJADMO Cc1cc(C[NH2+][C@H](C)c2c(F)cccc2Cl)cs1 ZINC000381205144 327149673 /nfs/dbraw/zinc/14/96/73/327149673.db2.gz WNIJJWWCEPBIAS-SNVBAGLBSA-N 1 1 283.799 4.700 20 0 CJADMO C[C@@H]([NH2+]Cc1cc(Cl)sc1Cl)c1ccsc1 ZINC000381207991 327150714 /nfs/dbraw/zinc/15/07/14/327150714.db2.gz GORPEYWSUCQTGO-SSDOTTSWSA-N 1 1 292.256 4.967 20 0 CJADMO C[C@H]([NH2+]Cc1cc(Cl)sc1Cl)c1ccsc1 ZINC000381207993 336055039 /nfs/dbraw/zinc/05/50/39/336055039.db2.gz GORPEYWSUCQTGO-ZETCQYMHSA-N 1 1 292.256 4.967 20 0 CJADMO Cc1cc(C[NH2+]Cc2c(Cl)cccc2Cl)cs1 ZINC000381224792 327157326 /nfs/dbraw/zinc/15/73/26/327157326.db2.gz RADMTZDKOTXYQX-UHFFFAOYSA-N 1 1 286.227 4.653 20 0 CJADMO CCCC[C@H]([NH2+]Cc1csc(CC)n1)c1ccccc1 ZINC000381381923 336061189 /nfs/dbraw/zinc/06/11/89/336061189.db2.gz KVFJURLEZJRTQE-INIZCTEOSA-N 1 1 288.460 4.727 20 0 CJADMO CCCC[C@@H]([NH2+]Cc1csc(CC)n1)c1ccccc1 ZINC000381381925 336061217 /nfs/dbraw/zinc/06/12/17/336061217.db2.gz KVFJURLEZJRTQE-MRXNPFEDSA-N 1 1 288.460 4.727 20 0 CJADMO COc1cccc(Cl)c1C[NH2+][C@H](C)c1csc(C)c1 ZINC000381512467 336067246 /nfs/dbraw/zinc/06/72/46/336067246.db2.gz VIQQFOCGQGCKNV-LLVKDONJSA-N 1 1 295.835 4.569 20 0 CJADMO COc1cccc(Cl)c1C[NH2+][C@@H](C)c1csc(C)c1 ZINC000381512469 336067120 /nfs/dbraw/zinc/06/71/20/336067120.db2.gz VIQQFOCGQGCKNV-NSHDSACASA-N 1 1 295.835 4.569 20 0 CJADMO Cc1cc([C@@H](C)Nc2cccc3cc[nH+]cc32)cs1 ZINC000381666880 336070348 /nfs/dbraw/zinc/07/03/48/336070348.db2.gz BGYXVOODXOPOLI-GFCCVEGCSA-N 1 1 268.385 4.778 20 0 CJADMO Cc1cc([C@H](C)Nc2cccc3cc[nH+]cc32)cs1 ZINC000381666886 336070307 /nfs/dbraw/zinc/07/03/07/336070307.db2.gz BGYXVOODXOPOLI-LBPRGKRZSA-N 1 1 268.385 4.778 20 0 CJADMO CC[C@H]([NH2+]Cc1c(Cl)cccc1OC)c1ccsc1 ZINC000382064144 327819825 /nfs/dbraw/zinc/81/98/25/327819825.db2.gz BAVIUJMPXMDBNB-AWEZNQCLSA-N 1 1 295.835 4.651 20 0 CJADMO CC[C@@H]([NH2+]Cc1c(Cl)cccc1OC)c1ccsc1 ZINC000382064146 327819893 /nfs/dbraw/zinc/81/98/93/327819893.db2.gz BAVIUJMPXMDBNB-CQSZACIVSA-N 1 1 295.835 4.651 20 0 CJADMO CC[C@H]([NH2+][C@@H](C)c1c(F)cccc1F)c1ccsc1 ZINC000382082793 336081445 /nfs/dbraw/zinc/08/14/45/336081445.db2.gz FSPSLKMUHOOJSV-HZMBPMFUSA-N 1 1 281.371 4.828 20 0 CJADMO CC[C@@H]([NH2+][C@@H](C)c1c(F)cccc1F)c1ccsc1 ZINC000382082796 336081422 /nfs/dbraw/zinc/08/14/22/336081422.db2.gz FSPSLKMUHOOJSV-IINYFYTJSA-N 1 1 281.371 4.828 20 0 CJADMO CC[C@@H]([NH2+][C@H](C)c1c(F)cccc1F)c1ccsc1 ZINC000382083238 336081393 /nfs/dbraw/zinc/08/13/93/336081393.db2.gz FSPSLKMUHOOJSV-QMTHXVAHSA-N 1 1 281.371 4.828 20 0 CJADMO CC[C@H]([NH2+][C@H](C)c1c(F)cccc1F)c1ccsc1 ZINC000382083239 336081420 /nfs/dbraw/zinc/08/14/20/336081420.db2.gz FSPSLKMUHOOJSV-YGRLFVJLSA-N 1 1 281.371 4.828 20 0 CJADMO CC[C@H](Nc1cccc2cc[nH+]cc21)c1ccsc1 ZINC000382165846 336083536 /nfs/dbraw/zinc/08/35/36/336083536.db2.gz VHXVSJGDUXVFDM-HNNXBMFYSA-N 1 1 268.385 4.860 20 0 CJADMO CC[C@@H](Nc1cccc2cc[nH+]cc21)c1ccsc1 ZINC000382165848 336083385 /nfs/dbraw/zinc/08/33/85/336083385.db2.gz VHXVSJGDUXVFDM-OAHLLOKOSA-N 1 1 268.385 4.860 20 0 CJADMO Cc1csc(C[NH2+]Cc2c(Cl)cccc2Cl)c1 ZINC000383080618 336104032 /nfs/dbraw/zinc/10/40/32/336104032.db2.gz IPZIILFVHGUYOX-UHFFFAOYSA-N 1 1 286.227 4.653 20 0 CJADMO COc1ccc([C@@H](C)Nc2cccc3cc[nH+]cc32)c(F)c1 ZINC000387879624 327817249 /nfs/dbraw/zinc/81/72/49/327817249.db2.gz LYCOLTIZRUPUCS-GFCCVEGCSA-N 1 1 296.345 4.556 20 0 CJADMO COc1ccc(C)cc1[C@@H](C)Nc1cccc2cc[nH+]cc21 ZINC000387895466 327818278 /nfs/dbraw/zinc/81/82/78/327818278.db2.gz IOQFPHQSYYKABY-CQSZACIVSA-N 1 1 292.382 4.725 20 0 CJADMO C[C@@H]([NH2+][C@@H](C)c1c(F)cccc1Cl)c1ccccc1 ZINC000388308791 327867723 /nfs/dbraw/zinc/86/77/23/327867723.db2.gz FZWJXUQQBWCPCX-NEPJUHHUSA-N 1 1 277.770 4.891 20 0 CJADMO C[C@H]([NH2+][C@@H](C)c1c(F)cccc1Cl)c1ccccc1 ZINC000388308793 327867720 /nfs/dbraw/zinc/86/77/20/327867720.db2.gz FZWJXUQQBWCPCX-RYUDHWBXSA-N 1 1 277.770 4.891 20 0 CJADMO Cc1csc(CNc2cc[nH+]c3cc(Cl)ccc23)c1 ZINC000393409990 329092307 /nfs/dbraw/zinc/09/23/07/329092307.db2.gz IUHWYZLIFRUWPZ-UHFFFAOYSA-N 1 1 288.803 4.870 20 0 CJADMO Cc1csc(C[NH2+][C@H](c2ccco2)c2ccccc2)c1 ZINC000393445111 329092526 /nfs/dbraw/zinc/09/25/26/329092526.db2.gz YJGIUQGRUMTGMK-KRWDZBQOSA-N 1 1 283.396 4.529 20 0 CJADMO Cc1csc(C[NH2+][C@@H](c2ccco2)c2ccccc2)c1 ZINC000393445113 329092444 /nfs/dbraw/zinc/09/24/44/329092444.db2.gz YJGIUQGRUMTGMK-QGZVFWFLSA-N 1 1 283.396 4.529 20 0 CJADMO C[C@@H]([NH2+][C@H]1CCC[C@H]1F)c1cc(Cl)sc1Cl ZINC000393476056 262376152 /nfs/dbraw/zinc/37/61/52/262376152.db2.gz RXJONQRYKRTMMT-VDAHYXPESA-N 1 1 282.211 4.596 20 0 CJADMO C[C@H]([NH2+][C@H]1CCC[C@H]1F)c1cc(Cl)sc1Cl ZINC000393476058 333413217 /nfs/dbraw/zinc/41/32/17/333413217.db2.gz RXJONQRYKRTMMT-ZQARSLAVSA-N 1 1 282.211 4.596 20 0 CJADMO COc1ccc(C)cc1[C@@H](C)[NH2+]Cc1sccc1Cl ZINC000394062950 333415921 /nfs/dbraw/zinc/41/59/21/333415921.db2.gz QBNNXOHWPQFUQM-LLVKDONJSA-N 1 1 295.835 4.569 20 0 CJADMO Clc1ccsc1CNc1cccc2cc[nH+]cc21 ZINC000394088328 329098718 /nfs/dbraw/zinc/09/87/18/329098718.db2.gz YUTIJBXJICAZPG-UHFFFAOYSA-N 1 1 274.776 4.562 20 0 CJADMO C[C@H]([NH2+]Cc1sccc1Cl)c1cc2ccccc2o1 ZINC000394105155 260022488 /nfs/dbraw/zinc/02/24/88/260022488.db2.gz HSNASJLPMJWPLM-JTQLQIEISA-N 1 1 291.803 4.999 20 0 CJADMO C[C@@H]([NH2+]Cc1sccc1Cl)c1cc2ccccc2o1 ZINC000394105158 260022621 /nfs/dbraw/zinc/02/26/21/260022621.db2.gz HSNASJLPMJWPLM-SNVBAGLBSA-N 1 1 291.803 4.999 20 0 CJADMO Cc1ccoc1C[NH2+]C(c1cccs1)c1cccs1 ZINC000394221414 260125815 /nfs/dbraw/zinc/12/58/15/260125815.db2.gz PKWVMWFZZUIMSE-UHFFFAOYSA-N 1 1 289.425 4.590 20 0 CJADMO Cc1cc([C@@H](C)[NH2+][C@H](C)c2c(F)cccc2F)cs1 ZINC000394493504 261092214 /nfs/dbraw/zinc/09/22/14/261092214.db2.gz SKMWRCGFIMVQMI-GHMZBOCLSA-N 1 1 281.371 4.747 20 0 CJADMO Cc1cc([C@@H](C)[NH2+][C@@H](C)c2c(F)cccc2F)cs1 ZINC000394493510 261092265 /nfs/dbraw/zinc/09/22/65/261092265.db2.gz SKMWRCGFIMVQMI-MNOVXSKESA-N 1 1 281.371 4.747 20 0 CJADMO Cc1cc([C@H](C)[NH2+][C@@H](C)c2c(F)cccc2F)cs1 ZINC000394493511 261092197 /nfs/dbraw/zinc/09/21/97/261092197.db2.gz SKMWRCGFIMVQMI-QWRGUYRKSA-N 1 1 281.371 4.747 20 0 CJADMO Cc1cc([C@H](C)[NH2+][C@H](C)c2c(F)cccc2F)cs1 ZINC000394493517 261092182 /nfs/dbraw/zinc/09/21/82/261092182.db2.gz SKMWRCGFIMVQMI-WDEREUQCSA-N 1 1 281.371 4.747 20 0 CJADMO Cc1cc(Cl)cc(C[NH2+][C@H](C)c2c(F)cccc2F)c1 ZINC000395138554 329275616 /nfs/dbraw/zinc/27/56/16/329275616.db2.gz JNRQHAPFRGZAMT-LLVKDONJSA-N 1 1 295.760 4.777 20 0 CJADMO Cc1cc(Cl)cc(C[NH2+][C@@H](C)c2c(F)cccc2F)c1 ZINC000395138557 329275601 /nfs/dbraw/zinc/27/56/01/329275601.db2.gz JNRQHAPFRGZAMT-NSHDSACASA-N 1 1 295.760 4.777 20 0 CJADMO CC[C@H]([NH2+]Cc1cnc(C)o1)c1ccc(Cl)cc1Cl ZINC000397945135 333431148 /nfs/dbraw/zinc/43/11/48/333431148.db2.gz LOISECIYFJFZOQ-AWEZNQCLSA-N 1 1 299.201 4.531 20 0 CJADMO CC[C@H]([NH2+]Cc1cnc(C)o1)c1ccc(Cl)c(Cl)c1 ZINC000397955449 327987726 /nfs/dbraw/zinc/98/77/26/327987726.db2.gz RJIDWSQZHYOVJB-AWEZNQCLSA-N 1 1 299.201 4.531 20 0 CJADMO c1csc([C@H]2CCC[N@@H+]2Cc2cnc3ccccc3c2)c1 ZINC000410297573 260481191 /nfs/dbraw/zinc/48/11/91/260481191.db2.gz MJMJFPIZZZZGBV-QGZVFWFLSA-N 1 1 294.423 4.633 20 0 CJADMO CC(C)[N@@H+](Cc1cccs1)Cc1cnc2ccccc2c1 ZINC000410344195 327187214 /nfs/dbraw/zinc/18/72/14/327187214.db2.gz VGSANYFLVVFBQM-UHFFFAOYSA-N 1 1 296.439 4.707 20 0 CJADMO Cc1ccccc1[C@H](C(C)C)[N@@H+](C)Cc1ccnn1C(C)C ZINC000410393318 327190154 /nfs/dbraw/zinc/19/01/54/327190154.db2.gz PEOJNYVMIRKUOM-IBGZPJMESA-N 1 1 299.462 4.602 20 0 CJADMO Cc1ccccc1[C@@H](C(C)C)[N@@H+](C)Cc1ccnn1C(C)C ZINC000410393323 327190112 /nfs/dbraw/zinc/19/01/12/327190112.db2.gz PEOJNYVMIRKUOM-LJQANCHMSA-N 1 1 299.462 4.602 20 0 CJADMO CC[C@H]([NH2+]Cc1ncc(Cl)cc1Cl)c1ccccc1 ZINC000411890131 262708818 /nfs/dbraw/zinc/70/88/18/262708818.db2.gz WHUNSYVFDCBEFN-AWEZNQCLSA-N 1 1 295.213 4.629 20 0 CJADMO CC[C@@H]([NH2+]Cc1ncc(Cl)cc1Cl)c1ccccc1 ZINC000411896701 262709842 /nfs/dbraw/zinc/70/98/42/262709842.db2.gz WHUNSYVFDCBEFN-CQSZACIVSA-N 1 1 295.213 4.629 20 0 CJADMO CCCC[N@@H+](Cc1ccc(C)nn1)[C@@H](CC)c1ccccc1 ZINC000414390792 328161777 /nfs/dbraw/zinc/16/17/77/328161777.db2.gz YVKMKPFEVMGCQM-IBGZPJMESA-N 1 1 297.446 4.538 20 0 CJADMO CCCC[N@@H+](Cc1ccc(C)nn1)[C@H](CC)c1ccccc1 ZINC000414390793 328161772 /nfs/dbraw/zinc/16/17/72/328161772.db2.gz YVKMKPFEVMGCQM-LJQANCHMSA-N 1 1 297.446 4.538 20 0 CJADMO C[C@@H]([NH2+]Cc1csc(C2CC2)n1)c1ccc(C2CC2)cc1 ZINC000418105035 228053188 /nfs/dbraw/zinc/05/31/88/228053188.db2.gz AXCKHWIJPYIIDC-GFCCVEGCSA-N 1 1 298.455 4.749 20 0 CJADMO C[C@H]([NH2+]Cc1csc(C2CC2)n1)c1ccc(C2CC2)cc1 ZINC000418105036 533938307 /nfs/dbraw/zinc/93/83/07/533938307.db2.gz AXCKHWIJPYIIDC-LBPRGKRZSA-N 1 1 298.455 4.749 20 0 CJADMO C[C@H]([NH2+]Cc1nc(C2CC2)cs1)c1ccc(C2CC2)cc1 ZINC000419330608 329717389 /nfs/dbraw/zinc/71/73/89/329717389.db2.gz GIZRYUKINQYYPT-LBPRGKRZSA-N 1 1 298.455 4.749 20 0 CJADMO C[C@H]([NH2+]Cc1cc(C(C)(C)C)on1)c1ccc(C2CC2)cc1 ZINC000419342954 329718645 /nfs/dbraw/zinc/71/86/45/329718645.db2.gz QDDLRZHMXJAFND-ZDUSSCGKSA-N 1 1 298.430 4.700 20 0 CJADMO C[C@@H]([NH2+]Cc1nc2ccccc2o1)c1ccc(C2CC2)cc1 ZINC000419364588 329720335 /nfs/dbraw/zinc/72/03/35/329720335.db2.gz WSTQTFCVNNMDNB-CYBMUJFWSA-N 1 1 292.382 4.556 20 0 CJADMO C[C@H]([NH2+]Cc1nc2ccccc2o1)c1ccc(C2CC2)cc1 ZINC000419364589 329720409 /nfs/dbraw/zinc/72/04/09/329720409.db2.gz WSTQTFCVNNMDNB-ZDUSSCGKSA-N 1 1 292.382 4.556 20 0 CJADMO C[C@@H]([NH2+][C@H](C)c1ccncc1Cl)c1ccccc1Cl ZINC000421801631 330080697 /nfs/dbraw/zinc/08/06/97/330080697.db2.gz LDRGWEMODMSKQO-GHMZBOCLSA-N 1 1 295.213 4.800 20 0 CJADMO C[C@@H]([NH2+][C@@H](C)c1ccncc1Cl)c1ccccc1Cl ZINC000421801632 330080663 /nfs/dbraw/zinc/08/06/63/330080663.db2.gz LDRGWEMODMSKQO-MNOVXSKESA-N 1 1 295.213 4.800 20 0 CJADMO C[C@H]([NH2+][C@@H](C)c1ccncc1Cl)c1ccccc1Cl ZINC000421801633 330080716 /nfs/dbraw/zinc/08/07/16/330080716.db2.gz LDRGWEMODMSKQO-QWRGUYRKSA-N 1 1 295.213 4.800 20 0 CJADMO C[C@@H]([NH2+][C@@H](C)c1ccccc1Cl)c1ccncc1Cl ZINC000421801634 330080730 /nfs/dbraw/zinc/08/07/30/330080730.db2.gz LDRGWEMODMSKQO-WDEREUQCSA-N 1 1 295.213 4.800 20 0 CJADMO COc1ccccc1[C@H](C)[NH2+]Cc1ccc(C2CC2)cc1F ZINC000425916494 330498587 /nfs/dbraw/zinc/49/85/87/330498587.db2.gz BJYOYDCFLKKSPO-ZDUSSCGKSA-N 1 1 299.389 4.563 20 0 CJADMO Cc1ccc2cc([C@H](C)[NH2+][C@@H](C)c3ccccn3)oc2c1 ZINC000425928002 263913483 /nfs/dbraw/zinc/91/34/83/263913483.db2.gz XVBQPMZZSNKALT-KBPBESRZSA-N 1 1 280.371 4.548 20 0 CJADMO CCc1ccc([C@@H](C)[NH2+]Cc2ccc(C3CC3)cc2F)o1 ZINC000425951803 264070770 /nfs/dbraw/zinc/07/07/70/264070770.db2.gz NRFNNVRBOCLTBD-GFCCVEGCSA-N 1 1 287.378 4.709 20 0 CJADMO CCc1ccc([C@H](C)[NH2+]Cc2ccc(C3CC3)cc2F)o1 ZINC000425951808 264070889 /nfs/dbraw/zinc/07/08/89/264070889.db2.gz NRFNNVRBOCLTBD-LBPRGKRZSA-N 1 1 287.378 4.709 20 0 CJADMO CCC[C@@H]([NH2+]Cc1ccc(C2CC2)cc1F)c1ccccn1 ZINC000425955172 264071918 /nfs/dbraw/zinc/07/19/18/264071918.db2.gz YNNBWQWHYFMNNR-GOSISDBHSA-N 1 1 298.405 4.729 20 0 CJADMO CCC[C@H]([NH2+]Cc1ccc(C2CC2)cc1F)c1ccccn1 ZINC000425955174 264072133 /nfs/dbraw/zinc/07/21/33/264072133.db2.gz YNNBWQWHYFMNNR-SFHVURJKSA-N 1 1 298.405 4.729 20 0 CJADMO Cc1cc([C@@H](C)[NH2+]Cc2ccc(C3CC3)cc2F)oc1C ZINC000425960192 264227363 /nfs/dbraw/zinc/22/73/63/264227363.db2.gz WAELUWVRNSOLEI-GFCCVEGCSA-N 1 1 287.378 4.764 20 0 CJADMO Cc1cc([C@H](C)[NH2+]Cc2ccc(C3CC3)cc2F)oc1C ZINC000425960194 264227274 /nfs/dbraw/zinc/22/72/74/264227274.db2.gz WAELUWVRNSOLEI-LBPRGKRZSA-N 1 1 287.378 4.764 20 0 CJADMO CC1(C)[C@@H](C(F)(F)F)CC[N@H+]1Cc1cc(Cl)cs1 ZINC000425998657 264304321 /nfs/dbraw/zinc/30/43/21/264304321.db2.gz KWMYPIMVQAMZSY-JTQLQIEISA-N 1 1 297.773 4.564 20 0 CJADMO CC1(C)[C@H](C(F)(F)F)CC[N@H+]1Cc1cc(Cl)cs1 ZINC000425998658 264304310 /nfs/dbraw/zinc/30/43/10/264304310.db2.gz KWMYPIMVQAMZSY-SNVBAGLBSA-N 1 1 297.773 4.564 20 0 CJADMO Cc1ccc2cc([C@@H](C)Nc3cc(C)cc[nH+]3)oc2c1 ZINC000426013949 264308258 /nfs/dbraw/zinc/30/82/58/264308258.db2.gz BIDXHBWISBPQEN-CYBMUJFWSA-N 1 1 266.344 4.618 20 0 CJADMO Cc1ccc2cc([C@H](C)Nc3cc(C)cc[nH+]3)oc2c1 ZINC000426013955 264308181 /nfs/dbraw/zinc/30/81/81/264308181.db2.gz BIDXHBWISBPQEN-ZDUSSCGKSA-N 1 1 266.344 4.618 20 0 CJADMO CC[C@@H]([NH2+]Cc1occc1C)c1cccc(Cl)c1F ZINC000426314885 330503825 /nfs/dbraw/zinc/50/38/25/330503825.db2.gz RLEZDJXJAMPKAG-CYBMUJFWSA-N 1 1 281.758 4.621 20 0 CJADMO C[C@@H]([NH2+]Cc1ccc(Cl)cc1F)c1cc(F)cc(F)c1 ZINC000427887711 260873606 /nfs/dbraw/zinc/87/36/06/260873606.db2.gz BQPWPZYNRGQMFH-SECBINFHSA-N 1 1 299.723 4.608 20 0 CJADMO Cc1nc(C(C)C)oc1C[N@H+]1CCCC2(CCCCC2)C1 ZINC000428222108 260891722 /nfs/dbraw/zinc/89/17/22/260891722.db2.gz VVKLFBQFTRBPCI-UHFFFAOYSA-N 1 1 290.451 4.653 20 0 CJADMO CC[C@@H](C)[C@H](C)[N@@H+](Cc1oc(C(C)C)nc1C)C1CC1 ZINC000428233408 260908715 /nfs/dbraw/zinc/90/87/15/260908715.db2.gz RZIUWEZJSFNEFJ-OCCSQVGLSA-N 1 1 278.440 4.505 20 0 CJADMO Cc1nc(C(C)C)oc1C[NH2+][C@H](C)c1ccccc1Cl ZINC000428364904 330521603 /nfs/dbraw/zinc/52/16/03/330521603.db2.gz AJMCDCAXWUDZQP-LLVKDONJSA-N 1 1 292.810 4.611 20 0 CJADMO Cc1nc(C(C)C)oc1C[N@H+]1CCC[C@H]1c1cccc(C)c1 ZINC000428456237 327378812 /nfs/dbraw/zinc/37/88/12/327378812.db2.gz HLUHMFJVGXEAKA-KRWDZBQOSA-N 1 1 298.430 4.752 20 0 CJADMO Cc1nc(C(C)C)oc1C[N@H+]1CCC[C@@H]1c1cccc(C)c1 ZINC000428456239 327378735 /nfs/dbraw/zinc/37/87/35/327378735.db2.gz HLUHMFJVGXEAKA-QGZVFWFLSA-N 1 1 298.430 4.752 20 0 CJADMO Cc1nc(C(C)C)oc1C[N@H+]1CCC[C@H]1c1ccsc1 ZINC000428461642 260744476 /nfs/dbraw/zinc/74/44/76/260744476.db2.gz PKIINBPSJFWTNV-AWEZNQCLSA-N 1 1 290.432 4.505 20 0 CJADMO Cc1nc(C(C)C)oc1C[N@@H+](C)[C@@H](C)c1ccccc1C ZINC000428477354 260755379 /nfs/dbraw/zinc/75/53/79/260755379.db2.gz ZLKCLNYZMRKXOY-HNNXBMFYSA-N 1 1 286.419 4.608 20 0 CJADMO Cc1nc(C(C)C)oc1C[N@@H+](C)[C@H](C)c1ccccc1C ZINC000428477355 327388757 /nfs/dbraw/zinc/38/87/57/327388757.db2.gz ZLKCLNYZMRKXOY-OAHLLOKOSA-N 1 1 286.419 4.608 20 0 CJADMO Cc1nc(C(C)C)oc1C[N@@H+](Cc1ccccc1C)C1CC1 ZINC000428485110 260761502 /nfs/dbraw/zinc/76/15/02/260761502.db2.gz MXUJQODGEIPWPD-UHFFFAOYSA-N 1 1 298.430 4.579 20 0 CJADMO CCc1nc(C)c(C[N@H+]2C[C@@H](C)CC[C@H]2c2ccccc2)o1 ZINC000428980241 260802827 /nfs/dbraw/zinc/80/28/27/260802827.db2.gz UOHCPDAXHKWJRL-YOEHRIQHSA-N 1 1 298.430 4.519 20 0 CJADMO C[C@@H]([NH2+]Cc1csc(Cl)c1Cl)c1ccccc1 ZINC000432237027 330595394 /nfs/dbraw/zinc/59/53/94/330595394.db2.gz CVIWBUQOQCBADW-SECBINFHSA-N 1 1 286.227 4.906 20 0 CJADMO CCCCC[N@@H+](Cc1cocn1)Cc1ccc(Cl)cc1 ZINC000432748447 330022253 /nfs/dbraw/zinc/02/22/53/330022253.db2.gz TZXSGKOKVWBGHF-UHFFFAOYSA-N 1 1 292.810 4.520 20 0 CJADMO CCCCC[N@H+](Cc1cocn1)Cc1ccc(Cl)cc1 ZINC000432748447 330022251 /nfs/dbraw/zinc/02/22/51/330022251.db2.gz TZXSGKOKVWBGHF-UHFFFAOYSA-N 1 1 292.810 4.520 20 0 CJADMO C[C@@H]1CC2(CCC2)C[N@H+]1Cc1cnc(C2CCCC2)s1 ZINC000432786442 330035681 /nfs/dbraw/zinc/03/56/81/330035681.db2.gz CRHPQHXGZXTALY-CYBMUJFWSA-N 1 1 290.476 4.565 20 0 CJADMO C[C@H]1CC2(CCC2)C[N@H+]1Cc1cnc(C2CCCC2)s1 ZINC000432786444 330035664 /nfs/dbraw/zinc/03/56/64/330035664.db2.gz CRHPQHXGZXTALY-ZDUSSCGKSA-N 1 1 290.476 4.565 20 0 CJADMO CC(C)c1[nH+]ccn1Cc1nc(C2CCCCC2)cs1 ZINC000435785472 330662976 /nfs/dbraw/zinc/66/29/76/330662976.db2.gz OTWBNXXOIAENQA-UHFFFAOYSA-N 1 1 289.448 4.559 20 0 CJADMO CC(C)c1[nH+]ccn1Cc1ccc(-c2ccsc2)cc1 ZINC000435786414 330663120 /nfs/dbraw/zinc/66/31/20/330663120.db2.gz TUHJRDXVNOIUTA-UHFFFAOYSA-N 1 1 282.412 4.783 20 0 CJADMO Cc1ccc(C[NH2+][C@@H](C)c2ncc(-c3ccccc3)o2)cc1 ZINC000439548784 330740252 /nfs/dbraw/zinc/74/02/52/330740252.db2.gz LZTVTEFYYGEAQS-HNNXBMFYSA-N 1 1 292.382 4.501 20 0 CJADMO Cc1ccc(C[NH2+][C@H](C)c2ncc(-c3ccccc3)o2)cc1 ZINC000439548785 330740268 /nfs/dbraw/zinc/74/02/68/330740268.db2.gz LZTVTEFYYGEAQS-OAHLLOKOSA-N 1 1 292.382 4.501 20 0 CJADMO Cc1cnc([C@@H](C)[NH2+][C@H]2CC(C)(C)CCc3ccccc32)o1 ZINC000440646502 330753468 /nfs/dbraw/zinc/75/34/68/330753468.db2.gz MPDMTYROGIUDLQ-PBHICJAKSA-N 1 1 298.430 4.737 20 0 CJADMO Cc1cnc([C@H](C)[NH2+][C@@H]2CC(C)(C)CCc3ccccc32)o1 ZINC000440646504 330753464 /nfs/dbraw/zinc/75/34/64/330753464.db2.gz MPDMTYROGIUDLQ-WMLDXEAASA-N 1 1 298.430 4.737 20 0 CJADMO CC[C@H](F)C[NH+](Cc1cccs1)Cc1cccs1 ZINC000440713407 330754955 /nfs/dbraw/zinc/75/49/55/330754955.db2.gz JOJBBGDUENEEOL-LBPRGKRZSA-N 1 1 283.437 4.560 20 0 CJADMO CC[N@@H+](Cc1ncc(-c2ccc(C)cc2)o1)[C@@H](C)C(C)C ZINC000441285404 263783821 /nfs/dbraw/zinc/78/38/21/263783821.db2.gz YFLINYBXNOWWJT-HNNXBMFYSA-N 1 1 286.419 4.516 20 0 CJADMO CSc1ccccc1[C@H](C)[NH2+]Cc1ccc(Cl)o1 ZINC000441342058 330766312 /nfs/dbraw/zinc/76/63/12/330766312.db2.gz XGZJGBMNWJUSNQ-JTQLQIEISA-N 1 1 281.808 4.506 20 0 CJADMO Cc1cccc([C@@H](C)[N@H+]2CC[C@H](c3ccccc3)C2)c1 ZINC000441538311 264210454 /nfs/dbraw/zinc/21/04/54/264210454.db2.gz ZBQYSZQTMZRCJU-APWZRJJASA-N 1 1 265.400 4.546 20 0 CJADMO Cc1cccc([C@H](C)[N@H+]2CC[C@H](c3ccccc3)C2)c1 ZINC000441538313 264210844 /nfs/dbraw/zinc/21/08/44/264210844.db2.gz ZBQYSZQTMZRCJU-LPHOPBHVSA-N 1 1 265.400 4.546 20 0 CJADMO Cc1cccc([C@H](C)[N@H+]2CC[C@@H](c3ccccc3)C2)c1 ZINC000441538314 264211491 /nfs/dbraw/zinc/21/14/91/264211491.db2.gz ZBQYSZQTMZRCJU-QFBILLFUSA-N 1 1 265.400 4.546 20 0 CJADMO Cc1cccc([C@@H](C)[N@H+]2CC[C@@H](c3ccccc3)C2)c1 ZINC000441538316 264211252 /nfs/dbraw/zinc/21/12/52/264211252.db2.gz ZBQYSZQTMZRCJU-VQIMIIECSA-N 1 1 265.400 4.546 20 0 CJADMO Cc1[nH+]ccn1CCCCSc1ccc2ccccc2c1 ZINC000442407596 330775645 /nfs/dbraw/zinc/77/56/45/330775645.db2.gz MSDMDTFIPLPQJJ-UHFFFAOYSA-N 1 1 296.439 4.917 20 0 CJADMO CCC[C@H](Nc1ccc2c(c1)[nH+]cn2C)c1ccsc1 ZINC000443088987 330794299 /nfs/dbraw/zinc/79/42/99/330794299.db2.gz CLQOFMVRKNOUPV-AWEZNQCLSA-N 1 1 285.416 4.588 20 0 CJADMO Cc1ccc(C[NH2+][C@@H](CC(F)(F)F)c2ccccc2C)o1 ZINC000444012244 330809450 /nfs/dbraw/zinc/80/94/50/330809450.db2.gz KUFVOBRYXXHAPN-HNNXBMFYSA-N 1 1 297.320 4.680 20 0 CJADMO Cc1ccc(C[NH2+][C@H](CC(F)(F)F)c2ccccc2C)o1 ZINC000444012248 330809331 /nfs/dbraw/zinc/80/93/31/330809331.db2.gz KUFVOBRYXXHAPN-OAHLLOKOSA-N 1 1 297.320 4.680 20 0 CJADMO Cc1ccoc1C[NH2+][C@@H](CC(F)(F)F)c1ccccc1C ZINC000444016799 330809490 /nfs/dbraw/zinc/80/94/90/330809490.db2.gz NLROAQQWLOXXHL-AWEZNQCLSA-N 1 1 297.320 4.680 20 0 CJADMO C[N@@H+](CCC(F)(F)F)Cc1ccc(-c2cccs2)cc1 ZINC000444624163 261054415 /nfs/dbraw/zinc/05/44/15/261054415.db2.gz LCLPZHYOZRCURA-UHFFFAOYSA-N 1 1 299.361 4.799 20 0 CJADMO c1sc(C[N@H+]2CC[C@H]3CCC[C@H]32)nc1C1CCCCC1 ZINC000444682259 261063441 /nfs/dbraw/zinc/06/34/41/261063441.db2.gz ZMOLUDLWGHNPJB-GDBMZVCRSA-N 1 1 290.476 4.565 20 0 CJADMO C[C@H](c1ccccc1Cl)[N@H+]1CC[C@H](CC(F)(F)F)C1 ZINC000444694989 261099359 /nfs/dbraw/zinc/09/93/59/261099359.db2.gz LAAZFKYRGKQCLS-GHMZBOCLSA-N 1 1 291.744 4.675 20 0 CJADMO C[C@H](c1ccccc1Cl)[N@H+]1CC[C@@H](CC(F)(F)F)C1 ZINC000444694995 261099927 /nfs/dbraw/zinc/09/99/27/261099927.db2.gz LAAZFKYRGKQCLS-MNOVXSKESA-N 1 1 291.744 4.675 20 0 CJADMO C[C@@H](c1ccccc1Cl)[N@H+]1CC[C@@H](CC(F)(F)F)C1 ZINC000444695000 261099755 /nfs/dbraw/zinc/09/97/55/261099755.db2.gz LAAZFKYRGKQCLS-QWRGUYRKSA-N 1 1 291.744 4.675 20 0 CJADMO C[C@@H](c1ccccc1Cl)[N@H+]1CC[C@H](CC(F)(F)F)C1 ZINC000444695008 261100147 /nfs/dbraw/zinc/10/01/47/261100147.db2.gz LAAZFKYRGKQCLS-WDEREUQCSA-N 1 1 291.744 4.675 20 0 CJADMO C[C@H]([NH2+]Cc1cc(F)ccc1Cl)c1ccc(F)cc1F ZINC000445809285 330837868 /nfs/dbraw/zinc/83/78/68/330837868.db2.gz VSTZMEXPNMFKGC-VIFPVBQESA-N 1 1 299.723 4.608 20 0 CJADMO C[C@@H]([NH2+]Cc1cc(F)ccc1Cl)c1cccc(F)c1F ZINC000445810123 330837831 /nfs/dbraw/zinc/83/78/31/330837831.db2.gz JRCZDJZLKDIQFE-SECBINFHSA-N 1 1 299.723 4.608 20 0 CJADMO Cc1ccccc1[C@H](CC(F)(F)F)[NH2+][C@H](C)c1ccco1 ZINC000447565469 330870317 /nfs/dbraw/zinc/87/03/17/330870317.db2.gz LKRFMQXAGCKBII-OCCSQVGLSA-N 1 1 297.320 4.932 20 0 CJADMO Cc1ccccc1[C@@H](CC(F)(F)F)[NH2+][C@H](C)c1ccco1 ZINC000447565470 330870298 /nfs/dbraw/zinc/87/02/98/330870298.db2.gz LKRFMQXAGCKBII-TZMCWYRMSA-N 1 1 297.320 4.932 20 0 CJADMO Cc1ccc([C@@H](C)[NH2+]Cc2ncc(C(C)(C)C)s2)cc1 ZINC000447940438 330880533 /nfs/dbraw/zinc/88/05/33/330880533.db2.gz OFTMWGYIAPYDMW-CYBMUJFWSA-N 1 1 288.460 4.600 20 0 CJADMO CC(C)(C)c1cnc(C[NH2+]C(C)(C)c2cccs2)s1 ZINC000447945811 260178383 /nfs/dbraw/zinc/17/83/83/260178383.db2.gz YBFKITWTSOZFCR-UHFFFAOYSA-N 1 1 294.489 4.527 20 0 CJADMO Cc1ccc([C@@H](C)[NH2+]Cc2ccc(-c3ccco3)cc2F)o1 ZINC000448026941 260585175 /nfs/dbraw/zinc/58/51/75/260585175.db2.gz KOBUYOQZZJNGPH-CYBMUJFWSA-N 1 1 299.345 4.838 20 0 CJADMO Cc1cc(C[NH2+][C@H](C)c2nc(C(C)(C)C)cs2)cs1 ZINC000449129222 330900733 /nfs/dbraw/zinc/90/07/33/330900733.db2.gz UNGGRBQQOCMUCH-LLVKDONJSA-N 1 1 294.489 4.661 20 0 CJADMO Cc1cc(C[NH2+][C@@H](C)c2nc(C(C)(C)C)cs2)cs1 ZINC000449129223 330900797 /nfs/dbraw/zinc/90/07/97/330900797.db2.gz UNGGRBQQOCMUCH-NSHDSACASA-N 1 1 294.489 4.661 20 0 CJADMO C[C@@H]([NH2+]Cc1ncc(Cl)s1)c1cccc(C2CC2)c1 ZINC000449346848 330916816 /nfs/dbraw/zinc/91/68/16/330916816.db2.gz APQMPFYMMFSYME-SNVBAGLBSA-N 1 1 292.835 4.525 20 0 CJADMO CC[C@H]([NH2+][C@@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1)C(F)F ZINC000449363005 260448913 /nfs/dbraw/zinc/44/89/13/260448913.db2.gz OOGIZIJIUICBEG-QEYWKRMJSA-N 1 1 293.810 4.527 20 0 CJADMO CC[C@@H]([NH2+][C@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1)C(F)F ZINC000449363011 260448865 /nfs/dbraw/zinc/44/88/65/260448865.db2.gz OOGIZIJIUICBEG-UTINFBMNSA-N 1 1 293.810 4.527 20 0 CJADMO Cc1cc([C@@H](C)[NH2+]Cc2csc(C(C)C)n2)ccc1F ZINC000449373381 327178357 /nfs/dbraw/zinc/17/83/57/327178357.db2.gz QUULZAMYYBQMJI-GFCCVEGCSA-N 1 1 292.423 4.565 20 0 CJADMO C[C@@H]([NH2+][C@H](C)C(C)(F)F)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000449414470 330923683 /nfs/dbraw/zinc/92/36/83/330923683.db2.gz MEPWVAACOGBLCI-DOLQZWNJSA-N 1 1 293.810 4.527 20 0 CJADMO C[C@@H]([NH2+][C@@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1)C(C)(F)F ZINC000449414471 330923740 /nfs/dbraw/zinc/92/37/40/330923740.db2.gz MEPWVAACOGBLCI-QCLAVDOMSA-N 1 1 293.810 4.527 20 0 CJADMO C[C@@H]([NH2+][C@@H](C)C(C)(F)F)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000449414472 330923643 /nfs/dbraw/zinc/92/36/43/330923643.db2.gz MEPWVAACOGBLCI-XFWSIPNHSA-N 1 1 293.810 4.527 20 0 CJADMO CCCc1ncc(C[NH2+]Cc2ccc(C3CCCC3)cc2)o1 ZINC000449609396 330939409 /nfs/dbraw/zinc/93/94/09/330939409.db2.gz BIAKJKLNABODAY-UHFFFAOYSA-N 1 1 298.430 4.575 20 0 CJADMO Cc1cccc([C@H](C)[NH2+]Cc2ncc(C(C)(C)C)s2)c1 ZINC000449779781 260847948 /nfs/dbraw/zinc/84/79/48/260847948.db2.gz UQANZPSMISNCDT-ZDUSSCGKSA-N 1 1 288.460 4.600 20 0 CJADMO CCCc1[nH+]ccn1Cc1ccc([C@@H](C)C(F)(F)F)cc1 ZINC000450889918 331004947 /nfs/dbraw/zinc/00/49/47/331004947.db2.gz SSBKXJGNBMRZEB-GFCCVEGCSA-N 1 1 296.336 4.550 20 0 CJADMO CCCc1[nH+]ccn1Cc1ccc([C@H](C)C(F)(F)F)cc1 ZINC000450889919 331005025 /nfs/dbraw/zinc/00/50/25/331005025.db2.gz SSBKXJGNBMRZEB-LBPRGKRZSA-N 1 1 296.336 4.550 20 0 CJADMO CC(C)c1[nH+]ccn1Cc1ccc([C@@H](C)C(F)(F)F)cc1 ZINC000450900207 331005760 /nfs/dbraw/zinc/00/57/60/331005760.db2.gz UJVUUYKLILPVIG-GFCCVEGCSA-N 1 1 296.336 4.721 20 0 CJADMO CC(C)c1[nH+]ccn1Cc1ccc([C@H](C)C(F)(F)F)cc1 ZINC000450900211 331005823 /nfs/dbraw/zinc/00/58/23/331005823.db2.gz UJVUUYKLILPVIG-LBPRGKRZSA-N 1 1 296.336 4.721 20 0 CJADMO CC(=O)c1ccc(C[N@H+]2CC(C)(C)[C@@H]2c2cccs2)cc1 ZINC000451043213 331013353 /nfs/dbraw/zinc/01/33/53/331013353.db2.gz XDHWDGIGFRVYFJ-KRWDZBQOSA-N 1 1 299.439 4.534 20 0 CJADMO CC(=O)c1ccc(C[N@@H+]2CC(C)(C)[C@@H]2c2cccs2)cc1 ZINC000451043213 331013352 /nfs/dbraw/zinc/01/33/52/331013352.db2.gz XDHWDGIGFRVYFJ-KRWDZBQOSA-N 1 1 299.439 4.534 20 0 CJADMO CC(=O)c1ccc(C[N@H+]2CC(C)(C)[C@H]2c2cccs2)cc1 ZINC000451043214 331013370 /nfs/dbraw/zinc/01/33/70/331013370.db2.gz XDHWDGIGFRVYFJ-QGZVFWFLSA-N 1 1 299.439 4.534 20 0 CJADMO CC(=O)c1ccc(C[N@@H+]2CC(C)(C)[C@H]2c2cccs2)cc1 ZINC000451043214 331013369 /nfs/dbraw/zinc/01/33/69/331013369.db2.gz XDHWDGIGFRVYFJ-QGZVFWFLSA-N 1 1 299.439 4.534 20 0 CJADMO C[C@@H]([NH2+]Cc1nc2ccccc2o1)c1cccc(C2CC2)c1 ZINC000451113950 331016005 /nfs/dbraw/zinc/01/60/05/331016005.db2.gz LRGVWONNVKEITH-CYBMUJFWSA-N 1 1 292.382 4.556 20 0 CJADMO C[C@H]([NH2+]Cc1nc2ccccc2o1)c1cccc(C2CC2)c1 ZINC000451113951 331016041 /nfs/dbraw/zinc/01/60/41/331016041.db2.gz LRGVWONNVKEITH-ZDUSSCGKSA-N 1 1 292.382 4.556 20 0 CJADMO FC1(F)CCC[C@H](C[N@H+]2CC3(CCC3)[C@H]2c2ccco2)C1 ZINC000451852680 331044669 /nfs/dbraw/zinc/04/46/69/331044669.db2.gz KRBIOENEMKWFBC-DZGCQCFKSA-N 1 1 295.373 4.632 20 0 CJADMO FC1(F)CCC[C@@H](C[N@H+]2CC3(CCC3)[C@@H]2c2ccco2)C1 ZINC000451852681 331044729 /nfs/dbraw/zinc/04/47/29/331044729.db2.gz KRBIOENEMKWFBC-HIFRSBDPSA-N 1 1 295.373 4.632 20 0 CJADMO FC1(F)CCC[C@@H](C[N@H+]2CC3(CCC3)[C@H]2c2ccco2)C1 ZINC000451852682 331044831 /nfs/dbraw/zinc/04/48/31/331044831.db2.gz KRBIOENEMKWFBC-UKRRQHHQSA-N 1 1 295.373 4.632 20 0 CJADMO FC1(F)CCC[C@H](C[N@H+]2CC3(CCC3)[C@@H]2c2ccco2)C1 ZINC000451852683 331044707 /nfs/dbraw/zinc/04/47/07/331044707.db2.gz KRBIOENEMKWFBC-ZFWWWQNUSA-N 1 1 295.373 4.632 20 0 CJADMO FC1(F)CCCC[C@H]1C[N@H+]1CC2(CCC2)[C@H]1c1ccco1 ZINC000451853864 331044690 /nfs/dbraw/zinc/04/46/90/331044690.db2.gz MHZIKYPXEPKOOZ-DZGCQCFKSA-N 1 1 295.373 4.632 20 0 CJADMO FC1(F)CCCC[C@@H]1C[N@H+]1CC2(CCC2)[C@@H]1c1ccco1 ZINC000451853865 331044732 /nfs/dbraw/zinc/04/47/32/331044732.db2.gz MHZIKYPXEPKOOZ-HIFRSBDPSA-N 1 1 295.373 4.632 20 0 CJADMO FC1(F)CCCC[C@@H]1C[N@H+]1CC2(CCC2)[C@H]1c1ccco1 ZINC000451853866 331044657 /nfs/dbraw/zinc/04/46/57/331044657.db2.gz MHZIKYPXEPKOOZ-UKRRQHHQSA-N 1 1 295.373 4.632 20 0 CJADMO FC1(F)CCCC[C@H]1C[N@H+]1CC2(CCC2)[C@@H]1c1ccco1 ZINC000451853867 331044676 /nfs/dbraw/zinc/04/46/76/331044676.db2.gz MHZIKYPXEPKOOZ-ZFWWWQNUSA-N 1 1 295.373 4.632 20 0 CJADMO c1coc([C@@H]2[N@@H+](CCCc3ccsc3)CC23CCC3)c1 ZINC000451865252 331045374 /nfs/dbraw/zinc/04/53/74/331045374.db2.gz XUEDSIHVIDBTTK-INIZCTEOSA-N 1 1 287.428 4.501 20 0 CJADMO c1coc([C@H]2[N@@H+](CCCc3ccsc3)CC23CCC3)c1 ZINC000451865253 331045439 /nfs/dbraw/zinc/04/54/39/331045439.db2.gz XUEDSIHVIDBTTK-MRXNPFEDSA-N 1 1 287.428 4.501 20 0 CJADMO FC(F)(F)CCCC[N@H+]1CC2(CCC2)[C@H]1c1ccco1 ZINC000451866974 331045407 /nfs/dbraw/zinc/04/54/07/331045407.db2.gz YRMQBNSKSJOUJW-CYBMUJFWSA-N 1 1 287.325 4.539 20 0 CJADMO FC(F)(F)CCCC[N@@H+]1CC2(CCC2)[C@H]1c1ccco1 ZINC000451866974 331045406 /nfs/dbraw/zinc/04/54/06/331045406.db2.gz YRMQBNSKSJOUJW-CYBMUJFWSA-N 1 1 287.325 4.539 20 0 CJADMO FC(F)(F)CCCC[N@H+]1CC2(CCC2)[C@@H]1c1ccco1 ZINC000451866977 331045399 /nfs/dbraw/zinc/04/53/99/331045399.db2.gz YRMQBNSKSJOUJW-ZDUSSCGKSA-N 1 1 287.325 4.539 20 0 CJADMO FC(F)(F)CCCC[N@@H+]1CC2(CCC2)[C@@H]1c1ccco1 ZINC000451866977 331045398 /nfs/dbraw/zinc/04/53/98/331045398.db2.gz YRMQBNSKSJOUJW-ZDUSSCGKSA-N 1 1 287.325 4.539 20 0 CJADMO CCCCc1nc(C[NH2+][C@@H](C)c2cccc(C)c2)cs1 ZINC000452082055 331053415 /nfs/dbraw/zinc/05/34/15/331053415.db2.gz ITJWNRJDJQPWTA-AWEZNQCLSA-N 1 1 288.460 4.645 20 0 CJADMO CCCCc1nc(C[NH2+][C@H](C)c2cccc(C)c2)cs1 ZINC000452082056 331053555 /nfs/dbraw/zinc/05/35/55/331053555.db2.gz ITJWNRJDJQPWTA-CQSZACIVSA-N 1 1 288.460 4.645 20 0 CJADMO Cc1cccc([C@@H](C)[NH2+]Cc2ncc(Cl)cc2Cl)c1 ZINC000452086658 331053569 /nfs/dbraw/zinc/05/35/69/331053569.db2.gz NDVNSWAJPJKXOB-LLVKDONJSA-N 1 1 295.213 4.548 20 0 CJADMO Cc1cccc([C@H](C)[NH2+]Cc2ncc(Cl)cc2Cl)c1 ZINC000452086664 263035253 /nfs/dbraw/zinc/03/52/53/263035253.db2.gz NDVNSWAJPJKXOB-NSHDSACASA-N 1 1 295.213 4.548 20 0 CJADMO Cc1cccc([C@H](C)[NH2+][C@@H](C)c2nc3ccccc3o2)c1 ZINC000452094005 331053769 /nfs/dbraw/zinc/05/37/69/331053769.db2.gz UTKGZONKYSBFKK-KBPBESRZSA-N 1 1 280.371 4.548 20 0 CJADMO Cc1cccc([C@@H](C)[NH2+][C@@H](C)c2nc3ccccc3o2)c1 ZINC000452094006 331053942 /nfs/dbraw/zinc/05/39/42/331053942.db2.gz UTKGZONKYSBFKK-KGLIPLIRSA-N 1 1 280.371 4.548 20 0 CJADMO Cc1cccc([C@H](C)[NH2+][C@H](C)c2nc3ccccc3o2)c1 ZINC000452094007 331053849 /nfs/dbraw/zinc/05/38/49/331053849.db2.gz UTKGZONKYSBFKK-UONOGXRCSA-N 1 1 280.371 4.548 20 0 CJADMO Cc1cccc([C@@H](C)[NH2+][C@H](C)c2nc3ccccc3o2)c1 ZINC000452094008 331053931 /nfs/dbraw/zinc/05/39/31/331053931.db2.gz UTKGZONKYSBFKK-ZIAGYGMSSA-N 1 1 280.371 4.548 20 0 CJADMO Cc1nc(C(C)C)oc1C[N@H+](C(C)C)C1CC(C)(C)C1 ZINC000452111249 331054552 /nfs/dbraw/zinc/05/45/52/331054552.db2.gz SXUOAKHCBUKBIE-UHFFFAOYSA-N 1 1 278.440 4.505 20 0 CJADMO Cc1cc([C@H](C)[NH2+]Cc2c(F)cccc2Cl)cs1 ZINC000453078144 331087007 /nfs/dbraw/zinc/08/70/07/331087007.db2.gz BQFNIPVAWAOHCG-JTQLQIEISA-N 1 1 283.799 4.700 20 0 CJADMO Cc1cc([C@@H](C)[NH2+]Cc2c(F)cccc2Cl)cs1 ZINC000453078145 331087072 /nfs/dbraw/zinc/08/70/72/331087072.db2.gz BQFNIPVAWAOHCG-SNVBAGLBSA-N 1 1 283.799 4.700 20 0 CJADMO CCn1ccnc1[C@H](C)[NH2+][C@H](C)c1ccc(CC(C)C)cc1 ZINC000453089913 331088079 /nfs/dbraw/zinc/08/80/79/331088079.db2.gz OYBFPXYMTBXYCV-CVEARBPZSA-N 1 1 299.462 4.513 20 0 CJADMO CCn1ccnc1[C@H](C)[NH2+][C@@H](C)c1ccc(CC(C)C)cc1 ZINC000453089914 331088111 /nfs/dbraw/zinc/08/81/11/331088111.db2.gz OYBFPXYMTBXYCV-HOTGVXAUSA-N 1 1 299.462 4.513 20 0 CJADMO CCn1ccnc1[C@@H](C)[NH2+][C@H](C)c1ccc(CC(C)C)cc1 ZINC000453089915 331088152 /nfs/dbraw/zinc/08/81/52/331088152.db2.gz OYBFPXYMTBXYCV-HZPDHXFCSA-N 1 1 299.462 4.513 20 0 CJADMO CCn1ccnc1[C@@H](C)[NH2+][C@@H](C)c1ccc(CC(C)C)cc1 ZINC000453089916 331088174 /nfs/dbraw/zinc/08/81/74/331088174.db2.gz OYBFPXYMTBXYCV-JKSUJKDBSA-N 1 1 299.462 4.513 20 0 CJADMO CCC(CC)c1cc(C[NH2+][C@@H](CC)c2ccsc2)on1 ZINC000453115357 331090587 /nfs/dbraw/zinc/09/05/87/331090587.db2.gz HUMNGRMEHUELJZ-HNNXBMFYSA-N 1 1 292.448 4.881 20 0 CJADMO CCC(CC)c1cc(C[NH2+][C@H](CC)c2ccsc2)on1 ZINC000453115358 331090580 /nfs/dbraw/zinc/09/05/80/331090580.db2.gz HUMNGRMEHUELJZ-OAHLLOKOSA-N 1 1 292.448 4.881 20 0 CJADMO Cc1cc([C@@H](C)[NH2+]Cc2nc(C(C)C)c(C)s2)cs1 ZINC000453116755 331090722 /nfs/dbraw/zinc/09/07/22/331090722.db2.gz JPZPKRASWYDYLD-LLVKDONJSA-N 1 1 294.489 4.796 20 0 CJADMO Cc1cc([C@H](C)[NH2+]Cc2nc(C(C)C)c(C)s2)cs1 ZINC000453116761 331090730 /nfs/dbraw/zinc/09/07/30/331090730.db2.gz JPZPKRASWYDYLD-NSHDSACASA-N 1 1 294.489 4.796 20 0 CJADMO CC[C@@H]([NH2+][C@H](C)c1c(F)cccc1OC)c1ccsc1 ZINC000453117578 331090831 /nfs/dbraw/zinc/09/08/31/331090831.db2.gz KKPKTJLZWYBPFW-BXUZGUMPSA-N 1 1 293.407 4.698 20 0 CJADMO CC[C@H]([NH2+][C@@H](C)c1c(F)cccc1OC)c1ccsc1 ZINC000453117612 331090846 /nfs/dbraw/zinc/09/08/46/331090846.db2.gz KKPKTJLZWYBPFW-FZMZJTMJSA-N 1 1 293.407 4.698 20 0 CJADMO CC[C@H]([NH2+][C@H](C)c1c(F)cccc1OC)c1ccsc1 ZINC000453117615 331090912 /nfs/dbraw/zinc/09/09/12/331090912.db2.gz KKPKTJLZWYBPFW-RISCZKNCSA-N 1 1 293.407 4.698 20 0 CJADMO CC[C@@H]([NH2+][C@@H](C)c1c(F)cccc1OC)c1ccsc1 ZINC000453117619 331090852 /nfs/dbraw/zinc/09/08/52/331090852.db2.gz KKPKTJLZWYBPFW-SMDDNHRTSA-N 1 1 293.407 4.698 20 0 CJADMO CC[C@@H]([NH2+]Cc1nc(C(C)C)c(C)s1)c1ccsc1 ZINC000453124673 331091718 /nfs/dbraw/zinc/09/17/18/331091718.db2.gz QJKUFRLMGDAMCF-CYBMUJFWSA-N 1 1 294.489 4.877 20 0 CJADMO CC[C@H]([NH2+]Cc1nc(C(C)C)c(C)s1)c1ccsc1 ZINC000453124679 331091632 /nfs/dbraw/zinc/09/16/32/331091632.db2.gz QJKUFRLMGDAMCF-ZDUSSCGKSA-N 1 1 294.489 4.877 20 0 CJADMO CCC(CC)c1cc(C[NH2+][C@H](C)c2csc(C)c2)on1 ZINC000453124814 331091801 /nfs/dbraw/zinc/09/18/01/331091801.db2.gz USYJMJCHOUFCNN-GFCCVEGCSA-N 1 1 292.448 4.799 20 0 CJADMO CCC(CC)c1cc(C[NH2+][C@@H](C)c2csc(C)c2)on1 ZINC000453124819 331091836 /nfs/dbraw/zinc/09/18/36/331091836.db2.gz USYJMJCHOUFCNN-LBPRGKRZSA-N 1 1 292.448 4.799 20 0 CJADMO COc1cccc(F)c1[C@H](C)[NH2+][C@H](C)c1csc(C)c1 ZINC000453127258 331091899 /nfs/dbraw/zinc/09/18/99/331091899.db2.gz YQKCGTNCUQCHFO-NEPJUHHUSA-N 1 1 293.407 4.616 20 0 CJADMO COc1cccc(F)c1[C@@H](C)[NH2+][C@@H](C)c1csc(C)c1 ZINC000453127260 331091953 /nfs/dbraw/zinc/09/19/53/331091953.db2.gz YQKCGTNCUQCHFO-NWDGAFQWSA-N 1 1 293.407 4.616 20 0 CJADMO COc1cccc(F)c1[C@H](C)[NH2+][C@@H](C)c1csc(C)c1 ZINC000453127261 331091951 /nfs/dbraw/zinc/09/19/51/331091951.db2.gz YQKCGTNCUQCHFO-RYUDHWBXSA-N 1 1 293.407 4.616 20 0 CJADMO COc1cccc(F)c1[C@@H](C)[NH2+][C@H](C)c1csc(C)c1 ZINC000453127263 331091879 /nfs/dbraw/zinc/09/18/79/331091879.db2.gz YQKCGTNCUQCHFO-VXGBXAGGSA-N 1 1 293.407 4.616 20 0 CJADMO CSc1ccc([C@H](C)[C@@H]2CCn3cc[nH+]c32)c(Cl)c1 ZINC000453141595 331093536 /nfs/dbraw/zinc/09/35/36/331093536.db2.gz LCWPUUJCLCTSHG-GWCFXTLKSA-N 1 1 292.835 4.549 20 0 CJADMO CSc1ccc([C@H](C)[C@H]2CCn3cc[nH+]c32)c(Cl)c1 ZINC000453141596 331093557 /nfs/dbraw/zinc/09/35/57/331093557.db2.gz LCWPUUJCLCTSHG-GXFFZTMASA-N 1 1 292.835 4.549 20 0 CJADMO CSc1ccc([C@@H](C)[C@@H]2CCn3cc[nH+]c32)c(Cl)c1 ZINC000453141597 331093500 /nfs/dbraw/zinc/09/35/00/331093500.db2.gz LCWPUUJCLCTSHG-MFKMUULPSA-N 1 1 292.835 4.549 20 0 CJADMO CSc1ccc([C@@H](C)[C@H]2CCn3cc[nH+]c32)c(Cl)c1 ZINC000453141598 331093543 /nfs/dbraw/zinc/09/35/43/331093543.db2.gz LCWPUUJCLCTSHG-ZWNOBZJWSA-N 1 1 292.835 4.549 20 0 CJADMO CC[C@H]([NH2+][C@H](C)c1c(F)cccc1Cl)c1ccncc1 ZINC000453154086 331094910 /nfs/dbraw/zinc/09/49/10/331094910.db2.gz RCXONGZMILDRPK-ABAIWWIYSA-N 1 1 292.785 4.676 20 0 CJADMO CC[C@@H]([NH2+][C@H](C)c1c(F)cccc1Cl)c1ccncc1 ZINC000453154088 331094890 /nfs/dbraw/zinc/09/48/90/331094890.db2.gz RCXONGZMILDRPK-IAQYHMDHSA-N 1 1 292.785 4.676 20 0 CJADMO CC[C@H]([NH2+][C@@H](C)c1c(F)cccc1Cl)c1ccncc1 ZINC000453154090 331094904 /nfs/dbraw/zinc/09/49/04/331094904.db2.gz RCXONGZMILDRPK-NHYWBVRUSA-N 1 1 292.785 4.676 20 0 CJADMO CC[C@@H]([NH2+][C@@H](C)c1c(F)cccc1Cl)c1ccncc1 ZINC000453154092 331094850 /nfs/dbraw/zinc/09/48/50/331094850.db2.gz RCXONGZMILDRPK-XHDPSFHLSA-N 1 1 292.785 4.676 20 0 CJADMO CC[C@@H](Nc1ccc([NH+]2CCCC2)cc1C)c1ccncc1 ZINC000453182211 331098169 /nfs/dbraw/zinc/09/81/69/331098169.db2.gz SNSLCNIRMSPAIR-GOSISDBHSA-N 1 1 295.430 4.553 20 0 CJADMO CC[C@H](Nc1ccc([NH+]2CCCC2)cc1C)c1ccncc1 ZINC000453182213 331098185 /nfs/dbraw/zinc/09/81/85/331098185.db2.gz SNSLCNIRMSPAIR-SFHVURJKSA-N 1 1 295.430 4.553 20 0 CJADMO CCC[C@@H]([NH2+]Cc1cc(C2CC2)ccc1F)c1ccccn1 ZINC000453249050 331107296 /nfs/dbraw/zinc/10/72/96/331107296.db2.gz CDLGRWAUPFUBBS-GOSISDBHSA-N 1 1 298.405 4.729 20 0 CJADMO CCC[C@H]([NH2+]Cc1cc(C2CC2)ccc1F)c1ccccn1 ZINC000453249051 331107320 /nfs/dbraw/zinc/10/73/20/331107320.db2.gz CDLGRWAUPFUBBS-SFHVURJKSA-N 1 1 298.405 4.729 20 0 CJADMO Cc1cc([C@@H](C)Nc2cc(C3CC3)cc[nH+]2)cs1 ZINC000453250109 331107546 /nfs/dbraw/zinc/10/75/46/331107546.db2.gz KJLQGAZGQKGADS-LLVKDONJSA-N 1 1 258.390 4.502 20 0 CJADMO Cc1cc([C@H](C)Nc2cc(C3CC3)cc[nH+]2)cs1 ZINC000453250113 331107561 /nfs/dbraw/zinc/10/75/61/331107561.db2.gz KJLQGAZGQKGADS-NSHDSACASA-N 1 1 258.390 4.502 20 0 CJADMO CCc1cccnc1[C@@H](C)[NH2+]Cc1cc(C2CC2)ccc1F ZINC000453252553 331107849 /nfs/dbraw/zinc/10/78/49/331107849.db2.gz HCJBYEKXHAJEDJ-CYBMUJFWSA-N 1 1 298.405 4.511 20 0 CJADMO CCc1cccnc1[C@H](C)[NH2+]Cc1cc(C2CC2)ccc1F ZINC000453252555 331107852 /nfs/dbraw/zinc/10/78/52/331107852.db2.gz HCJBYEKXHAJEDJ-ZDUSSCGKSA-N 1 1 298.405 4.511 20 0 CJADMO COc1ccccc1[C@@H](C)[NH2+]Cc1cc(C2CC2)ccc1F ZINC000453259999 331108534 /nfs/dbraw/zinc/10/85/34/331108534.db2.gz PZDDSQBTAWOKSN-CYBMUJFWSA-N 1 1 299.389 4.563 20 0 CJADMO COc1ccccc1[C@H](C)[NH2+]Cc1cc(C2CC2)ccc1F ZINC000453260000 331108552 /nfs/dbraw/zinc/10/85/52/331108552.db2.gz PZDDSQBTAWOKSN-ZDUSSCGKSA-N 1 1 299.389 4.563 20 0 CJADMO CC[C@H](Nc1cc(C2CC2)cc[nH+]1)c1ccsc1 ZINC000453260437 331108526 /nfs/dbraw/zinc/10/85/26/331108526.db2.gz VKMAYFGEBUUFAA-AWEZNQCLSA-N 1 1 258.390 4.584 20 0 CJADMO CC[C@@H](Nc1cc(C2CC2)cc[nH+]1)c1ccsc1 ZINC000453260440 331108531 /nfs/dbraw/zinc/10/85/31/331108531.db2.gz VKMAYFGEBUUFAA-CQSZACIVSA-N 1 1 258.390 4.584 20 0 CJADMO CCn1ccnc1[C@H](C)[NH2+][C@H](C)c1cccc(CC(C)C)c1 ZINC000453331841 331117878 /nfs/dbraw/zinc/11/78/78/331117878.db2.gz ANQDVHASGSLOTI-CVEARBPZSA-N 1 1 299.462 4.513 20 0 CJADMO CCn1ccnc1[C@H](C)[NH2+][C@@H](C)c1cccc(CC(C)C)c1 ZINC000453331843 331117818 /nfs/dbraw/zinc/11/78/18/331117818.db2.gz ANQDVHASGSLOTI-HOTGVXAUSA-N 1 1 299.462 4.513 20 0 CJADMO CCn1ccnc1[C@@H](C)[NH2+][C@H](C)c1cccc(CC(C)C)c1 ZINC000453331846 331117876 /nfs/dbraw/zinc/11/78/76/331117876.db2.gz ANQDVHASGSLOTI-HZPDHXFCSA-N 1 1 299.462 4.513 20 0 CJADMO CCn1ccnc1[C@@H](C)[NH2+][C@@H](C)c1cccc(CC(C)C)c1 ZINC000453331847 331117831 /nfs/dbraw/zinc/11/78/31/331117831.db2.gz ANQDVHASGSLOTI-JKSUJKDBSA-N 1 1 299.462 4.513 20 0 CJADMO CC[C@@H]([NH2+]Cc1cnc(C2CC2)o1)c1ccc(Cl)s1 ZINC000453347651 331120262 /nfs/dbraw/zinc/12/02/62/331120262.db2.gz INGOOPFRJVHFNZ-LLVKDONJSA-N 1 1 296.823 4.508 20 0 CJADMO CC[C@H]([NH2+]Cc1cnc(C2CC2)o1)c1ccc(Cl)s1 ZINC000453347654 331120193 /nfs/dbraw/zinc/12/01/93/331120193.db2.gz INGOOPFRJVHFNZ-NSHDSACASA-N 1 1 296.823 4.508 20 0 CJADMO CCn1ccnc1[C@H](C)[NH2+][C@H](C)c1ccccc1C(C)(C)C ZINC000453357221 331121792 /nfs/dbraw/zinc/12/17/92/331121792.db2.gz PQTZGBFHTMDNLR-CABCVRRESA-N 1 1 299.462 4.612 20 0 CJADMO CCn1ccnc1[C@H](C)[NH2+][C@@H](C)c1ccccc1C(C)(C)C ZINC000453357224 331121828 /nfs/dbraw/zinc/12/18/28/331121828.db2.gz PQTZGBFHTMDNLR-GJZGRUSLSA-N 1 1 299.462 4.612 20 0 CJADMO CCn1ccnc1[C@@H](C)[NH2+][C@H](C)c1ccccc1C(C)(C)C ZINC000453357226 331121788 /nfs/dbraw/zinc/12/17/88/331121788.db2.gz PQTZGBFHTMDNLR-HUUCEWRRSA-N 1 1 299.462 4.612 20 0 CJADMO CCn1ccnc1[C@@H](C)[NH2+][C@@H](C)c1ccccc1C(C)(C)C ZINC000453357229 331121818 /nfs/dbraw/zinc/12/18/18/331121818.db2.gz PQTZGBFHTMDNLR-LSDHHAIUSA-N 1 1 299.462 4.612 20 0 CJADMO CCCc1ncc(C[NH2+][C@H](CC)c2ccc(Cl)s2)o1 ZINC000453358473 331121994 /nfs/dbraw/zinc/12/19/94/331121994.db2.gz DUZNIRJWSWUZLK-LLVKDONJSA-N 1 1 298.839 4.583 20 0 CJADMO CCCc1ncc(C[NH2+][C@@H](CC)c2ccc(Cl)s2)o1 ZINC000453358476 331122066 /nfs/dbraw/zinc/12/20/66/331122066.db2.gz DUZNIRJWSWUZLK-NSHDSACASA-N 1 1 298.839 4.583 20 0 CJADMO CCCCc1ccc([C@H](C)[NH2+][C@H]2C[C@H](C)n3ccnc32)cc1 ZINC000453365641 331123373 /nfs/dbraw/zinc/12/33/73/331123373.db2.gz SNLKIRPAFRQTCT-MPGHIAIKSA-N 1 1 297.446 4.582 20 0 CJADMO CCCCc1ccc([C@H](C)[NH2+][C@@H]2C[C@H](C)n3ccnc32)cc1 ZINC000453365642 331123261 /nfs/dbraw/zinc/12/32/61/331123261.db2.gz SNLKIRPAFRQTCT-RLFYNMQTSA-N 1 1 297.446 4.582 20 0 CJADMO CCCCc1ccc([C@H](C)[NH2+][C@@H]2C[C@@H](C)n3ccnc32)cc1 ZINC000453365643 331123296 /nfs/dbraw/zinc/12/32/96/331123296.db2.gz SNLKIRPAFRQTCT-RVKKMQEKSA-N 1 1 297.446 4.582 20 0 CJADMO CCCCc1ccc([C@H](C)[NH2+][C@H]2C[C@@H](C)n3ccnc32)cc1 ZINC000453365644 331123379 /nfs/dbraw/zinc/12/33/79/331123379.db2.gz SNLKIRPAFRQTCT-VKJFTORMSA-N 1 1 297.446 4.582 20 0 CJADMO C[C@H]([NH2+][C@@H]1C[C@H](C)n2ccnc21)c1ccccc1C(C)(C)C ZINC000453365671 331123277 /nfs/dbraw/zinc/12/32/77/331123277.db2.gz SSXLMWRRFSCBCG-GRDNDAEWSA-N 1 1 297.446 4.537 20 0 CJADMO C[C@H]([NH2+][C@@H]1C[C@@H](C)n2ccnc21)c1ccccc1C(C)(C)C ZINC000453365672 331123328 /nfs/dbraw/zinc/12/33/28/331123328.db2.gz SSXLMWRRFSCBCG-JKIFEVAISA-N 1 1 297.446 4.537 20 0 CJADMO C[C@H]([NH2+][C@H]1C[C@@H](C)n2ccnc21)c1ccccc1C(C)(C)C ZINC000453365673 331123283 /nfs/dbraw/zinc/12/32/83/331123283.db2.gz SSXLMWRRFSCBCG-KEYYUXOJSA-N 1 1 297.446 4.537 20 0 CJADMO C[C@H]([NH2+][C@H]1C[C@H](C)n2ccnc21)c1ccccc1C(C)(C)C ZINC000453365674 331123291 /nfs/dbraw/zinc/12/32/91/331123291.db2.gz SSXLMWRRFSCBCG-ZQIUZPCESA-N 1 1 297.446 4.537 20 0 CJADMO CCCCc1ccc([C@@H](C)[NH2+][C@@H](C)c2nccn2CC)cc1 ZINC000453376745 331125148 /nfs/dbraw/zinc/12/51/48/331125148.db2.gz YWIBBAPQNUVEKC-CVEARBPZSA-N 1 1 299.462 4.657 20 0 CJADMO CCCCc1ccc([C@H](C)[NH2+][C@@H](C)c2nccn2CC)cc1 ZINC000453377668 331125114 /nfs/dbraw/zinc/12/51/14/331125114.db2.gz YWIBBAPQNUVEKC-HOTGVXAUSA-N 1 1 299.462 4.657 20 0 CJADMO CCCCc1ccc([C@@H](C)[NH2+][C@H](C)c2nccn2CC)cc1 ZINC000453377670 331125153 /nfs/dbraw/zinc/12/51/53/331125153.db2.gz YWIBBAPQNUVEKC-HZPDHXFCSA-N 1 1 299.462 4.657 20 0 CJADMO CCCCc1ccc([C@H](C)[NH2+][C@H](C)c2nccn2CC)cc1 ZINC000453377672 331125070 /nfs/dbraw/zinc/12/50/70/331125070.db2.gz YWIBBAPQNUVEKC-JKSUJKDBSA-N 1 1 299.462 4.657 20 0 CJADMO CCCc1ncc(C[NH2+][C@H](C)c2oc3ccccc3c2C)o1 ZINC000453392664 331127552 /nfs/dbraw/zinc/12/75/52/331127552.db2.gz RKYRQXMDMAAVFP-CYBMUJFWSA-N 1 1 298.386 4.533 20 0 CJADMO CCCc1ncc(C[NH2+][C@@H](C)c2oc3ccccc3c2C)o1 ZINC000453392665 331127434 /nfs/dbraw/zinc/12/74/34/331127434.db2.gz RKYRQXMDMAAVFP-ZDUSSCGKSA-N 1 1 298.386 4.533 20 0 CJADMO CCCc1ncc(C[NH2+][C@H](C)c2cc3ccc(C)cc3o2)o1 ZINC000453401654 331128708 /nfs/dbraw/zinc/12/87/08/331128708.db2.gz ZGRCBRXEBDLJQM-CYBMUJFWSA-N 1 1 298.386 4.533 20 0 CJADMO CCCc1ncc(C[NH2+][C@@H](C)c2cc3ccc(C)cc3o2)o1 ZINC000453401655 331128723 /nfs/dbraw/zinc/12/87/23/331128723.db2.gz ZGRCBRXEBDLJQM-ZDUSSCGKSA-N 1 1 298.386 4.533 20 0 CJADMO C[C@H](c1cccs1)[N@@H+](C)CC1CCC(F)(F)CC1 ZINC000459305763 331275469 /nfs/dbraw/zinc/27/54/69/331275469.db2.gz QBDFJGNIWRQQPQ-LLVKDONJSA-N 1 1 273.392 4.566 20 0 CJADMO C[C@@H](c1cccs1)[N@@H+](C)CC1CCC(F)(F)CC1 ZINC000459305764 331275418 /nfs/dbraw/zinc/27/54/18/331275418.db2.gz QBDFJGNIWRQQPQ-NSHDSACASA-N 1 1 273.392 4.566 20 0 CJADMO CCC(CC)c1cc(C[NH2+]Cc2ccc(C3CC3)cc2)on1 ZINC000459419621 331280557 /nfs/dbraw/zinc/28/05/57/331280557.db2.gz JWMHYUPETFQCSO-UHFFFAOYSA-N 1 1 298.430 4.745 20 0 CJADMO FC1(F)CCC(C[N@H+]2CC3(CCC3)[C@@H]2c2ccco2)CC1 ZINC000459501944 331285135 /nfs/dbraw/zinc/28/51/35/331285135.db2.gz DIZZTVVKBYYBGT-HNNXBMFYSA-N 1 1 295.373 4.632 20 0 CJADMO FC1(F)CCC(C[N@H+]2CC3(CCC3)[C@H]2c2ccco2)CC1 ZINC000459501946 331285201 /nfs/dbraw/zinc/28/52/01/331285201.db2.gz DIZZTVVKBYYBGT-OAHLLOKOSA-N 1 1 295.373 4.632 20 0 CJADMO Cc1cnc([C@H](C)[N@H+]2CC3(CCCC3)[C@H]2c2ccccc2)o1 ZINC000459573978 331288600 /nfs/dbraw/zinc/28/86/00/331288600.db2.gz IXUNBCVLYAGXFV-DOTOQJQBSA-N 1 1 296.414 4.661 20 0 CJADMO Cc1cnc([C@H](C)[N@@H+]2CC3(CCCC3)[C@H]2c2ccccc2)o1 ZINC000459573978 331288599 /nfs/dbraw/zinc/28/85/99/331288599.db2.gz IXUNBCVLYAGXFV-DOTOQJQBSA-N 1 1 296.414 4.661 20 0 CJADMO Cc1cnc([C@@H](C)[N@H+]2CC3(CCCC3)[C@H]2c2ccccc2)o1 ZINC000459573980 331288613 /nfs/dbraw/zinc/28/86/13/331288613.db2.gz IXUNBCVLYAGXFV-NVXWUHKLSA-N 1 1 296.414 4.661 20 0 CJADMO Cc1cnc([C@@H](C)[N@@H+]2CC3(CCCC3)[C@H]2c2ccccc2)o1 ZINC000459573980 331288612 /nfs/dbraw/zinc/28/86/12/331288612.db2.gz IXUNBCVLYAGXFV-NVXWUHKLSA-N 1 1 296.414 4.661 20 0 CJADMO Cc1cnc([C@H](C)[N@H+]2CC3(CCCC3)[C@@H]2c2ccccc2)o1 ZINC000459573981 331288547 /nfs/dbraw/zinc/28/85/47/331288547.db2.gz IXUNBCVLYAGXFV-RDJZCZTQSA-N 1 1 296.414 4.661 20 0 CJADMO Cc1cnc([C@H](C)[N@@H+]2CC3(CCCC3)[C@@H]2c2ccccc2)o1 ZINC000459573981 331288546 /nfs/dbraw/zinc/28/85/46/331288546.db2.gz IXUNBCVLYAGXFV-RDJZCZTQSA-N 1 1 296.414 4.661 20 0 CJADMO Cc1cnc([C@@H](C)[N@H+]2CC3(CCCC3)[C@@H]2c2ccccc2)o1 ZINC000459573982 331288697 /nfs/dbraw/zinc/28/86/97/331288697.db2.gz IXUNBCVLYAGXFV-WBVHZDCISA-N 1 1 296.414 4.661 20 0 CJADMO Cc1cnc([C@@H](C)[N@@H+]2CC3(CCCC3)[C@@H]2c2ccccc2)o1 ZINC000459573982 331288696 /nfs/dbraw/zinc/28/86/96/331288696.db2.gz IXUNBCVLYAGXFV-WBVHZDCISA-N 1 1 296.414 4.661 20 0 CJADMO CC(C)c1cnc(C[NH2+][C@H](C)c2ccc(Cl)cc2)s1 ZINC000459761990 331299075 /nfs/dbraw/zinc/29/90/75/331299075.db2.gz LBJFRJHOWCEYKP-LLVKDONJSA-N 1 1 294.851 4.771 20 0 CJADMO CC(C)c1cnc(C[NH2+][C@@H](C)c2ccc(Cl)cc2)s1 ZINC000459761991 331299096 /nfs/dbraw/zinc/29/90/96/331299096.db2.gz LBJFRJHOWCEYKP-NSHDSACASA-N 1 1 294.851 4.771 20 0 CJADMO CCCc1csc(C[NH2+][C@H](C)c2ccc(Cl)cc2)n1 ZINC000459775798 329390718 /nfs/dbraw/zinc/39/07/18/329390718.db2.gz XQDWDLNITIPTLP-LLVKDONJSA-N 1 1 294.851 4.600 20 0 CJADMO CCCc1csc(C[NH2+][C@@H](C)c2ccc(Cl)cc2)n1 ZINC000459775800 329390778 /nfs/dbraw/zinc/39/07/78/329390778.db2.gz XQDWDLNITIPTLP-NSHDSACASA-N 1 1 294.851 4.600 20 0 CJADMO CCSCC[C@@H](C)[N@@H+](C)Cc1ccc(C(F)F)cc1 ZINC000461362032 331312588 /nfs/dbraw/zinc/31/25/88/331312588.db2.gz OQXSXRGNDXUWAG-GFCCVEGCSA-N 1 1 287.419 4.588 20 0 CJADMO CCSCC[C@H](C)[N@@H+](C)Cc1ccc(C(F)F)cc1 ZINC000461362033 331312581 /nfs/dbraw/zinc/31/25/81/331312581.db2.gz OQXSXRGNDXUWAG-LBPRGKRZSA-N 1 1 287.419 4.588 20 0 CJADMO C[C@H](c1ccco1)[N@@H+](Cc1ccc(C(F)F)cc1)C1CC1 ZINC000461369019 331312584 /nfs/dbraw/zinc/31/25/84/331312584.db2.gz HMBDBMWQFXFJRF-GFCCVEGCSA-N 1 1 291.341 4.943 20 0 CJADMO C[C@@H](c1ccco1)[N@@H+](Cc1ccc(C(F)F)cc1)C1CC1 ZINC000461369021 331312613 /nfs/dbraw/zinc/31/26/13/331312613.db2.gz HMBDBMWQFXFJRF-LBPRGKRZSA-N 1 1 291.341 4.943 20 0 CJADMO CC(C)[N@@H+](Cc1ccc(C(F)F)cc1)C1CCCC1 ZINC000461375850 331312668 /nfs/dbraw/zinc/31/26/68/331312668.db2.gz QNEZJWZRXHXIHZ-UHFFFAOYSA-N 1 1 267.363 4.777 20 0 CJADMO CC[N@@H+](Cc1ccccc1)Cc1ccc(C(F)F)cc1 ZINC000461381272 331312684 /nfs/dbraw/zinc/31/26/84/331312684.db2.gz CJNDIGFVDZTIHO-UHFFFAOYSA-N 1 1 275.342 4.646 20 0 CJADMO CC(C)[N@@H+](Cc1ccco1)Cc1ccc(C(F)F)cc1 ZINC000461384944 331312750 /nfs/dbraw/zinc/31/27/50/331312750.db2.gz IDCGRZJYDRXWFS-UHFFFAOYSA-N 1 1 279.330 4.628 20 0 CJADMO C[C@H](c1ccccc1)[N@@H+](C)Cc1ccc(C(F)F)cc1 ZINC000461386252 331312894 /nfs/dbraw/zinc/31/28/94/331312894.db2.gz JHPVBYMMSNKWDT-CYBMUJFWSA-N 1 1 275.342 4.817 20 0 CJADMO C[C@@H](c1ccccc1)[N@@H+](C)Cc1ccc(C(F)F)cc1 ZINC000461386253 331312790 /nfs/dbraw/zinc/31/27/90/331312790.db2.gz JHPVBYMMSNKWDT-ZDUSSCGKSA-N 1 1 275.342 4.817 20 0 CJADMO C[N@@H+](Cc1ccc(C(F)F)cc1)Cc1ccc(F)c(F)c1 ZINC000461389120 331312767 /nfs/dbraw/zinc/31/27/67/331312767.db2.gz RTWZSVKDOZDLFC-UHFFFAOYSA-N 1 1 297.295 4.534 20 0 CJADMO C[C@H](c1ccc(F)cc1)[N@@H+](C)Cc1ccc(C(F)F)cc1 ZINC000461389829 331312845 /nfs/dbraw/zinc/31/28/45/331312845.db2.gz PXBNYSGJMCKIOS-GFCCVEGCSA-N 1 1 293.332 4.956 20 0 CJADMO C[C@@H](c1ccc(F)cc1)[N@@H+](C)Cc1ccc(C(F)F)cc1 ZINC000461389830 331312593 /nfs/dbraw/zinc/31/25/93/331312593.db2.gz PXBNYSGJMCKIOS-LBPRGKRZSA-N 1 1 293.332 4.956 20 0 CJADMO CC[N@@H+](Cc1cccs1)Cc1ccc(C(F)F)cc1 ZINC000461392521 331312878 /nfs/dbraw/zinc/31/28/78/331312878.db2.gz WLNLPMVRANUFGN-UHFFFAOYSA-N 1 1 281.371 4.708 20 0 CJADMO FC(F)c1ccc(C[N@H+]2CC[C@H](c3ccccc3)C2)cc1 ZINC000461392917 331312852 /nfs/dbraw/zinc/31/28/52/331312852.db2.gz XHHRIOHMMYGWRY-KRWDZBQOSA-N 1 1 287.353 4.614 20 0 CJADMO FC(F)c1ccc(C[N@H+]2CC[C@@H](c3ccccc3)C2)cc1 ZINC000461392918 331312850 /nfs/dbraw/zinc/31/28/50/331312850.db2.gz XHHRIOHMMYGWRY-QGZVFWFLSA-N 1 1 287.353 4.614 20 0 CJADMO C[N@@H+](Cc1ccc(C(F)F)cc1)[C@H]1CCc2ccccc21 ZINC000461394141 331312887 /nfs/dbraw/zinc/31/28/87/331312887.db2.gz GTBXRBOOVQLVAX-KRWDZBQOSA-N 1 1 287.353 4.744 20 0 CJADMO C[N@@H+](Cc1ccc(C(F)F)cc1)[C@@H]1CCc2ccccc21 ZINC000461394142 331312897 /nfs/dbraw/zinc/31/28/97/331312897.db2.gz GTBXRBOOVQLVAX-QGZVFWFLSA-N 1 1 287.353 4.744 20 0 CJADMO CCS[C@H]1CC[C@@H]([N@@H+](C)Cc2ccc(C(F)F)cc2)C1 ZINC000461395620 331312848 /nfs/dbraw/zinc/31/28/48/331312848.db2.gz HELWBSGVFRNQBU-CABCVRRESA-N 1 1 299.430 4.730 20 0 CJADMO CCS[C@H]1CC[C@H]([N@@H+](C)Cc2ccc(C(F)F)cc2)C1 ZINC000461395621 331312821 /nfs/dbraw/zinc/31/28/21/331312821.db2.gz HELWBSGVFRNQBU-GJZGRUSLSA-N 1 1 299.430 4.730 20 0 CJADMO CCS[C@@H]1CC[C@@H]([N@@H+](C)Cc2ccc(C(F)F)cc2)C1 ZINC000461395622 331312756 /nfs/dbraw/zinc/31/27/56/331312756.db2.gz HELWBSGVFRNQBU-HUUCEWRRSA-N 1 1 299.430 4.730 20 0 CJADMO CCS[C@@H]1CC[C@H]([N@@H+](C)Cc2ccc(C(F)F)cc2)C1 ZINC000461395623 331312774 /nfs/dbraw/zinc/31/27/74/331312774.db2.gz HELWBSGVFRNQBU-LSDHHAIUSA-N 1 1 299.430 4.730 20 0 CJADMO FC(F)c1ccc(C[N@H+]2CC[C@H]2c2ccccc2)cc1 ZINC000461397248 331312708 /nfs/dbraw/zinc/31/27/08/331312708.db2.gz TZAOESMYVRNNIF-INIZCTEOSA-N 1 1 273.326 4.571 20 0 CJADMO FC(F)c1ccc(C[N@H+]2CC[C@@H]2c2ccccc2)cc1 ZINC000461397249 331312785 /nfs/dbraw/zinc/31/27/85/331312785.db2.gz TZAOESMYVRNNIF-MRXNPFEDSA-N 1 1 273.326 4.571 20 0 CJADMO C[C@H](c1ccccc1F)[N@@H+](C)Cc1ccc(C(F)F)cc1 ZINC000461398486 331312991 /nfs/dbraw/zinc/31/29/91/331312991.db2.gz ZPACSQKCPKZELM-GFCCVEGCSA-N 1 1 293.332 4.956 20 0 CJADMO C[C@@H](c1ccccc1F)[N@@H+](C)Cc1ccc(C(F)F)cc1 ZINC000461398487 331312971 /nfs/dbraw/zinc/31/29/71/331312971.db2.gz ZPACSQKCPKZELM-LBPRGKRZSA-N 1 1 293.332 4.956 20 0 CJADMO CC[N@@H+](CCc1cccs1)Cc1ccc(C(F)F)cc1 ZINC000461400514 331313034 /nfs/dbraw/zinc/31/30/34/331313034.db2.gz WLXROYHLYGQAHV-UHFFFAOYSA-N 1 1 295.398 4.750 20 0 CJADMO CN(Cc1ccc(Cl)s1)c1cc[nH+]c2ccsc21 ZINC000462116245 331317531 /nfs/dbraw/zinc/31/75/31/331317531.db2.gz MDIZWPHBZZEIIV-UHFFFAOYSA-N 1 1 294.832 4.648 20 0 CJADMO Clc1cccc(CNc2cc[nH+]c3ccsc32)c1 ZINC000462116375 331317542 /nfs/dbraw/zinc/31/75/42/331317542.db2.gz HZKJRUAJJYZJOE-UHFFFAOYSA-N 1 1 274.776 4.562 20 0 CJADMO c1csc([C@H]2CCCN2c2cc[nH+]c3ccsc32)c1 ZINC000462117138 331317579 /nfs/dbraw/zinc/31/75/79/331317579.db2.gz RPHAOZBYDSOTNE-GFCCVEGCSA-N 1 1 286.425 4.699 20 0 CJADMO c1csc([C@@H]2CCCN2c2cc[nH+]c3ccsc32)c1 ZINC000462117139 331317513 /nfs/dbraw/zinc/31/75/13/331317513.db2.gz RPHAOZBYDSOTNE-LBPRGKRZSA-N 1 1 286.425 4.699 20 0 CJADMO Clc1ccc(CNc2cc[nH+]c3ccsc32)cc1 ZINC000462122603 331317743 /nfs/dbraw/zinc/31/77/43/331317743.db2.gz UPAUKQZHRRGETD-UHFFFAOYSA-N 1 1 274.776 4.562 20 0 CJADMO Clc1ccc(CNc2cc[nH+]c3ccsc32)s1 ZINC000462366967 331320525 /nfs/dbraw/zinc/32/05/25/331320525.db2.gz AKEXHVQABMSDOE-UHFFFAOYSA-N 1 1 280.805 4.623 20 0 CJADMO Fc1cccc(Cl)c1CNc1cc[nH+]c2ccsc21 ZINC000462386366 331321193 /nfs/dbraw/zinc/32/11/93/331321193.db2.gz AGJVFVXKJJUPMZ-UHFFFAOYSA-N 1 1 292.766 4.701 20 0 CJADMO FC(F)c1ccc(CNc2cc[nH+]c3ccsc32)cc1 ZINC000462707670 331325537 /nfs/dbraw/zinc/32/55/37/331325537.db2.gz QGDQKBXYIVDFHX-UHFFFAOYSA-N 1 1 290.338 4.846 20 0 CJADMO Cc1ccc(CNc2cc[nH+]c3ccsc32)c(C)c1 ZINC000462777623 331328521 /nfs/dbraw/zinc/32/85/21/331328521.db2.gz NJBHNHBVNNZPTK-UHFFFAOYSA-N 1 1 268.385 4.525 20 0 CJADMO CCCOc1ccc(CNc2cc[nH+]c3ccsc32)cc1 ZINC000462785084 331328929 /nfs/dbraw/zinc/32/89/29/331328929.db2.gz JWGAYBDIBPRPDY-UHFFFAOYSA-N 1 1 298.411 4.697 20 0 CJADMO Cc1ccc(C[N@H+](C)[C@H](c2ccccc2C)C(C)C)cn1 ZINC000462785292 331328954 /nfs/dbraw/zinc/32/89/54/331328954.db2.gz LVKQSMGBTYNQLZ-IBGZPJMESA-N 1 1 282.431 4.528 20 0 CJADMO Cc1ccc(C[N@H+](C)[C@@H](c2ccccc2C)C(C)C)cn1 ZINC000462785293 331328936 /nfs/dbraw/zinc/32/89/36/331328936.db2.gz LVKQSMGBTYNQLZ-LJQANCHMSA-N 1 1 282.431 4.528 20 0 CJADMO CC(C)Oc1ccccc1CNc1cc[nH+]c2ccsc21 ZINC000462785729 331328939 /nfs/dbraw/zinc/32/89/39/331328939.db2.gz RAWWRCMBSFVPFX-UHFFFAOYSA-N 1 1 298.411 4.696 20 0 CJADMO CCc1ccc(CNc2cc[nH+]c3ccsc32)s1 ZINC000462794512 331329499 /nfs/dbraw/zinc/32/94/99/331329499.db2.gz WCZPDHOXIQUJPP-UHFFFAOYSA-N 1 1 274.414 4.532 20 0 CJADMO Fc1ccc(CNc2cc[nH+]c3ccsc32)cc1Cl ZINC000462795140 331329521 /nfs/dbraw/zinc/32/95/21/331329521.db2.gz NXYQDHMSWOLAJT-UHFFFAOYSA-N 1 1 292.766 4.701 20 0 CJADMO Cc1nc([C@H](C)[NH2+][C@H](C)c2cc(C)c(F)c(C)c2)cs1 ZINC000462808878 331330168 /nfs/dbraw/zinc/33/01/68/331330168.db2.gz PWYYWTSNJGRNPX-NEPJUHHUSA-N 1 1 292.423 4.619 20 0 CJADMO Cc1nc([C@@H](C)[NH2+][C@@H](C)c2cc(C)c(F)c(C)c2)cs1 ZINC000462808879 331330188 /nfs/dbraw/zinc/33/01/88/331330188.db2.gz PWYYWTSNJGRNPX-NWDGAFQWSA-N 1 1 292.423 4.619 20 0 CJADMO Cc1nc([C@H](C)[NH2+][C@@H](C)c2cc(C)c(F)c(C)c2)cs1 ZINC000462808880 331330158 /nfs/dbraw/zinc/33/01/58/331330158.db2.gz PWYYWTSNJGRNPX-RYUDHWBXSA-N 1 1 292.423 4.619 20 0 CJADMO Cc1nc([C@@H](C)[NH2+][C@H](C)c2cc(C)c(F)c(C)c2)cs1 ZINC000462808881 331330123 /nfs/dbraw/zinc/33/01/23/331330123.db2.gz PWYYWTSNJGRNPX-VXGBXAGGSA-N 1 1 292.423 4.619 20 0 CJADMO FC(F)(F)[C@@H](Nc1cc(C2CC2)cc[nH+]1)c1ccccc1 ZINC000462813428 331330540 /nfs/dbraw/zinc/33/05/40/331330540.db2.gz RSONJPYCGCNPEQ-HNNXBMFYSA-N 1 1 292.304 4.675 20 0 CJADMO FC(F)(F)[C@H](Nc1cc(C2CC2)cc[nH+]1)c1ccccc1 ZINC000462813429 331330497 /nfs/dbraw/zinc/33/04/97/331330497.db2.gz RSONJPYCGCNPEQ-OAHLLOKOSA-N 1 1 292.304 4.675 20 0 CJADMO Cc1ccccc1[C@H]1CCN(c2cc[nH+]c3ccsc32)C1 ZINC000462819520 331331004 /nfs/dbraw/zinc/33/10/04/331331004.db2.gz UEIWXECTKPRCNA-AWEZNQCLSA-N 1 1 294.423 4.599 20 0 CJADMO Cc1ccccc1[C@@H]1CCN(c2cc[nH+]c3ccsc32)C1 ZINC000462819521 331331031 /nfs/dbraw/zinc/33/10/31/331331031.db2.gz UEIWXECTKPRCNA-CQSZACIVSA-N 1 1 294.423 4.599 20 0 CJADMO CC[N@@H+](Cc1cnc(-c2ccsc2)s1)CC(C)(C)C ZINC000462829380 331331731 /nfs/dbraw/zinc/33/17/31/331331731.db2.gz CJVHUQZKZQPHMZ-UHFFFAOYSA-N 1 1 294.489 4.740 20 0 CJADMO CC[N@@H+](Cc1csc(-c2ccsc2)n1)CC(C)(C)C ZINC000462829731 331331864 /nfs/dbraw/zinc/33/18/64/331331864.db2.gz LLIHJCPMHBBEJY-UHFFFAOYSA-N 1 1 294.489 4.740 20 0 CJADMO c1cc2[nH+]ccc(N3CCC[C@@]4(CC=CCC4)C3)c2s1 ZINC000462832364 331332018 /nfs/dbraw/zinc/33/20/18/331332018.db2.gz GBGRLQOEZSXWLD-KRWDZBQOSA-N 1 1 284.428 4.623 20 0 CJADMO c1cc2[nH+]ccc(N3CCC[C@]4(CC=CCC4)C3)c2s1 ZINC000462832365 331332039 /nfs/dbraw/zinc/33/20/39/331332039.db2.gz GBGRLQOEZSXWLD-QGZVFWFLSA-N 1 1 284.428 4.623 20 0 CJADMO C[C@H]1C[C@@H](c2ccccc2)CN1c1cc[nH+]c2ccsc21 ZINC000462848010 331332526 /nfs/dbraw/zinc/33/25/26/331332526.db2.gz LAZQPOVCTWOLOV-DZGCQCFKSA-N 1 1 294.423 4.679 20 0 CJADMO C[C@@H]1C[C@H](c2ccccc2)CN1c1cc[nH+]c2ccsc21 ZINC000462848011 331332607 /nfs/dbraw/zinc/33/26/07/331332607.db2.gz LAZQPOVCTWOLOV-HIFRSBDPSA-N 1 1 294.423 4.679 20 0 CJADMO C[C@@H]1C[C@@H](c2ccccc2)CN1c1cc[nH+]c2ccsc21 ZINC000462848012 331332605 /nfs/dbraw/zinc/33/26/05/331332605.db2.gz LAZQPOVCTWOLOV-UKRRQHHQSA-N 1 1 294.423 4.679 20 0 CJADMO C[C@H]1C[C@H](c2ccccc2)CN1c1cc[nH+]c2ccsc21 ZINC000462848013 331332591 /nfs/dbraw/zinc/33/25/91/331332591.db2.gz LAZQPOVCTWOLOV-ZFWWWQNUSA-N 1 1 294.423 4.679 20 0 CJADMO CC(C)(C)C[C@H](Nc1[nH+]cnc2[nH]ccc21)c1ccccc1 ZINC000462865302 331333231 /nfs/dbraw/zinc/33/32/31/331333231.db2.gz XSEHFHYMMKYWMO-HNNXBMFYSA-N 1 1 294.402 4.547 20 0 CJADMO CC(C)(C)C[C@@H](Nc1[nH+]cnc2[nH]ccc21)c1ccccc1 ZINC000462865303 331333189 /nfs/dbraw/zinc/33/31/89/331333189.db2.gz XSEHFHYMMKYWMO-OAHLLOKOSA-N 1 1 294.402 4.547 20 0 CJADMO CCCc1ccc([C@@H](C)[NH2+][C@H](C)c2csc(C)n2)cc1 ZINC000462899114 331334351 /nfs/dbraw/zinc/33/43/51/331334351.db2.gz WYGNTTBGMBHVLH-CHWSQXEVSA-N 1 1 288.460 4.816 20 0 CJADMO CCCc1ccc([C@@H](C)[NH2+][C@@H](C)c2csc(C)n2)cc1 ZINC000462899115 331334316 /nfs/dbraw/zinc/33/43/16/331334316.db2.gz WYGNTTBGMBHVLH-OLZOCXBDSA-N 1 1 288.460 4.816 20 0 CJADMO CCCc1ccc([C@H](C)[NH2+][C@H](C)c2csc(C)n2)cc1 ZINC000462899216 331334326 /nfs/dbraw/zinc/33/43/26/331334326.db2.gz WYGNTTBGMBHVLH-QWHCGFSZSA-N 1 1 288.460 4.816 20 0 CJADMO CCCc1ccc([C@H](C)[NH2+][C@@H](C)c2csc(C)n2)cc1 ZINC000462899217 331334306 /nfs/dbraw/zinc/33/43/06/331334306.db2.gz WYGNTTBGMBHVLH-STQMWFEESA-N 1 1 288.460 4.816 20 0 CJADMO COC(C)(C)C[C@@H](C)Nc1cc[nH+]c2cc(Cl)ccc12 ZINC000462904639 331334513 /nfs/dbraw/zinc/33/45/13/331334513.db2.gz XBPIVIPHCXKEIV-LLVKDONJSA-N 1 1 292.810 4.504 20 0 CJADMO COC(C)(C)C[C@H](C)Nc1cc[nH+]c2cc(Cl)ccc12 ZINC000462904640 331334491 /nfs/dbraw/zinc/33/44/91/331334491.db2.gz XBPIVIPHCXKEIV-NSHDSACASA-N 1 1 292.810 4.504 20 0 CJADMO C[C@@H](Nc1cc[nH+]c2ccsc21)c1ccc(Cl)s1 ZINC000462921451 331335178 /nfs/dbraw/zinc/33/51/78/331335178.db2.gz BBXKFAKMODJXBX-MRVPVSSYSA-N 1 1 294.832 4.606 20 0 CJADMO C[C@H](Nc1cc[nH+]c2ccsc21)c1ccc(Cl)s1 ZINC000462921452 331335190 /nfs/dbraw/zinc/33/51/90/331335190.db2.gz BBXKFAKMODJXBX-QMMMGPOBSA-N 1 1 294.832 4.606 20 0 CJADMO c1cc2[nH+]ccc(NCCSc3ccccc3)c2s1 ZINC000462927001 331335259 /nfs/dbraw/zinc/33/52/59/331335259.db2.gz FYNQBGHLCHTYGM-UHFFFAOYSA-N 1 1 286.425 4.501 20 0 CJADMO Cc1ccsc1C[N@H+](C)[C@H]1CCCC[C@H]1C(F)(F)F ZINC000463035453 331337947 /nfs/dbraw/zinc/33/79/47/331337947.db2.gz QJCOGEUALMCSSY-NEPJUHHUSA-N 1 1 291.382 4.609 20 0 CJADMO Cc1ccc(C[N@H+](C)[C@H]2CCCC[C@H]2C(F)(F)F)s1 ZINC000463045651 331338471 /nfs/dbraw/zinc/33/84/71/331338471.db2.gz WSZATRHUHXTQPR-OLZOCXBDSA-N 1 1 291.382 4.609 20 0 CJADMO C[C@@H](c1cccs1)[N@@H+](C)C[C@@H]1C[C@H]1c1ccccc1 ZINC000463075174 331339519 /nfs/dbraw/zinc/33/95/19/331339519.db2.gz YFOIMLFZCQMYSL-BPUTZDHNSA-N 1 1 271.429 4.545 20 0 CJADMO C[C@H](c1cccs1)[N@@H+](C)C[C@@H]1C[C@H]1c1ccccc1 ZINC000463075175 331339506 /nfs/dbraw/zinc/33/95/06/331339506.db2.gz YFOIMLFZCQMYSL-KBMXLJTQSA-N 1 1 271.429 4.545 20 0 CJADMO CCCCC[N@@H+](Cc1cncc(C(F)(F)F)c1)C(C)C ZINC000463080867 331339837 /nfs/dbraw/zinc/33/98/37/331339837.db2.gz ABWUAVBEJVFURA-UHFFFAOYSA-N 1 1 288.357 4.501 20 0 CJADMO COCCCC[N@@H+](Cc1ccccc1)[C@H](C)c1ccccc1 ZINC000463218580 331342566 /nfs/dbraw/zinc/34/25/66/331342566.db2.gz LEBJHIWEUHBPQU-GOSISDBHSA-N 1 1 297.442 4.676 20 0 CJADMO COCCCC[N@@H+](Cc1ccccc1)[C@@H](C)c1ccccc1 ZINC000463218581 331342677 /nfs/dbraw/zinc/34/26/77/331342677.db2.gz LEBJHIWEUHBPQU-SFHVURJKSA-N 1 1 297.442 4.676 20 0 CJADMO C[C@@H](c1ccc(Cl)cc1)[N@@H+](C)CCCC1CCOCC1 ZINC000463287161 331345310 /nfs/dbraw/zinc/34/53/10/331345310.db2.gz IYWYJUFEUXQVAN-AWEZNQCLSA-N 1 1 295.854 4.540 20 0 CJADMO C[C@H](c1ccc(Cl)cc1)[N@@H+](C)CCCC1CCOCC1 ZINC000463287162 331345334 /nfs/dbraw/zinc/34/53/34/331345334.db2.gz IYWYJUFEUXQVAN-CQSZACIVSA-N 1 1 295.854 4.540 20 0 CJADMO C[C@@H](c1cccc(Cl)c1)[N@@H+](C)CCCC1CCOCC1 ZINC000463287240 331345273 /nfs/dbraw/zinc/34/52/73/331345273.db2.gz XIUYZSRGIDJFDK-AWEZNQCLSA-N 1 1 295.854 4.540 20 0 CJADMO C[C@H](c1cccc(Cl)c1)[N@@H+](C)CCCC1CCOCC1 ZINC000463287728 331345342 /nfs/dbraw/zinc/34/53/42/331345342.db2.gz XIUYZSRGIDJFDK-CQSZACIVSA-N 1 1 295.854 4.540 20 0 CJADMO C[C@@H](c1ccccc1Cl)[N@@H+](C)CCCC1CCOCC1 ZINC000463289000 331345330 /nfs/dbraw/zinc/34/53/30/331345330.db2.gz NWORRIFUBAYWKC-AWEZNQCLSA-N 1 1 295.854 4.540 20 0 CJADMO C[C@H](c1ccccc1Cl)[N@@H+](C)CCCC1CCOCC1 ZINC000463289001 331345259 /nfs/dbraw/zinc/34/52/59/331345259.db2.gz NWORRIFUBAYWKC-CQSZACIVSA-N 1 1 295.854 4.540 20 0 CJADMO CC[N@@H+](Cc1nc(-c2ccsc2)oc1C)CC(C)(C)C ZINC000463360768 331346504 /nfs/dbraw/zinc/34/65/04/331346504.db2.gz LXOFEPNCFZAIIU-UHFFFAOYSA-N 1 1 292.448 4.580 20 0 CJADMO CC[N@@H+](Cc1nc(-c2cccs2)oc1C)CC(C)(C)C ZINC000463369418 331346670 /nfs/dbraw/zinc/34/66/70/331346670.db2.gz RRULNODBEQVTEI-UHFFFAOYSA-N 1 1 292.448 4.580 20 0 CJADMO CC[N@@H+](Cc1nc(-c2ccccc2)oc1C)CC(C)(C)C ZINC000463369949 331346729 /nfs/dbraw/zinc/34/67/29/331346729.db2.gz RPVWODKHKXIUCW-UHFFFAOYSA-N 1 1 286.419 4.518 20 0 CJADMO CCC[N@@H+](CCCCC(F)(F)F)CCc1cccs1 ZINC000464570843 331362941 /nfs/dbraw/zinc/36/29/41/331362941.db2.gz NOXQTYGJUAZOBG-UHFFFAOYSA-N 1 1 293.398 4.735 20 0 CJADMO Cc1ccc(-c2cnc(C[N@H+]3CCC[C@H]3C(C)(C)C)o2)cc1 ZINC000464732244 331365606 /nfs/dbraw/zinc/36/56/06/331365606.db2.gz GUFAWZSNQPTTEC-KRWDZBQOSA-N 1 1 298.430 4.661 20 0 CJADMO Cc1ccc(-c2cnc(C[N@H+]3CCC[C@@H]3C(C)(C)C)o2)cc1 ZINC000464732929 331365615 /nfs/dbraw/zinc/36/56/15/331365615.db2.gz GUFAWZSNQPTTEC-QGZVFWFLSA-N 1 1 298.430 4.661 20 0 CJADMO C[C@H](c1ccc(F)c(Cl)c1)[N@@H+](C)CCc1cccs1 ZINC000464759840 331366542 /nfs/dbraw/zinc/36/65/42/331366542.db2.gz ZFQIJJMSBNIUNH-LLVKDONJSA-N 1 1 297.826 4.776 20 0 CJADMO C[C@@H](c1ccc(F)c(Cl)c1)[N@@H+](C)CCc1cccs1 ZINC000464759841 331366507 /nfs/dbraw/zinc/36/65/07/331366507.db2.gz ZFQIJJMSBNIUNH-NSHDSACASA-N 1 1 297.826 4.776 20 0 CJADMO C[C@@H](c1cccnc1)[N@H+]1CCCC2(C1)CCCCCC2 ZINC000464760451 331366574 /nfs/dbraw/zinc/36/65/74/331366574.db2.gz HSPHOKNXQJUGFC-INIZCTEOSA-N 1 1 272.436 4.579 20 0 CJADMO C[C@H](c1cccnc1)[N@H+]1CCCC2(C1)CCCCCC2 ZINC000464760452 261221619 /nfs/dbraw/zinc/22/16/19/261221619.db2.gz HSPHOKNXQJUGFC-MRXNPFEDSA-N 1 1 272.436 4.579 20 0 CJADMO C[C@@H](c1ccc(-c2ccccc2)cc1)[N@@H+](C)CCCCCO ZINC000464760645 331366515 /nfs/dbraw/zinc/36/65/15/331366515.db2.gz ACBCOPWFNCNVQW-KRWDZBQOSA-N 1 1 297.442 4.509 20 0 CJADMO C[C@H](c1ccc(-c2ccccc2)cc1)[N@@H+](C)CCCCCO ZINC000464760646 331366576 /nfs/dbraw/zinc/36/65/76/331366576.db2.gz ACBCOPWFNCNVQW-QGZVFWFLSA-N 1 1 297.442 4.509 20 0 CJADMO C[N@@H+](CCCc1ccc(Cl)cc1)CCc1cccs1 ZINC000464760716 331366588 /nfs/dbraw/zinc/36/65/88/331366588.db2.gz JMSWHPWGVKJUOZ-UHFFFAOYSA-N 1 1 293.863 4.509 20 0 CJADMO C[N@@H+](CCc1cccs1)CCc1ccc2ccccc2c1 ZINC000464761855 331366735 /nfs/dbraw/zinc/36/67/35/331366735.db2.gz RAAMCWCGFYGVOR-UHFFFAOYSA-N 1 1 295.451 4.618 20 0 CJADMO CC[C@@H](c1ccc(F)cc1F)[N@@H+](C)CCc1cccs1 ZINC000464763572 331366825 /nfs/dbraw/zinc/36/68/25/331366825.db2.gz QTWMZQKBCCZEGG-INIZCTEOSA-N 1 1 295.398 4.652 20 0 CJADMO CC[C@H](c1ccc(F)cc1F)[N@@H+](C)CCc1cccs1 ZINC000464763573 331366713 /nfs/dbraw/zinc/36/67/13/331366713.db2.gz QTWMZQKBCCZEGG-MRXNPFEDSA-N 1 1 295.398 4.652 20 0 CJADMO C[C@@H](c1ccccc1)[N@H+]1CC[C@@H](CSc2ccccc2)C1 ZINC000464763945 331366743 /nfs/dbraw/zinc/36/67/43/331366743.db2.gz DPEFIRGVRZQLNV-DLBZAZTESA-N 1 1 297.467 4.862 20 0 CJADMO C[C@H](c1ccccc1)[N@H+]1CC[C@@H](CSc2ccccc2)C1 ZINC000464763955 331366763 /nfs/dbraw/zinc/36/67/63/331366763.db2.gz DPEFIRGVRZQLNV-IAGOWNOFSA-N 1 1 297.467 4.862 20 0 CJADMO C[C@@H](c1ccccc1)[N@H+]1CC[C@H](CSc2ccccc2)C1 ZINC000464763957 331366622 /nfs/dbraw/zinc/36/66/22/331366622.db2.gz DPEFIRGVRZQLNV-IRXDYDNUSA-N 1 1 297.467 4.862 20 0 CJADMO C[C@H](c1ccccc1)[N@H+]1CC[C@H](CSc2ccccc2)C1 ZINC000464763959 331366677 /nfs/dbraw/zinc/36/66/77/331366677.db2.gz DPEFIRGVRZQLNV-SJORKVTESA-N 1 1 297.467 4.862 20 0 CJADMO c1ccc2oc(C[N@H+]3CCCC4(C3)CCCCCC4)nc2c1 ZINC000464765744 331366659 /nfs/dbraw/zinc/36/66/59/331366659.db2.gz PPIKXVQLOSYHOP-UHFFFAOYSA-N 1 1 298.430 4.764 20 0 CJADMO COCCCCC[N@H+]1CCCC[C@H]1c1cccc(C)c1C ZINC000464772645 331367242 /nfs/dbraw/zinc/36/72/42/331367242.db2.gz FLCPTBZNFLBLCZ-IBGZPJMESA-N 1 1 289.463 4.647 20 0 CJADMO COCCCCC[N@H+]1CCCC[C@@H]1c1cccc(C)c1C ZINC000464772646 331367073 /nfs/dbraw/zinc/36/70/73/331367073.db2.gz FLCPTBZNFLBLCZ-LJQANCHMSA-N 1 1 289.463 4.647 20 0 CJADMO Cc1cccc([C@@H]2CCCC[N@@H+]2CCCOC(C)C)c1C ZINC000464776908 331367322 /nfs/dbraw/zinc/36/73/22/331367322.db2.gz LHSKOUOWSAJLAY-IBGZPJMESA-N 1 1 289.463 4.646 20 0 CJADMO Cc1cccc([C@H]2CCCC[N@@H+]2CCCOC(C)C)c1C ZINC000464776915 331367420 /nfs/dbraw/zinc/36/74/20/331367420.db2.gz LHSKOUOWSAJLAY-LJQANCHMSA-N 1 1 289.463 4.646 20 0 CJADMO CC[C@@]1(C)CCC[N@H+]([C@H](C)c2ncc(-c3ccccc3)o2)C1 ZINC000464778434 331367633 /nfs/dbraw/zinc/36/76/33/331367633.db2.gz OJUAKNHQMPGTTM-BEFAXECRSA-N 1 1 298.430 4.915 20 0 CJADMO CC[C@]1(C)CCC[N@H+]([C@H](C)c2ncc(-c3ccccc3)o2)C1 ZINC000464778436 331367742 /nfs/dbraw/zinc/36/77/42/331367742.db2.gz OJUAKNHQMPGTTM-DNVCBOLYSA-N 1 1 298.430 4.915 20 0 CJADMO CC[C@]1(C)CCC[N@H+]([C@@H](C)c2ncc(-c3ccccc3)o2)C1 ZINC000464778438 331367649 /nfs/dbraw/zinc/36/76/49/331367649.db2.gz OJUAKNHQMPGTTM-HNAYVOBHSA-N 1 1 298.430 4.915 20 0 CJADMO CC[C@@]1(C)CCC[N@H+]([C@@H](C)c2ncc(-c3ccccc3)o2)C1 ZINC000464778440 331367735 /nfs/dbraw/zinc/36/77/35/331367735.db2.gz OJUAKNHQMPGTTM-KXBFYZLASA-N 1 1 298.430 4.915 20 0 CJADMO C[C@@H](c1ccc(-c2ccccc2)cc1)[N@@H+](C)C[C@@H]1CCCO1 ZINC000464779643 331367965 /nfs/dbraw/zinc/36/79/65/331367965.db2.gz YLJFQFISCCZSMU-JXFKEZNVSA-N 1 1 295.426 4.525 20 0 CJADMO C[C@@H](c1ccc(-c2ccccc2)cc1)[N@@H+](C)C[C@H]1CCCO1 ZINC000464779646 331367919 /nfs/dbraw/zinc/36/79/19/331367919.db2.gz YLJFQFISCCZSMU-OXJNMPFZSA-N 1 1 295.426 4.525 20 0 CJADMO C[C@H](c1ccc(-c2ccccc2)cc1)[N@@H+](C)C[C@H]1CCCO1 ZINC000464779648 331367782 /nfs/dbraw/zinc/36/77/82/331367782.db2.gz YLJFQFISCCZSMU-OXQOHEQNSA-N 1 1 295.426 4.525 20 0 CJADMO C[C@H](c1ccc(-c2ccccc2)cc1)[N@@H+](C)C[C@@H]1CCCO1 ZINC000464779650 331367866 /nfs/dbraw/zinc/36/78/66/331367866.db2.gz YLJFQFISCCZSMU-UZLBHIALSA-N 1 1 295.426 4.525 20 0 CJADMO CC[C@@]1(C)CCC[N@@H+](Cc2nc(-c3ccccc3)oc2C)C1 ZINC000464780967 331367942 /nfs/dbraw/zinc/36/79/42/331367942.db2.gz UUJAWCWHLUCXCE-IBGZPJMESA-N 1 1 298.430 4.662 20 0 CJADMO CC[C@]1(C)CCC[N@@H+](Cc2nc(-c3ccccc3)oc2C)C1 ZINC000464780968 331367984 /nfs/dbraw/zinc/36/79/84/331367984.db2.gz UUJAWCWHLUCXCE-LJQANCHMSA-N 1 1 298.430 4.662 20 0 CJADMO C[C@@H]1CC[C@@H](C)[N@@H+](Cc2c(Cl)ccc3cccnc32)C1 ZINC000464817505 331369520 /nfs/dbraw/zinc/36/95/20/331369520.db2.gz XKXJOWGTNBQBGF-CHWSQXEVSA-N 1 1 288.822 4.509 20 0 CJADMO C[C@@H]1CC[C@H](C)[N@@H+](Cc2c(Cl)ccc3cccnc32)C1 ZINC000464817506 331369575 /nfs/dbraw/zinc/36/95/75/331369575.db2.gz XKXJOWGTNBQBGF-OLZOCXBDSA-N 1 1 288.822 4.509 20 0 CJADMO C[C@@H]1CC[C@H](C)C[N@@H+]1Cc1c(Cl)ccc2cccnc21 ZINC000464817507 331369496 /nfs/dbraw/zinc/36/94/96/331369496.db2.gz XKXJOWGTNBQBGF-QWHCGFSZSA-N 1 1 288.822 4.509 20 0 CJADMO C[C@H]1CC[C@H](C)[N@@H+](Cc2c(Cl)ccc3cccnc32)C1 ZINC000464817508 331369493 /nfs/dbraw/zinc/36/94/93/331369493.db2.gz XKXJOWGTNBQBGF-STQMWFEESA-N 1 1 288.822 4.509 20 0 CJADMO C[C@@H]1CC[C@@H](C)[N@@H+](Cc2cc(Cl)cc3cccnc32)C1 ZINC000464822712 331369816 /nfs/dbraw/zinc/36/98/16/331369816.db2.gz NTLPKPWMWAEWSS-CHWSQXEVSA-N 1 1 288.822 4.509 20 0 CJADMO C[C@@H]1CC[C@H](C)[N@@H+](Cc2cc(Cl)cc3cccnc32)C1 ZINC000464822713 331369633 /nfs/dbraw/zinc/36/96/33/331369633.db2.gz NTLPKPWMWAEWSS-OLZOCXBDSA-N 1 1 288.822 4.509 20 0 CJADMO C[C@@H]1CC[C@H](C)C[N@@H+]1Cc1cc(Cl)cc2cccnc21 ZINC000464822714 331369504 /nfs/dbraw/zinc/36/95/04/331369504.db2.gz NTLPKPWMWAEWSS-QWHCGFSZSA-N 1 1 288.822 4.509 20 0 CJADMO C[C@H]1CC[C@H](C)[N@@H+](Cc2cc(Cl)cc3cccnc32)C1 ZINC000464822715 331369846 /nfs/dbraw/zinc/36/98/46/331369846.db2.gz NTLPKPWMWAEWSS-STQMWFEESA-N 1 1 288.822 4.509 20 0 CJADMO C[C@@H]1CC[C@@H](C)[N@@H+](Cc2ccc(Cl)c3cccnc23)C1 ZINC000464824891 331369736 /nfs/dbraw/zinc/36/97/36/331369736.db2.gz WPEQMZWAQMDZTE-CHWSQXEVSA-N 1 1 288.822 4.509 20 0 CJADMO C[C@@H]1CC[C@H](C)[N@@H+](Cc2ccc(Cl)c3cccnc23)C1 ZINC000464824893 331369752 /nfs/dbraw/zinc/36/97/52/331369752.db2.gz WPEQMZWAQMDZTE-OLZOCXBDSA-N 1 1 288.822 4.509 20 0 CJADMO C[C@@H]1CC[C@H](C)C[N@@H+]1Cc1ccc(Cl)c2cccnc12 ZINC000464824894 331369722 /nfs/dbraw/zinc/36/97/22/331369722.db2.gz WPEQMZWAQMDZTE-QWHCGFSZSA-N 1 1 288.822 4.509 20 0 CJADMO C[C@H]1CC[C@H](C)[N@@H+](Cc2ccc(Cl)c3cccnc23)C1 ZINC000464824895 331369849 /nfs/dbraw/zinc/36/98/49/331369849.db2.gz WPEQMZWAQMDZTE-STQMWFEESA-N 1 1 288.822 4.509 20 0 CJADMO C[C@H]1CC[N@@H+](Cc2ccc(F)c(F)c2)[C@@H](c2ccco2)C1 ZINC000464850446 331371230 /nfs/dbraw/zinc/37/12/30/331371230.db2.gz DTKAZLJNTYOYQV-BLLLJJGKSA-N 1 1 291.341 4.531 20 0 CJADMO C[C@H]1CC[N@H+](Cc2ccc(F)c(F)c2)[C@@H](c2ccco2)C1 ZINC000464850446 331371229 /nfs/dbraw/zinc/37/12/29/331371229.db2.gz DTKAZLJNTYOYQV-BLLLJJGKSA-N 1 1 291.341 4.531 20 0 CJADMO C[C@H]1CC[N@@H+](Cc2ccc(F)c(F)c2)[C@H](c2ccco2)C1 ZINC000464850447 331371070 /nfs/dbraw/zinc/37/10/70/331371070.db2.gz DTKAZLJNTYOYQV-LRDDRELGSA-N 1 1 291.341 4.531 20 0 CJADMO C[C@H]1CC[N@H+](Cc2ccc(F)c(F)c2)[C@H](c2ccco2)C1 ZINC000464850447 331371069 /nfs/dbraw/zinc/37/10/69/331371069.db2.gz DTKAZLJNTYOYQV-LRDDRELGSA-N 1 1 291.341 4.531 20 0 CJADMO C[C@@H]1CC[N@@H+](Cc2ccc(F)c(F)c2)[C@@H](c2ccco2)C1 ZINC000464850448 331371087 /nfs/dbraw/zinc/37/10/87/331371087.db2.gz DTKAZLJNTYOYQV-MLGOLLRUSA-N 1 1 291.341 4.531 20 0 CJADMO C[C@@H]1CC[N@H+](Cc2ccc(F)c(F)c2)[C@@H](c2ccco2)C1 ZINC000464850448 331371086 /nfs/dbraw/zinc/37/10/86/331371086.db2.gz DTKAZLJNTYOYQV-MLGOLLRUSA-N 1 1 291.341 4.531 20 0 CJADMO C[C@@H]1CC[N@@H+](Cc2ccc(F)c(F)c2)[C@H](c2ccco2)C1 ZINC000464850449 331371064 /nfs/dbraw/zinc/37/10/64/331371064.db2.gz DTKAZLJNTYOYQV-WBMJQRKESA-N 1 1 291.341 4.531 20 0 CJADMO C[C@@H]1CC[N@H+](Cc2ccc(F)c(F)c2)[C@H](c2ccco2)C1 ZINC000464850449 331371063 /nfs/dbraw/zinc/37/10/63/331371063.db2.gz DTKAZLJNTYOYQV-WBMJQRKESA-N 1 1 291.341 4.531 20 0 CJADMO C[C@@H]1CC[N@@H+](Cc2cccc(F)c2F)[C@H](c2ccco2)C1 ZINC000464857601 331371393 /nfs/dbraw/zinc/37/13/93/331371393.db2.gz UKWIEILTNJBHJT-DOMZBBRYSA-N 1 1 291.341 4.531 20 0 CJADMO C[C@@H]1CC[N@H+](Cc2cccc(F)c2F)[C@H](c2ccco2)C1 ZINC000464857601 331371392 /nfs/dbraw/zinc/37/13/92/331371392.db2.gz UKWIEILTNJBHJT-DOMZBBRYSA-N 1 1 291.341 4.531 20 0 CJADMO C[C@@H]1CC[N@@H+](Cc2cccc(F)c2F)[C@@H](c2ccco2)C1 ZINC000464857603 331371516 /nfs/dbraw/zinc/37/15/16/331371516.db2.gz UKWIEILTNJBHJT-IUODEOHRSA-N 1 1 291.341 4.531 20 0 CJADMO C[C@@H]1CC[N@H+](Cc2cccc(F)c2F)[C@@H](c2ccco2)C1 ZINC000464857603 331371515 /nfs/dbraw/zinc/37/15/15/331371515.db2.gz UKWIEILTNJBHJT-IUODEOHRSA-N 1 1 291.341 4.531 20 0 CJADMO C[C@H]1CC[N@@H+](Cc2cccc(F)c2F)[C@@H](c2ccco2)C1 ZINC000464857604 331371402 /nfs/dbraw/zinc/37/14/02/331371402.db2.gz UKWIEILTNJBHJT-SWLSCSKDSA-N 1 1 291.341 4.531 20 0 CJADMO C[C@H]1CC[N@H+](Cc2cccc(F)c2F)[C@@H](c2ccco2)C1 ZINC000464857604 331371401 /nfs/dbraw/zinc/37/14/01/331371401.db2.gz UKWIEILTNJBHJT-SWLSCSKDSA-N 1 1 291.341 4.531 20 0 CJADMO C[C@H]1CC[N@@H+](Cc2cccc(F)c2F)[C@H](c2ccco2)C1 ZINC000464857605 331371451 /nfs/dbraw/zinc/37/14/51/331371451.db2.gz UKWIEILTNJBHJT-WFASDCNBSA-N 1 1 291.341 4.531 20 0 CJADMO C[C@H]1CC[N@H+](Cc2cccc(F)c2F)[C@H](c2ccco2)C1 ZINC000464857605 331371450 /nfs/dbraw/zinc/37/14/50/331371450.db2.gz UKWIEILTNJBHJT-WFASDCNBSA-N 1 1 291.341 4.531 20 0 CJADMO CC/C=C/CC[N@H+]1CCCC[C@H]1c1nc2ccccc2o1 ZINC000466221362 331391237 /nfs/dbraw/zinc/39/12/37/331391237.db2.gz WKRQJUXKKVRKKH-CWDCEQMOSA-N 1 1 284.403 4.711 20 0 CJADMO CC/C=C\CC[N@H+]1CCCC[C@@H]1c1nc2ccccc2o1 ZINC000466221363 331391108 /nfs/dbraw/zinc/39/11/08/331391108.db2.gz WKRQJUXKKVRKKH-MJSXRHKHSA-N 1 1 284.403 4.711 20 0 CJADMO CC/C=C/CC[N@H+]1CCCC[C@@H]1c1nc2ccccc2o1 ZINC000466221364 331391171 /nfs/dbraw/zinc/39/11/71/331391171.db2.gz WKRQJUXKKVRKKH-QDLOVBKTSA-N 1 1 284.403 4.711 20 0 CJADMO CC/C=C\CC[N@H+]1CCCC[C@H]1c1nc2ccccc2o1 ZINC000466221365 331391188 /nfs/dbraw/zinc/39/11/88/331391188.db2.gz WKRQJUXKKVRKKH-QGZUEGPWSA-N 1 1 284.403 4.711 20 0 CJADMO COc1cc(C)ccc1C[NH2+][C@H](C)c1ccccc1Cl ZINC000466321467 331392780 /nfs/dbraw/zinc/39/27/80/331392780.db2.gz XGFVHRXZDLYZOM-CYBMUJFWSA-N 1 1 289.806 4.508 20 0 CJADMO COc1cc(C)ccc1C[NH2+][C@@H](C)c1ccccc1Cl ZINC000466321468 331392862 /nfs/dbraw/zinc/39/28/62/331392862.db2.gz XGFVHRXZDLYZOM-ZDUSSCGKSA-N 1 1 289.806 4.508 20 0 CJADMO CCC[C@H]1CCC[N@H+]([C@@H](C)c2ncc(C(C)(C)C)o2)C1 ZINC000466462407 331397708 /nfs/dbraw/zinc/39/77/08/331397708.db2.gz GUWWHYAQLLHROM-KBPBESRZSA-N 1 1 278.440 4.545 20 0 CJADMO CCC[C@H]1CCC[N@H+]([C@H](C)c2ncc(C(C)(C)C)o2)C1 ZINC000466462408 331397688 /nfs/dbraw/zinc/39/76/88/331397688.db2.gz GUWWHYAQLLHROM-KGLIPLIRSA-N 1 1 278.440 4.545 20 0 CJADMO CCC[C@@H]1CCC[N@H+]([C@@H](C)c2ncc(C(C)(C)C)o2)C1 ZINC000466462409 331397637 /nfs/dbraw/zinc/39/76/37/331397637.db2.gz GUWWHYAQLLHROM-UONOGXRCSA-N 1 1 278.440 4.545 20 0 CJADMO CCC[C@@H]1CCC[N@H+]([C@H](C)c2ncc(C(C)(C)C)o2)C1 ZINC000466462410 331397718 /nfs/dbraw/zinc/39/77/18/331397718.db2.gz GUWWHYAQLLHROM-ZIAGYGMSSA-N 1 1 278.440 4.545 20 0 CJADMO CC[C@@H](c1ccc(Cl)cc1)[N@@H+](C)CCC1CCOCC1 ZINC000466466717 331397772 /nfs/dbraw/zinc/39/77/72/331397772.db2.gz REJCKNFQWHSFCZ-KRWDZBQOSA-N 1 1 295.854 4.540 20 0 CJADMO CC[C@H](c1ccc(Cl)cc1)[N@@H+](C)CCC1CCOCC1 ZINC000466466718 331397654 /nfs/dbraw/zinc/39/76/54/331397654.db2.gz REJCKNFQWHSFCZ-QGZVFWFLSA-N 1 1 295.854 4.540 20 0 CJADMO C[C@@H](c1ccc2ccccc2c1)[N@@H+](C)CCC1CCOCC1 ZINC000466487827 331398385 /nfs/dbraw/zinc/39/83/85/331398385.db2.gz FSMWAMNUEXNZKN-INIZCTEOSA-N 1 1 297.442 4.649 20 0 CJADMO C[C@H](c1ccc2ccccc2c1)[N@@H+](C)CCC1CCOCC1 ZINC000466487828 331398322 /nfs/dbraw/zinc/39/83/22/331398322.db2.gz FSMWAMNUEXNZKN-MRXNPFEDSA-N 1 1 297.442 4.649 20 0 CJADMO CCCCOc1ccccc1C[N@H+]1CCC[C@H]1c1ccc[nH]1 ZINC000468397450 264345975 /nfs/dbraw/zinc/34/59/75/264345975.db2.gz MJLQBAGVQDVRJR-SFHVURJKSA-N 1 1 298.430 4.531 20 0 CJADMO CC[N@@H+](Cc1ccc(F)cn1)[C@@H](C)c1cc2ccccc2o1 ZINC000469114129 329173196 /nfs/dbraw/zinc/17/31/96/329173196.db2.gz ZEUIUKXXESKIKC-ZDUSSCGKSA-N 1 1 298.361 4.550 20 0 CJADMO Cc1cc[nH+]c(N[C@H](C)c2cc3ccccc3s2)c1 ZINC000470517893 331484713 /nfs/dbraw/zinc/48/47/13/331484713.db2.gz CTVDBTZVVPFTLD-GFCCVEGCSA-N 1 1 268.385 4.778 20 0 CJADMO Cc1cc[nH+]c(N[C@@H](C)c2cc3ccccc3s2)c1 ZINC000470517894 331484849 /nfs/dbraw/zinc/48/48/49/331484849.db2.gz CTVDBTZVVPFTLD-LBPRGKRZSA-N 1 1 268.385 4.778 20 0 CJADMO Cc1ccccc1[C@H]([NH2+]Cc1ncc(Cl)s1)C(C)C ZINC000472058092 331527886 /nfs/dbraw/zinc/52/78/86/331527886.db2.gz DGRKLOIDBIJLIO-OAHLLOKOSA-N 1 1 294.851 4.592 20 0 CJADMO C[C@@H]([NH2+]Cc1ccc(Cl)o1)c1cc2cccc(F)c2o1 ZINC000473996940 331562150 /nfs/dbraw/zinc/56/21/50/331562150.db2.gz SETOHBYDFZZVLU-SECBINFHSA-N 1 1 293.725 4.669 20 0 CJADMO C[C@H]([NH2+]Cc1ccc(Cl)o1)c1cc2cccc(F)c2o1 ZINC000473996941 331562189 /nfs/dbraw/zinc/56/21/89/331562189.db2.gz SETOHBYDFZZVLU-VIFPVBQESA-N 1 1 293.725 4.669 20 0 CJADMO C[C@@H]([NH2+][C@H](C)c1cc2cccc(F)c2o1)c1ccco1 ZINC000474104763 331570743 /nfs/dbraw/zinc/57/07/43/331570743.db2.gz JVZNSGYVKYXWMI-GHMZBOCLSA-N 1 1 273.307 4.577 20 0 CJADMO C[C@H]([NH2+][C@@H](C)c1cc2cccc(F)c2o1)c1ccco1 ZINC000474104766 331570912 /nfs/dbraw/zinc/57/09/12/331570912.db2.gz JVZNSGYVKYXWMI-QWRGUYRKSA-N 1 1 273.307 4.577 20 0 CJADMO CC(C)Sc1cccc(Cl)c1C[NH2+]Cc1ccco1 ZINC000474466247 331586871 /nfs/dbraw/zinc/58/68/71/331586871.db2.gz ZSTNIQDRXDAKGF-UHFFFAOYSA-N 1 1 295.835 4.723 20 0 CJADMO CC(C)Sc1cccc(Cl)c1C[NH2+]Cc1ccoc1 ZINC000474604507 331591492 /nfs/dbraw/zinc/59/14/92/331591492.db2.gz IMHUXNSGLHGINI-UHFFFAOYSA-N 1 1 295.835 4.723 20 0 CJADMO Cc1cccc(N[C@H](C)c2cc3ccccc3s2)[nH+]1 ZINC000475058563 331613133 /nfs/dbraw/zinc/61/31/33/331613133.db2.gz ZGERNEXPLSDPGN-GFCCVEGCSA-N 1 1 268.385 4.778 20 0 CJADMO Cc1cccc(N[C@@H](C)c2cc3ccccc3s2)[nH+]1 ZINC000475058564 331613122 /nfs/dbraw/zinc/61/31/22/331613122.db2.gz ZGERNEXPLSDPGN-LBPRGKRZSA-N 1 1 268.385 4.778 20 0 CJADMO C[C@H](c1ncc(C(C)(C)C)o1)[N@H+]1CCC2(C1)CCCCC2 ZINC000475356052 264310286 /nfs/dbraw/zinc/31/02/86/264310286.db2.gz XZYKPKRNVNSFGZ-CQSZACIVSA-N 1 1 290.451 4.689 20 0 CJADMO c1nc(C[N@H+](CC2CC2)C2CCC2)sc1-c1ccccc1 ZINC000475668282 264334672 /nfs/dbraw/zinc/33/46/72/264334672.db2.gz AAHJPIMFAHGHGI-UHFFFAOYSA-N 1 1 298.455 4.575 20 0 CJADMO Cc1[nH+]ccn1CCCCSC[C@@H](C)c1ccccc1 ZINC000475881519 264338053 /nfs/dbraw/zinc/33/80/53/264338053.db2.gz NTCSEBAYSZRNMU-OAHLLOKOSA-N 1 1 288.460 4.509 20 0 CJADMO Clc1ccc(C[NH2+]C2(c3ccccc3)CC2)c(Cl)c1 ZINC000477435821 331683912 /nfs/dbraw/zinc/68/39/12/331683912.db2.gz IVAMVPKUSCEZPB-UHFFFAOYSA-N 1 1 292.209 4.772 20 0 CJADMO COc1cccc(F)c1[C@@H](C)[NH2+]Cc1ccc(C2CC2)cc1 ZINC000477854308 331692071 /nfs/dbraw/zinc/69/20/71/331692071.db2.gz HCMITGPHDGCEQK-CYBMUJFWSA-N 1 1 299.389 4.563 20 0 CJADMO CC(C)[C@H]([NH2+]Cc1ccccc1F)c1cc(F)ccc1F ZINC000479329731 331724925 /nfs/dbraw/zinc/72/49/25/331724925.db2.gz HSTMBZWSMDYCQW-KRWDZBQOSA-N 1 1 293.332 4.591 20 0 CJADMO CC(C)c1cnc(C[NH2+]Cc2cccc(C(C)C)c2)s1 ZINC000479409297 331727613 /nfs/dbraw/zinc/72/76/13/331727613.db2.gz JNWMDXFUCNEMPN-UHFFFAOYSA-N 1 1 288.460 4.680 20 0 CJADMO CCc1ccc([C@H](C)[NH2+][C@H](C)c2ccccc2Cl)o1 ZINC000479770889 529722182 /nfs/dbraw/zinc/72/21/82/529722182.db2.gz MCYUOAQCHIKKGD-NEPJUHHUSA-N 1 1 277.795 4.907 20 0 CJADMO CCc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccccc2Cl)o1 ZINC000479770893 529707230 /nfs/dbraw/zinc/70/72/30/529707230.db2.gz MCYUOAQCHIKKGD-NWDGAFQWSA-N 1 1 277.795 4.907 20 0 CJADMO CCc1ccc([C@H](C)[NH2+][C@@H](C)c2ccccc2Cl)o1 ZINC000479770896 529721637 /nfs/dbraw/zinc/72/16/37/529721637.db2.gz MCYUOAQCHIKKGD-RYUDHWBXSA-N 1 1 277.795 4.907 20 0 CJADMO CCc1ccc([C@@H](C)[NH2+][C@H](C)c2ccccc2Cl)o1 ZINC000479770905 529707465 /nfs/dbraw/zinc/70/74/65/529707465.db2.gz MCYUOAQCHIKKGD-VXGBXAGGSA-N 1 1 277.795 4.907 20 0 CJADMO C[C@@H]([NH2+]Cc1ccccc1F)c1ccc(-c2ccccc2)o1 ZINC000479850453 331748061 /nfs/dbraw/zinc/74/80/61/331748061.db2.gz LXCLYYFYTBDJAQ-CQSZACIVSA-N 1 1 295.357 4.937 20 0 CJADMO Cc1c2ccccc2oc1C[NH2+]Cc1ccsc1Cl ZINC000480328528 331768290 /nfs/dbraw/zinc/76/82/90/331768290.db2.gz BGRDKVBFXGWABY-UHFFFAOYSA-N 1 1 291.803 4.746 20 0 CJADMO C[C@@H]([NH2+][C@H](C)c1ccccc1Cl)c1ccc(Cl)cn1 ZINC000480340949 331768809 /nfs/dbraw/zinc/76/88/09/331768809.db2.gz ZCBWIXSTOUIFPF-GHMZBOCLSA-N 1 1 295.213 4.800 20 0 CJADMO Clc1sccc1C[NH2+]C1(c2cccc(Cl)c2)CC1 ZINC000480356340 331769466 /nfs/dbraw/zinc/76/94/66/331769466.db2.gz MGGNLDDXCAGKLT-UHFFFAOYSA-N 1 1 298.238 4.834 20 0 CJADMO CSc1cc(C)ccc1C[NH2+]Cc1ccsc1Cl ZINC000480359988 331769735 /nfs/dbraw/zinc/76/97/35/331769735.db2.gz GTCPXNPSJXDIHV-UHFFFAOYSA-N 1 1 297.876 4.722 20 0 CJADMO Cc1cc([C@@H](C)[NH2+]Cc2ccsc2Cl)ccc1F ZINC000480391677 331771527 /nfs/dbraw/zinc/77/15/27/331771527.db2.gz VWQNQZJRGYEDJY-SNVBAGLBSA-N 1 1 283.799 4.700 20 0 CJADMO Fc1cccc(Cl)c1C[NH2+]Cc1ccc(C2CC2)cc1 ZINC000480452005 331773296 /nfs/dbraw/zinc/77/32/96/331773296.db2.gz GFUSZATWSGHYFX-UHFFFAOYSA-N 1 1 289.781 4.646 20 0 CJADMO Cc1occc1C[NH2+][C@@H](c1ccccc1)c1ccc(F)cc1 ZINC000480823520 331789294 /nfs/dbraw/zinc/78/92/94/331789294.db2.gz WQKRJIRJMCIRLH-IBGZPJMESA-N 1 1 295.357 4.606 20 0 CJADMO Cc1occc1C[NH2+][C@H](c1ccccc1)c1ccc(F)cc1 ZINC000480823540 331789218 /nfs/dbraw/zinc/78/92/18/331789218.db2.gz WQKRJIRJMCIRLH-LJQANCHMSA-N 1 1 295.357 4.606 20 0 CJADMO C[C@@H]([NH2+]Cc1c(F)cccc1Cl)c1cc(F)cc(F)c1 ZINC000481714750 331813037 /nfs/dbraw/zinc/81/30/37/331813037.db2.gz HCPPRFSHNXQIPT-SECBINFHSA-N 1 1 299.723 4.608 20 0 CJADMO Cc1cccc2c1CC[C@H]2[NH2+]Cc1c(F)cccc1Cl ZINC000481718566 331813197 /nfs/dbraw/zinc/81/31/97/331813197.db2.gz NDOOVZNEYCWHSC-QGZVFWFLSA-N 1 1 289.781 4.565 20 0 CJADMO Cc1ccc2c(c1)[C@@H]([NH2+]Cc1c(F)cccc1Cl)CC2 ZINC000481725241 331813420 /nfs/dbraw/zinc/81/34/20/331813420.db2.gz OQTZSPLMBOAUFA-KRWDZBQOSA-N 1 1 289.781 4.565 20 0 CJADMO Cc1ccc2c(c1)[C@H]([NH2+]Cc1c(F)cccc1Cl)CC2 ZINC000481725242 331813490 /nfs/dbraw/zinc/81/34/90/331813490.db2.gz OQTZSPLMBOAUFA-QGZVFWFLSA-N 1 1 289.781 4.565 20 0 CJADMO Cc1sc(C[NH2+][C@H](C)c2cccc(F)c2)nc1C(C)C ZINC000482897318 331851527 /nfs/dbraw/zinc/85/15/27/331851527.db2.gz XMWGLGVGCMEEQH-LLVKDONJSA-N 1 1 292.423 4.565 20 0 CJADMO Cc1sc(C[NH2+][C@@H](C)c2cccc(F)c2)nc1C(C)C ZINC000482897319 331851693 /nfs/dbraw/zinc/85/16/93/331851693.db2.gz XMWGLGVGCMEEQH-NSHDSACASA-N 1 1 292.423 4.565 20 0 CJADMO CCc1ccc([C@H](C)[NH2+]Cc2oc3ccccc3c2C)o1 ZINC000483128717 331859594 /nfs/dbraw/zinc/85/95/94/331859594.db2.gz IYNYFALCTGQRIX-ZDUSSCGKSA-N 1 1 283.371 4.747 20 0 CJADMO CCc1ccc([C@H](C)[NH2+][C@H](CC)c2ccc(F)cc2F)o1 ZINC000483240367 331864421 /nfs/dbraw/zinc/86/44/21/331864421.db2.gz HLXWFXPJKIREIL-MEDUHNTESA-N 1 1 293.357 4.922 20 0 CJADMO C[C@@H](c1ccc(F)c(Cl)c1)[NH+]1CCC(C(F)F)CC1 ZINC000483519741 331877892 /nfs/dbraw/zinc/87/78/92/331877892.db2.gz OBDXDRHQYKYAKN-VIFPVBQESA-N 1 1 291.744 4.517 20 0 CJADMO CCc1ccc([C@@H](C)[NH2+]Cc2cc(F)ccc2SC)o1 ZINC000483844905 331886408 /nfs/dbraw/zinc/88/64/08/331886408.db2.gz AILULBLDNHFRHX-LLVKDONJSA-N 1 1 293.407 4.554 20 0 CJADMO CCc1ccc([C@H](C)[NH2+]Cc2cc(F)ccc2SC)o1 ZINC000483844907 331886435 /nfs/dbraw/zinc/88/64/35/331886435.db2.gz AILULBLDNHFRHX-NSHDSACASA-N 1 1 293.407 4.554 20 0 CJADMO C[C@H]([NH2+][C@H](c1ccc(F)cc1F)C(C)(C)C)c1ccco1 ZINC000484522567 331901331 /nfs/dbraw/zinc/90/13/31/331901331.db2.gz YOKOSEABPDDYCL-MEDUHNTESA-N 1 1 293.357 4.996 20 0 CJADMO Cc1[nH+]ccn1CCCCSC(C)(C)c1ccccc1 ZINC000485475540 331915204 /nfs/dbraw/zinc/91/52/04/331915204.db2.gz MTPXITJJCVJART-UHFFFAOYSA-N 1 1 288.460 4.640 20 0 CJADMO C[C@@H]([NH2+]Cc1cc(F)cc(Cl)c1)c1cccc(F)c1F ZINC000485730884 331922789 /nfs/dbraw/zinc/92/27/89/331922789.db2.gz HQDSRPIVKITKDJ-SECBINFHSA-N 1 1 299.723 4.608 20 0 CJADMO CC(C)c1ccc[nH+]c1NCc1cnc(-c2ccco2)s1 ZINC000485953825 331927532 /nfs/dbraw/zinc/92/75/32/331927532.db2.gz HOCOGRSCXHQUEP-UHFFFAOYSA-N 1 1 299.399 4.534 20 0 CJADMO c1cc([C@H]2CCCN2c2cc[nH+]c3ccsc32)cs1 ZINC000486931166 331950080 /nfs/dbraw/zinc/95/00/80/331950080.db2.gz AOGAVCCYYDOWRN-CYBMUJFWSA-N 1 1 286.425 4.699 20 0 CJADMO c1cc([C@@H]2CCCN2c2cc[nH+]c3ccsc32)cs1 ZINC000486931167 331950135 /nfs/dbraw/zinc/95/01/35/331950135.db2.gz AOGAVCCYYDOWRN-ZDUSSCGKSA-N 1 1 286.425 4.699 20 0 CJADMO Cc1cnc([C@H](C)[NH2+][C@H](C)c2ccc(F)c3ccccc32)o1 ZINC000487931716 331984775 /nfs/dbraw/zinc/98/47/75/331984775.db2.gz FSNUWESVSPAQRG-OLZOCXBDSA-N 1 1 298.361 4.687 20 0 CJADMO Cc1cnc([C@@H](C)[NH2+][C@@H](C)c2ccc(F)c3ccccc32)o1 ZINC000487931718 331984791 /nfs/dbraw/zinc/98/47/91/331984791.db2.gz FSNUWESVSPAQRG-QWHCGFSZSA-N 1 1 298.361 4.687 20 0 CJADMO Cc1cnc([C@H](C)[NH2+][C@@H](C)c2ccc(F)c3ccccc32)o1 ZINC000487931720 331984762 /nfs/dbraw/zinc/98/47/62/331984762.db2.gz FSNUWESVSPAQRG-STQMWFEESA-N 1 1 298.361 4.687 20 0 CJADMO Cc1ccc([C@@H]2CCC[N@H+]2Cc2cc3ccc(F)cc3[nH]2)o1 ZINC000488335432 332000501 /nfs/dbraw/zinc/00/05/01/332000501.db2.gz XYKGWTBGFNEBLL-KRWDZBQOSA-N 1 1 298.361 4.546 20 0 CJADMO Cc1ccc([C@H]2CCC[N@H+]2Cc2cc3ccc(F)cc3[nH]2)o1 ZINC000488335434 332000420 /nfs/dbraw/zinc/00/04/20/332000420.db2.gz XYKGWTBGFNEBLL-QGZVFWFLSA-N 1 1 298.361 4.546 20 0 CJADMO CC(C)(C)C[C@H]1CCC[N@H+]1Cc1ncc(-c2ccccc2)o1 ZINC000488385786 332003384 /nfs/dbraw/zinc/00/33/84/332003384.db2.gz PWXOZYONMFMUMX-MRXNPFEDSA-N 1 1 298.430 4.742 20 0 CJADMO CC(C)(C)C[C@H]1CCC[N@H+]1Cc1cccc2cccnc21 ZINC000488400979 332004336 /nfs/dbraw/zinc/00/43/36/332004336.db2.gz FPXLQSHDOSPSSK-QGZVFWFLSA-N 1 1 282.431 4.635 20 0 CJADMO CC(C)c1nc(C[N@H+]2CCC[C@H]2CC(C)(C)C)cs1 ZINC000488406126 332004500 /nfs/dbraw/zinc/00/45/00/332004500.db2.gz XBAYKUMQAGDOEM-AWEZNQCLSA-N 1 1 280.481 4.667 20 0 CJADMO CC(C)(C)C[C@H]1CCC[N@H+]1Cc1coc(-c2ccccc2)n1 ZINC000488411311 332004991 /nfs/dbraw/zinc/00/49/91/332004991.db2.gz OQUWLBJCHSFJJR-QGZVFWFLSA-N 1 1 298.430 4.742 20 0 CJADMO CCc1cccnc1[C@@H](C)[NH2+][C@H](C)c1ccccc1Cl ZINC000488468335 262327176 /nfs/dbraw/zinc/32/71/76/262327176.db2.gz PBEDRRCUKQBDOJ-CHWSQXEVSA-N 1 1 288.822 4.709 20 0 CJADMO CCc1cccnc1[C@H](C)[NH2+][C@H](C)c1ccccc1Cl ZINC000488468358 262327449 /nfs/dbraw/zinc/32/74/49/262327449.db2.gz PBEDRRCUKQBDOJ-OLZOCXBDSA-N 1 1 288.822 4.709 20 0 CJADMO C[C@H](c1ccccc1Cl)[N@@H+](C)Cc1ccsc1 ZINC000488525639 332015550 /nfs/dbraw/zinc/01/55/50/332015550.db2.gz DPSPLUPOEWUWPL-LLVKDONJSA-N 1 1 265.809 4.595 20 0 CJADMO C[C@H](c1ccccc1Cl)[N@H+](C)Cc1ccsc1 ZINC000488525639 332015548 /nfs/dbraw/zinc/01/55/48/332015548.db2.gz DPSPLUPOEWUWPL-LLVKDONJSA-N 1 1 265.809 4.595 20 0 CJADMO C[C@@H](c1ccccc1Cl)[N@@H+](C)Cc1ccsc1 ZINC000488525640 332015593 /nfs/dbraw/zinc/01/55/93/332015593.db2.gz DPSPLUPOEWUWPL-NSHDSACASA-N 1 1 265.809 4.595 20 0 CJADMO C[C@@H](c1ccccc1Cl)[N@H+](C)Cc1ccsc1 ZINC000488525640 332015591 /nfs/dbraw/zinc/01/55/91/332015591.db2.gz DPSPLUPOEWUWPL-NSHDSACASA-N 1 1 265.809 4.595 20 0 CJADMO C[C@H](c1cccc(Cl)c1)[N@@H+](C)Cc1ccsc1 ZINC000488528838 332015709 /nfs/dbraw/zinc/01/57/09/332015709.db2.gz NMEJELWSMPTSMV-LLVKDONJSA-N 1 1 265.809 4.595 20 0 CJADMO C[C@@H](c1cccc(Cl)c1)[N@@H+](C)Cc1ccsc1 ZINC000488528839 332015804 /nfs/dbraw/zinc/01/58/04/332015804.db2.gz NMEJELWSMPTSMV-NSHDSACASA-N 1 1 265.809 4.595 20 0 CJADMO C[C@H](c1ccc(Cl)cc1)[N@@H+](C)Cc1ccsc1 ZINC000488531911 332015943 /nfs/dbraw/zinc/01/59/43/332015943.db2.gz VFJWETJHZPYIBZ-LLVKDONJSA-N 1 1 265.809 4.595 20 0 CJADMO C[C@@H](c1ccc(Cl)cc1)[N@@H+](C)Cc1ccsc1 ZINC000488531912 332015892 /nfs/dbraw/zinc/01/58/92/332015892.db2.gz VFJWETJHZPYIBZ-NSHDSACASA-N 1 1 265.809 4.595 20 0 CJADMO CC[N@@H+](Cc1ccc2ccccc2c1)[C@@H](C)c1cccnc1 ZINC000488722930 332022654 /nfs/dbraw/zinc/02/26/54/332022654.db2.gz HXIOOENOXOZQGT-INIZCTEOSA-N 1 1 290.410 4.818 20 0 CJADMO CC[N@@H+](Cc1ccc2ccccc2c1)[C@H](C)c1cccnc1 ZINC000488722933 332022562 /nfs/dbraw/zinc/02/25/62/332022562.db2.gz HXIOOENOXOZQGT-MRXNPFEDSA-N 1 1 290.410 4.818 20 0 CJADMO Cc1cccc(N[C@@H]2CCCc3sc(Cl)cc32)[nH+]1 ZINC000488750846 332024095 /nfs/dbraw/zinc/02/40/95/332024095.db2.gz HNENOYJGJXSEDN-LLVKDONJSA-N 1 1 278.808 4.594 20 0 CJADMO Cc1cccc(N[C@H]2CCCc3sc(Cl)cc32)[nH+]1 ZINC000488750847 332024080 /nfs/dbraw/zinc/02/40/80/332024080.db2.gz HNENOYJGJXSEDN-NSHDSACASA-N 1 1 278.808 4.594 20 0 CJADMO Cc1cc[nH+]c(N[C@@H]2CCCc3sc(Cl)cc32)c1 ZINC000488754605 332024395 /nfs/dbraw/zinc/02/43/95/332024395.db2.gz QBSQOMYPFAHZRK-LLVKDONJSA-N 1 1 278.808 4.594 20 0 CJADMO Cc1cc[nH+]c(N[C@H]2CCCc3sc(Cl)cc32)c1 ZINC000488754608 332024357 /nfs/dbraw/zinc/02/43/57/332024357.db2.gz QBSQOMYPFAHZRK-NSHDSACASA-N 1 1 278.808 4.594 20 0 CJADMO CCC[N@@H+](CC)[C@H](C)c1ncc(-c2ccc(Cl)cc2)o1 ZINC000488758148 332024373 /nfs/dbraw/zinc/02/43/73/332024373.db2.gz HTQFNSVDDSOCSG-GFCCVEGCSA-N 1 1 292.810 4.788 20 0 CJADMO CCC[N@@H+](CC)[C@@H](C)c1ncc(-c2ccc(Cl)cc2)o1 ZINC000488758149 332024209 /nfs/dbraw/zinc/02/42/09/332024209.db2.gz HTQFNSVDDSOCSG-LBPRGKRZSA-N 1 1 292.810 4.788 20 0 CJADMO Cc1ccccc1[C@H](C(C)C)[N@@H+](C)Cc1nccn1C(C)C ZINC000488773739 332024951 /nfs/dbraw/zinc/02/49/51/332024951.db2.gz ZACZLQOGFARZAT-IBGZPJMESA-N 1 1 299.462 4.602 20 0 CJADMO Cc1ccccc1[C@@H](C(C)C)[N@@H+](C)Cc1nccn1C(C)C ZINC000488773740 332024987 /nfs/dbraw/zinc/02/49/87/332024987.db2.gz ZACZLQOGFARZAT-LJQANCHMSA-N 1 1 299.462 4.602 20 0 CJADMO CC[N@@H+](Cc1ccc2ccccc2c1)[C@@H](C)c1ccccn1 ZINC000488796410 332026057 /nfs/dbraw/zinc/02/60/57/332026057.db2.gz XKMVINPEXJDIOW-INIZCTEOSA-N 1 1 290.410 4.818 20 0 CJADMO CC[N@@H+](Cc1ccc2ccccc2c1)[C@H](C)c1ccccn1 ZINC000488796412 332026139 /nfs/dbraw/zinc/02/61/39/332026139.db2.gz XKMVINPEXJDIOW-MRXNPFEDSA-N 1 1 290.410 4.818 20 0 CJADMO CC[C@H](c1ccccc1)[N@@H+](C)Cc1sccc1C ZINC000489223295 332043689 /nfs/dbraw/zinc/04/36/89/332043689.db2.gz JJTQPCSXKGTPJA-OAHLLOKOSA-N 1 1 259.418 4.640 20 0 CJADMO CC[N@@H+](Cc1ccccn1)[C@@H](C)c1ccc2ccccc2c1 ZINC000489399451 332050249 /nfs/dbraw/zinc/05/02/49/332050249.db2.gz YFOFDMZHYQYAEJ-INIZCTEOSA-N 1 1 290.410 4.818 20 0 CJADMO CC[N@@H+](Cc1ccccn1)[C@H](C)c1ccc2ccccc2c1 ZINC000489399456 332050071 /nfs/dbraw/zinc/05/00/71/332050071.db2.gz YFOFDMZHYQYAEJ-MRXNPFEDSA-N 1 1 290.410 4.818 20 0 CJADMO CC[C@@H](c1ccc(Cl)cc1)[N@@H+](CC)Cc1ccccn1 ZINC000489400224 332050188 /nfs/dbraw/zinc/05/01/88/332050188.db2.gz ZNMZCQIBRRUEBO-KRWDZBQOSA-N 1 1 288.822 4.708 20 0 CJADMO CC[C@H](c1ccc(Cl)cc1)[N@@H+](CC)Cc1ccccn1 ZINC000489400225 332050322 /nfs/dbraw/zinc/05/03/22/332050322.db2.gz ZNMZCQIBRRUEBO-QGZVFWFLSA-N 1 1 288.822 4.708 20 0 CJADMO C[N@@H+](CCCSc1ccccc1Cl)Cc1ccoc1 ZINC000489603489 332061183 /nfs/dbraw/zinc/06/11/83/332061183.db2.gz JARRADFQJCHYCL-UHFFFAOYSA-N 1 1 295.835 4.547 20 0 CJADMO C[N@@H+](Cc1csc(-c2ccsc2)n1)C1(C)CCCC1 ZINC000489830857 332069594 /nfs/dbraw/zinc/06/95/94/332069594.db2.gz KIFGUVWUTJQXTE-UHFFFAOYSA-N 1 1 292.473 4.636 20 0 CJADMO C[N@@H+](Cc1cnc(-c2ccccc2)s1)C1(C)CCCC1 ZINC000489860400 332070669 /nfs/dbraw/zinc/07/06/69/332070669.db2.gz NKDBRAWZYHHYKP-UHFFFAOYSA-N 1 1 286.444 4.575 20 0 CJADMO C[N@@H+](Cc1csc(-c2ccccc2)n1)C1(C)CCCC1 ZINC000489871055 332071129 /nfs/dbraw/zinc/07/11/29/332071129.db2.gz BJYNWXPLUSCTSN-UHFFFAOYSA-N 1 1 286.444 4.575 20 0 CJADMO C[N@@H+](CC1CCC(C(F)(F)F)CC1)C1(C)CCCC1 ZINC000489878084 332071441 /nfs/dbraw/zinc/07/14/41/332071441.db2.gz ZBKBLWNJULLHDD-UHFFFAOYSA-N 1 1 277.374 4.620 20 0 CJADMO C[N@@H+](Cc1ncc(-c2ccccc2)s1)C1(C)CCCC1 ZINC000489878925 332071474 /nfs/dbraw/zinc/07/14/74/332071474.db2.gz YSHGJVTWZJQEIK-UHFFFAOYSA-N 1 1 286.444 4.575 20 0 CJADMO C[N@@H+](Cc1csc(C2CCCC2)n1)C1(C)CCCC1 ZINC000490109009 332081807 /nfs/dbraw/zinc/08/18/07/332081807.db2.gz RHVUVFCKQYSDOR-UHFFFAOYSA-N 1 1 278.465 4.565 20 0 CJADMO C[N@@H+](Cc1csc(-c2cccs2)n1)C1(C)CCCC1 ZINC000490192498 332084201 /nfs/dbraw/zinc/08/42/01/332084201.db2.gz BHBQHQCYQXOYGE-UHFFFAOYSA-N 1 1 292.473 4.636 20 0 CJADMO C[N@@H+](Cc1nc(-c2ccccc2)cs1)C1(C)CCCC1 ZINC000490210831 332084690 /nfs/dbraw/zinc/08/46/90/332084690.db2.gz UQLMLDRGKLWOGH-UHFFFAOYSA-N 1 1 286.444 4.575 20 0 CJADMO Cc1nc(C(C)C)sc1[C@@H](C)[N@@H+](C)Cc1ccoc1C ZINC000490419129 332089093 /nfs/dbraw/zinc/08/90/93/332089093.db2.gz FYHRGISMQRVELM-GFCCVEGCSA-N 1 1 292.448 4.669 20 0 CJADMO Cc1nc(C(C)C)sc1[C@H](C)[N@@H+](C)Cc1ccoc1C ZINC000490419131 332089081 /nfs/dbraw/zinc/08/90/81/332089081.db2.gz FYHRGISMQRVELM-LBPRGKRZSA-N 1 1 292.448 4.669 20 0 CJADMO Cc1occc1C[N@H+](C)[C@H](C)c1cc2ccccc2o1 ZINC000490425197 332089098 /nfs/dbraw/zinc/08/90/98/332089098.db2.gz XNENXBGHEAAJDY-GFCCVEGCSA-N 1 1 269.344 4.527 20 0 CJADMO Cc1occc1C[N@H+](C)[C@@H](C)c1cc2ccccc2o1 ZINC000490425198 332089062 /nfs/dbraw/zinc/08/90/62/332089062.db2.gz XNENXBGHEAAJDY-LBPRGKRZSA-N 1 1 269.344 4.527 20 0 CJADMO Cc1cnc(C[N@@H+]2CCCC[C@@H]2c2ccc(C(C)C)cc2)o1 ZINC000490678007 332102934 /nfs/dbraw/zinc/10/29/34/332102934.db2.gz WDTHWTGSLKYAHH-GOSISDBHSA-N 1 1 298.430 4.834 20 0 CJADMO Cc1cnc(C[N@H+]2CCCC[C@@H]2c2ccc(C(C)C)cc2)o1 ZINC000490678007 332102933 /nfs/dbraw/zinc/10/29/33/332102933.db2.gz WDTHWTGSLKYAHH-GOSISDBHSA-N 1 1 298.430 4.834 20 0 CJADMO Cc1cnc(C[N@@H+]2CCCC[C@H]2c2ccc(C(C)C)cc2)o1 ZINC000490678014 332102958 /nfs/dbraw/zinc/10/29/58/332102958.db2.gz WDTHWTGSLKYAHH-SFHVURJKSA-N 1 1 298.430 4.834 20 0 CJADMO Cc1cnc(C[N@H+]2CCCC[C@H]2c2ccc(C(C)C)cc2)o1 ZINC000490678014 332102957 /nfs/dbraw/zinc/10/29/57/332102957.db2.gz WDTHWTGSLKYAHH-SFHVURJKSA-N 1 1 298.430 4.834 20 0 CJADMO CC(C)c1ccc([C@H]2CCCC[N@H+]2Cc2ccon2)cc1 ZINC000490703387 332106466 /nfs/dbraw/zinc/10/64/66/332106466.db2.gz XJUBWQYOOBDMKF-GOSISDBHSA-N 1 1 284.403 4.525 20 0 CJADMO CC(C)c1ccc([C@H]2CCCC[N@@H+]2Cc2ccon2)cc1 ZINC000490703387 332106464 /nfs/dbraw/zinc/10/64/64/332106464.db2.gz XJUBWQYOOBDMKF-GOSISDBHSA-N 1 1 284.403 4.525 20 0 CJADMO CC(C)c1ccc([C@@H]2CCCC[N@H+]2Cc2ccon2)cc1 ZINC000490703389 332106581 /nfs/dbraw/zinc/10/65/81/332106581.db2.gz XJUBWQYOOBDMKF-SFHVURJKSA-N 1 1 284.403 4.525 20 0 CJADMO CC(C)c1ccc([C@@H]2CCCC[N@@H+]2Cc2ccon2)cc1 ZINC000490703389 332106579 /nfs/dbraw/zinc/10/65/79/332106579.db2.gz XJUBWQYOOBDMKF-SFHVURJKSA-N 1 1 284.403 4.525 20 0 CJADMO CC(C)OCCC[N@@H+](C)[C@@H](C)c1ccc(C(C)C)cc1 ZINC000491030339 332140857 /nfs/dbraw/zinc/14/08/57/332140857.db2.gz YNRFISGTIMTSMB-INIZCTEOSA-N 1 1 277.452 4.618 20 0 CJADMO CC(C)OCCC[N@@H+](C)[C@H](C)c1ccc(C(C)C)cc1 ZINC000491030341 332140851 /nfs/dbraw/zinc/14/08/51/332140851.db2.gz YNRFISGTIMTSMB-MRXNPFEDSA-N 1 1 277.452 4.618 20 0 CJADMO CC[C@@H](c1ccc(Cl)cc1)[N@@H+](C)CCCOC(C)C ZINC000491055351 332143672 /nfs/dbraw/zinc/14/36/72/332143672.db2.gz FZZSRIXCODOWIV-INIZCTEOSA-N 1 1 283.843 4.538 20 0 CJADMO CC[C@H](c1ccc(Cl)cc1)[N@@H+](C)CCCOC(C)C ZINC000491055352 332143622 /nfs/dbraw/zinc/14/36/22/332143622.db2.gz FZZSRIXCODOWIV-MRXNPFEDSA-N 1 1 283.843 4.538 20 0 CJADMO CC(C)OCCC[N@@H+](C)[C@@H](C)c1ccc2ccccc2c1 ZINC000491072706 332147004 /nfs/dbraw/zinc/14/70/04/332147004.db2.gz AEHSZYXQHMALTB-INIZCTEOSA-N 1 1 285.431 4.648 20 0 CJADMO CC(C)OCCC[N@@H+](C)[C@H](C)c1ccc2ccccc2c1 ZINC000491072707 332146802 /nfs/dbraw/zinc/14/68/02/332146802.db2.gz AEHSZYXQHMALTB-MRXNPFEDSA-N 1 1 285.431 4.648 20 0 CJADMO COCCCCC[N@@H+](C)Cc1ccccc1-c1ccccc1 ZINC000491073333 332147156 /nfs/dbraw/zinc/14/71/56/332147156.db2.gz DALFEZBKEJXPMW-UHFFFAOYSA-N 1 1 297.442 4.602 20 0 CJADMO CC(C)OCCC[N@@H+](C)Cc1ccccc1-c1ccccc1 ZINC000491076368 332147402 /nfs/dbraw/zinc/14/74/02/332147402.db2.gz OKQVGIMGNVXBKO-UHFFFAOYSA-N 1 1 297.442 4.601 20 0 CJADMO CC(C)[N@@H+](Cc1nc2cc(F)ccc2o1)C1CCCCC1 ZINC000491186479 332162302 /nfs/dbraw/zinc/16/23/02/332162302.db2.gz MVGBFMYCEFQRCB-UHFFFAOYSA-N 1 1 290.382 4.510 20 0 CJADMO CC(C)[N@@H+](Cc1ccn(C2CCCC2)n1)C1CCCCC1 ZINC000491289724 332182789 /nfs/dbraw/zinc/18/27/89/332182789.db2.gz PLFGPELUOOYFDC-UHFFFAOYSA-N 1 1 289.467 4.541 20 0 CJADMO CC(C)[N@@H+](Cc1nc2ccc(F)cc2o1)C1CCCCC1 ZINC000491299657 332185321 /nfs/dbraw/zinc/18/53/21/332185321.db2.gz AUZGEQGWLITEHQ-UHFFFAOYSA-N 1 1 290.382 4.510 20 0 CJADMO CC(C)[N@@H+](CCCCC(F)(F)F)C1CCCCC1 ZINC000491301077 332185379 /nfs/dbraw/zinc/18/53/79/332185379.db2.gz SMNXVINDIZTFOD-UHFFFAOYSA-N 1 1 265.363 4.762 20 0 CJADMO Cc1ccoc1C[NH2+]Cc1ccc(-c2cccc(F)c2C)o1 ZINC000491402155 332205208 /nfs/dbraw/zinc/20/52/08/332205208.db2.gz RUZJWZUPNPHSNT-UHFFFAOYSA-N 1 1 299.345 4.585 20 0 CJADMO Cc1ccoc1C[NH2+]Cc1ccc(-c2ccccc2)cc1F ZINC000491484761 332219979 /nfs/dbraw/zinc/21/99/79/332219979.db2.gz KUEAVGWWXGPIPM-UHFFFAOYSA-N 1 1 295.357 4.684 20 0 CJADMO Cc1ccoc1C[NH2+]Cc1ccc(-c2ccc(F)cc2C)o1 ZINC000491500212 332224021 /nfs/dbraw/zinc/22/40/21/332224021.db2.gz KMKWOTUKBCJLNV-UHFFFAOYSA-N 1 1 299.345 4.585 20 0 CJADMO Fc1cc(C2CC2)ccc1C[NH2+]Cc1ccccc1Cl ZINC000491531164 332231061 /nfs/dbraw/zinc/23/10/61/332231061.db2.gz MJQZTVGAODOXQR-UHFFFAOYSA-N 1 1 289.781 4.646 20 0 CJADMO C[C@@H]([NH2+]Cc1ccc(C2CC2)cc1F)c1ccccc1F ZINC000491534430 332231184 /nfs/dbraw/zinc/23/11/84/332231184.db2.gz VKEYTKGZOMMYHV-GFCCVEGCSA-N 1 1 287.353 4.693 20 0 CJADMO C[C@H]([NH2+]Cc1ccc(C2CC2)cc1F)c1ccccc1F ZINC000491534431 332231090 /nfs/dbraw/zinc/23/10/90/332231090.db2.gz VKEYTKGZOMMYHV-LBPRGKRZSA-N 1 1 287.353 4.693 20 0 CJADMO C[C@@H]1C[C@@H]1c1ccc(C[NH2+]Cc2ccc(C3CC3)cc2F)o1 ZINC000491585881 332241454 /nfs/dbraw/zinc/24/14/54/332241454.db2.gz IBJOKDJKYRSULK-PXAZEXFGSA-N 1 1 299.389 4.709 20 0 CJADMO C[C@H]1C[C@@H]1c1ccc(C[NH2+]Cc2ccc(C3CC3)cc2F)o1 ZINC000491585882 332241558 /nfs/dbraw/zinc/24/15/58/332241558.db2.gz IBJOKDJKYRSULK-SJCJKPOMSA-N 1 1 299.389 4.709 20 0 CJADMO C[C@@H]1C[C@H]1c1ccc(C[NH2+]Cc2ccc(C3CC3)cc2F)o1 ZINC000491585883 332241535 /nfs/dbraw/zinc/24/15/35/332241535.db2.gz IBJOKDJKYRSULK-SJKOYZFVSA-N 1 1 299.389 4.709 20 0 CJADMO C[C@H]1C[C@H]1c1ccc(C[NH2+]Cc2ccc(C3CC3)cc2F)o1 ZINC000491585884 332241500 /nfs/dbraw/zinc/24/15/00/332241500.db2.gz IBJOKDJKYRSULK-YVEFUNNKSA-N 1 1 299.389 4.709 20 0 CJADMO Fc1cc(C2CC2)ccc1C[NH2+]Cc1sccc1Cl ZINC000491585891 332241575 /nfs/dbraw/zinc/24/15/75/332241575.db2.gz IBQHZHVMXHEODO-UHFFFAOYSA-N 1 1 295.810 4.708 20 0 CJADMO Fc1cc(C2CC2)ccc1C[NH2+]Cc1cc2ccccc2o1 ZINC000491589905 332241774 /nfs/dbraw/zinc/24/17/74/332241774.db2.gz VIMHXKZSOFGRSF-UHFFFAOYSA-N 1 1 295.357 4.739 20 0 CJADMO Fc1cc(C2CC2)ccc1C[NH2+]Cc1ccsc1Cl ZINC000491594045 332242042 /nfs/dbraw/zinc/24/20/42/332242042.db2.gz MCLDDMLIVPTSBW-UHFFFAOYSA-N 1 1 295.810 4.708 20 0 CJADMO Cc1nc2ccc(CNc3[nH+]cccc3C(C)C)cc2s1 ZINC000491871891 332373032 /nfs/dbraw/zinc/37/30/32/332373032.db2.gz ORVDSRIOPFIEJE-UHFFFAOYSA-N 1 1 297.427 4.735 20 0 CJADMO CC(C)([NH2+]Cc1cccc(Cl)c1F)c1ccccc1F ZINC000492107909 332383191 /nfs/dbraw/zinc/38/31/91/332383191.db2.gz PPFNLQKTNHTZAV-UHFFFAOYSA-N 1 1 295.760 4.643 20 0 CJADMO CCSc1cccc(C[NH2+]Cc2ccsc2Cl)c1 ZINC000492174247 332385765 /nfs/dbraw/zinc/38/57/65/332385765.db2.gz AUBCPYAVBMJKLD-UHFFFAOYSA-N 1 1 297.876 4.803 20 0 CJADMO COCCCCC[N@@H+](Cc1ccccc1)C1CCCCC1 ZINC000492195868 332386496 /nfs/dbraw/zinc/38/64/96/332386496.db2.gz RXWXXKXXNYTECG-UHFFFAOYSA-N 1 1 289.463 4.638 20 0 CJADMO COCCCCC[N@@H+](Cc1ccc2ccccc2c1)C1CC1 ZINC000492207158 332387216 /nfs/dbraw/zinc/38/72/16/332387216.db2.gz IHQZMXOJFVUEPW-UHFFFAOYSA-N 1 1 297.442 4.621 20 0 CJADMO COCCCCC[N@H+]1CCC[C@H]1c1cccc2ccccc21 ZINC000492207191 332387303 /nfs/dbraw/zinc/38/73/03/332387303.db2.gz ITIRJXFGAVFIDT-FQEVSTJZSA-N 1 1 297.442 4.793 20 0 CJADMO COCCCCC[N@H+]1CCC[C@@H]1c1cccc2ccccc21 ZINC000492207192 332387205 /nfs/dbraw/zinc/38/72/05/332387205.db2.gz ITIRJXFGAVFIDT-HXUWFJFHSA-N 1 1 297.442 4.793 20 0 CJADMO CC[N@@H+](CCCCCOC)[C@@H](C)c1cc2ccccc2o1 ZINC000492208522 332387210 /nfs/dbraw/zinc/38/72/10/332387210.db2.gz OPLSAGMFXFPMIZ-HNNXBMFYSA-N 1 1 289.419 4.632 20 0 CJADMO CC[N@@H+](CCCCCOC)[C@H](C)c1cc2ccccc2o1 ZINC000492208526 332387245 /nfs/dbraw/zinc/38/72/45/332387245.db2.gz OPLSAGMFXFPMIZ-OAHLLOKOSA-N 1 1 289.419 4.632 20 0 CJADMO CC(C)OCCC[N@H+]1CCC[C@H]1c1cccc2ccccc21 ZINC000492210083 332387503 /nfs/dbraw/zinc/38/75/03/332387503.db2.gz WGNKFJMJHMQZOM-FQEVSTJZSA-N 1 1 297.442 4.792 20 0 CJADMO CC(C)OCCC[N@H+]1CCC[C@@H]1c1cccc2ccccc21 ZINC000492210084 332387470 /nfs/dbraw/zinc/38/74/70/332387470.db2.gz WGNKFJMJHMQZOM-HXUWFJFHSA-N 1 1 297.442 4.792 20 0 CJADMO CC[N@@H+](CCCOC(C)C)[C@@H](C)c1cc2ccccc2o1 ZINC000492210139 332387473 /nfs/dbraw/zinc/38/74/73/332387473.db2.gz XIQVHNYDNNZQQK-HNNXBMFYSA-N 1 1 289.419 4.631 20 0 CJADMO CC[N@@H+](CCCOC(C)C)[C@H](C)c1cc2ccccc2o1 ZINC000492210140 332387243 /nfs/dbraw/zinc/38/72/43/332387243.db2.gz XIQVHNYDNNZQQK-OAHLLOKOSA-N 1 1 289.419 4.631 20 0 CJADMO CC(C)OCCC[N@@H+](Cc1ccc2ccccc2c1)C1CC1 ZINC000492210600 332387416 /nfs/dbraw/zinc/38/74/16/332387416.db2.gz YMNCEQKGYVDXJJ-UHFFFAOYSA-N 1 1 297.442 4.619 20 0 CJADMO CC(C)([NH2+]Cc1sccc1Cl)c1ccccc1F ZINC000492315224 332392062 /nfs/dbraw/zinc/39/20/62/332392062.db2.gz WOKRULSOSQAZJL-UHFFFAOYSA-N 1 1 283.799 4.566 20 0 CJADMO C[C@H]1C[C@H]1c1ccc(C[NH2+]C(C)(C)c2ccccc2F)o1 ZINC000492376842 332394791 /nfs/dbraw/zinc/39/47/91/332394791.db2.gz OJGZATCLDHBENO-GXTWGEPZSA-N 1 1 287.378 4.567 20 0 CJADMO C[C@H]1C[C@@H]1c1ccc(C[NH2+]C(C)(C)c2ccccc2F)o1 ZINC000492376843 332394823 /nfs/dbraw/zinc/39/48/23/332394823.db2.gz OJGZATCLDHBENO-JSGCOSHPSA-N 1 1 287.378 4.567 20 0 CJADMO C[C@@H]1C[C@@H]1c1ccc(C[NH2+]C(C)(C)c2ccccc2F)o1 ZINC000492376844 332394807 /nfs/dbraw/zinc/39/48/07/332394807.db2.gz OJGZATCLDHBENO-OCCSQVGLSA-N 1 1 287.378 4.567 20 0 CJADMO C[C@@H]1C[C@H]1c1ccc(C[NH2+]C(C)(C)c2ccccc2F)o1 ZINC000492377045 332394811 /nfs/dbraw/zinc/39/48/11/332394811.db2.gz OJGZATCLDHBENO-TZMCWYRMSA-N 1 1 287.378 4.567 20 0 CJADMO CC(C)([NH2+]Cc1ccc(F)cc1Cl)c1ccccc1F ZINC000492393364 332395417 /nfs/dbraw/zinc/39/54/17/332395417.db2.gz CYWURMAEUCFZQN-UHFFFAOYSA-N 1 1 295.760 4.643 20 0 CJADMO C[N@@H+](CCCCC(F)(F)F)CCc1ccc(Cl)cc1 ZINC000492401474 332395915 /nfs/dbraw/zinc/39/59/15/332395915.db2.gz PPPBBXOBNFMPMJ-UHFFFAOYSA-N 1 1 293.760 4.547 20 0 CJADMO CC(C)([NH2+]Cc1cc(Cl)ccc1F)c1ccccc1F ZINC000492415752 332396497 /nfs/dbraw/zinc/39/64/97/332396497.db2.gz HKWJUIBEHHLMIY-UHFFFAOYSA-N 1 1 295.760 4.643 20 0 CJADMO CC(C)([NH2+]Cc1ccc(Cl)cc1F)c1ccccc1F ZINC000492416453 332396441 /nfs/dbraw/zinc/39/64/41/332396441.db2.gz JVMDWOJLXSIGGA-UHFFFAOYSA-N 1 1 295.760 4.643 20 0 CJADMO CC(C)([NH2+]Cc1ccsc1Cl)c1ccccc1F ZINC000492433747 332397190 /nfs/dbraw/zinc/39/71/90/332397190.db2.gz BLKHMXNBGLFRFU-UHFFFAOYSA-N 1 1 283.799 4.566 20 0 CJADMO CC(C)([NH2+]Cc1ccccc1Cl)c1ccccc1F ZINC000492462266 332398666 /nfs/dbraw/zinc/39/86/66/332398666.db2.gz MIKFYQMIKZPCGU-UHFFFAOYSA-N 1 1 277.770 4.504 20 0 CJADMO Cc1ccc(C[NH2+]Cc2ccc(-c3ccccc3)cc2F)o1 ZINC000492481831 332399761 /nfs/dbraw/zinc/39/97/61/332399761.db2.gz FICWHNVMVJUNJK-UHFFFAOYSA-N 1 1 295.357 4.684 20 0 CJADMO CCCc1csc(C[NH2+][C@@H](C)c2cc(C)cc(C)c2)n1 ZINC000494000406 332460553 /nfs/dbraw/zinc/46/05/53/332460553.db2.gz QUZGXUJURCAPGW-AWEZNQCLSA-N 1 1 288.460 4.563 20 0 CJADMO CCCc1csc(C[NH2+][C@H](C)c2cc(C)sc2C)n1 ZINC000494198376 332466405 /nfs/dbraw/zinc/46/64/05/332466405.db2.gz NBYKCSIMGGJMEQ-LLVKDONJSA-N 1 1 294.489 4.625 20 0 CJADMO CCCc1csc(C[NH2+][C@@H](C)c2cc(C)sc2C)n1 ZINC000494198377 332466274 /nfs/dbraw/zinc/46/62/74/332466274.db2.gz NBYKCSIMGGJMEQ-NSHDSACASA-N 1 1 294.489 4.625 20 0 CJADMO CCCc1csc(C[NH2+]Cc2ccc(C(C)C)cc2)n1 ZINC000494318565 332470312 /nfs/dbraw/zinc/47/03/12/332470312.db2.gz YFRKNLYQEFVWHM-UHFFFAOYSA-N 1 1 288.460 4.509 20 0 CJADMO CCCc1csc(C[NH2+][C@H](C)c2cccc(Cl)c2)n1 ZINC000494323219 332470236 /nfs/dbraw/zinc/47/02/36/332470236.db2.gz PYLXSIUJCQDCFD-LLVKDONJSA-N 1 1 294.851 4.600 20 0 CJADMO CCCc1csc(C[NH2+][C@@H](C)c2cccc(Cl)c2)n1 ZINC000494323220 332470294 /nfs/dbraw/zinc/47/02/94/332470294.db2.gz PYLXSIUJCQDCFD-NSHDSACASA-N 1 1 294.851 4.600 20 0 CJADMO CCCc1csc(C[NH2+][C@H](C)c2ccc(CC)cc2)n1 ZINC000494337291 332470751 /nfs/dbraw/zinc/47/07/51/332470751.db2.gz ZZODQYVNASLIHB-CYBMUJFWSA-N 1 1 288.460 4.509 20 0 CJADMO Fc1cc(Cl)ccc1C[NH2+]Cc1cc2ccccc2o1 ZINC000494403054 332472559 /nfs/dbraw/zinc/47/25/59/332472559.db2.gz FLFSSOVRRLOOER-UHFFFAOYSA-N 1 1 289.737 4.515 20 0 CJADMO CC[C@H]([NH2+]C1(c2ccccc2F)CC1)c1ccccc1F ZINC000494713603 332484146 /nfs/dbraw/zinc/48/41/46/332484146.db2.gz HCBLHXRSNLJYCT-KRWDZBQOSA-N 1 1 287.353 4.695 20 0 CJADMO CC[C@@H]([NH2+]C1(c2ccccc2F)CC1)c1ccccc1F ZINC000494713613 332484136 /nfs/dbraw/zinc/48/41/36/332484136.db2.gz HCBLHXRSNLJYCT-QGZVFWFLSA-N 1 1 287.353 4.695 20 0 CJADMO CC[C@@H]([NH2+][C@H](C)c1cccc(F)c1F)c1ccccc1F ZINC000494728526 332484609 /nfs/dbraw/zinc/48/46/09/332484609.db2.gz DSVBWBICCXKFIL-BDJLRTHQSA-N 1 1 293.332 4.906 20 0 CJADMO CC[C@@H]([NH2+][C@@H](C)c1cccc(F)c1F)c1ccccc1F ZINC000494728528 332484654 /nfs/dbraw/zinc/48/46/54/332484654.db2.gz DSVBWBICCXKFIL-MEDUHNTESA-N 1 1 293.332 4.906 20 0 CJADMO CC[C@H]([NH2+][C@@H](C)c1cccc(F)c1F)c1ccccc1F ZINC000494728529 332484627 /nfs/dbraw/zinc/48/46/27/332484627.db2.gz DSVBWBICCXKFIL-ZBEGNZNMSA-N 1 1 293.332 4.906 20 0 CJADMO CC(C)c1[nH+]ccn1Cc1cccc(N[C@@H]2C[C@@H](C)[C@H]2C)c1 ZINC000495083824 332504659 /nfs/dbraw/zinc/50/46/59/332504659.db2.gz ZPIHPADGFLFGIR-IIDMSEBBSA-N 1 1 297.446 4.511 20 0 CJADMO CC(C)c1[nH+]ccn1Cc1cccc(N[C@@H]2C[C@H](C)[C@@H]2C)c1 ZINC000495083825 332504822 /nfs/dbraw/zinc/50/48/22/332504822.db2.gz ZPIHPADGFLFGIR-RLFYNMQTSA-N 1 1 297.446 4.511 20 0 CJADMO CC(C)c1[nH+]ccn1Cc1cccc(N[C@@H]2C[C@@H](C)[C@@H]2C)c1 ZINC000495083827 332504839 /nfs/dbraw/zinc/50/48/39/332504839.db2.gz ZPIHPADGFLFGIR-RVKKMQEKSA-N 1 1 297.446 4.511 20 0 CJADMO C[C@@H](c1ccc(Cl)cc1)[N@@H+](C[C@H]1CCSC1)C1CC1 ZINC000495097071 262274885 /nfs/dbraw/zinc/27/48/85/262274885.db2.gz FJZRIQQDLOHADZ-QWHCGFSZSA-N 1 1 295.879 4.619 20 0 CJADMO C[C@@H](c1ccc(Cl)cc1)[N@@H+](C[C@@H]1CCSC1)C1CC1 ZINC000495097075 262274830 /nfs/dbraw/zinc/27/48/30/262274830.db2.gz FJZRIQQDLOHADZ-STQMWFEESA-N 1 1 295.879 4.619 20 0 CJADMO Cc1sc(C[NH2+][C@@H](C)c2ccc(F)cc2)nc1C(C)C ZINC000495461157 332519805 /nfs/dbraw/zinc/51/98/05/332519805.db2.gz RCRFQIHSRSJCME-NSHDSACASA-N 1 1 292.423 4.565 20 0 CJADMO Fc1ccc(C[N@@H+](Cc2cccs2)C2CC2)c(Cl)c1 ZINC000497196672 262099944 /nfs/dbraw/zinc/09/99/44/262099944.db2.gz BJHPAWYRDKSSNB-UHFFFAOYSA-N 1 1 295.810 4.705 20 0 CJADMO Fc1ccc(C[N@H+](Cc2cccs2)C2CC2)c(Cl)c1 ZINC000497196672 262099943 /nfs/dbraw/zinc/09/99/43/262099943.db2.gz BJHPAWYRDKSSNB-UHFFFAOYSA-N 1 1 295.810 4.705 20 0 CJADMO Cc1ccc(C)c(C[N@@H+](Cc2cccs2)C2CC2)c1 ZINC000497201163 262103611 /nfs/dbraw/zinc/10/36/11/262103611.db2.gz UPRGADGIGWWOCN-UHFFFAOYSA-N 1 1 271.429 4.530 20 0 CJADMO CC(C)[C@H](c1ccccc1)[N@@H+](C)Cc1ccccc1 ZINC000497412860 262156628 /nfs/dbraw/zinc/15/66/28/262156628.db2.gz WEHFVODKZHEHND-GOSISDBHSA-N 1 1 253.389 4.516 20 0 CJADMO CC(C)[C@@H](c1ccccc1)[N@@H+](C)Cc1ccccc1 ZINC000497412861 262156831 /nfs/dbraw/zinc/15/68/31/262156831.db2.gz WEHFVODKZHEHND-SFHVURJKSA-N 1 1 253.389 4.516 20 0 CJADMO CC(C)[C@@H](c1ccccc1)[N@@H+](C)Cc1nc2ccccc2o1 ZINC000497418383 262157868 /nfs/dbraw/zinc/15/78/68/262157868.db2.gz NVNVIYYWKZTRSG-IBGZPJMESA-N 1 1 294.398 4.657 20 0 CJADMO CC(C)[C@H](c1ccccc1)[N@@H+](C)Cc1nc2ccccc2o1 ZINC000497418385 262158355 /nfs/dbraw/zinc/15/83/55/262158355.db2.gz NVNVIYYWKZTRSG-LJQANCHMSA-N 1 1 294.398 4.657 20 0 CJADMO COc1cccc(C[N@@H+](C)[C@H](c2ccccc2)C(C)C)c1 ZINC000497449533 262162811 /nfs/dbraw/zinc/16/28/11/262162811.db2.gz UJUABXSWBXDPQR-IBGZPJMESA-N 1 1 283.415 4.524 20 0 CJADMO COc1cccc(C[N@@H+](C)[C@@H](c2ccccc2)C(C)C)c1 ZINC000497449536 262163023 /nfs/dbraw/zinc/16/30/23/262163023.db2.gz UJUABXSWBXDPQR-LJQANCHMSA-N 1 1 283.415 4.524 20 0 CJADMO C[C@H](c1ccc(Cl)cc1)[N@@H+](C)Cc1cccc(F)c1 ZINC000497585016 262178347 /nfs/dbraw/zinc/17/83/47/262178347.db2.gz LGCCAKBTJIUTGL-GFCCVEGCSA-N 1 1 277.770 4.672 20 0 CJADMO C[C@@H](c1ccc(Cl)cc1)[N@@H+](C)Cc1cccc(F)c1 ZINC000497585017 262178234 /nfs/dbraw/zinc/17/82/34/262178234.db2.gz LGCCAKBTJIUTGL-LBPRGKRZSA-N 1 1 277.770 4.672 20 0 CJADMO Cc1ccsc1C[N@H+](C)[C@H](C)c1ccc(Cl)cc1 ZINC000497585034 262178331 /nfs/dbraw/zinc/17/83/31/262178331.db2.gz LPLYLIUCPRQLMV-GFCCVEGCSA-N 1 1 279.836 4.903 20 0 CJADMO Cc1ccsc1C[N@H+](C)[C@H](C)c1cccc(Cl)c1 ZINC000497585488 262178298 /nfs/dbraw/zinc/17/82/98/262178298.db2.gz QAGYLRYYTDECSZ-GFCCVEGCSA-N 1 1 279.836 4.903 20 0 CJADMO Cc1ccsc1C[N@H+](C)[C@H](C)c1ccc(F)c(F)c1 ZINC000497585923 262177938 /nfs/dbraw/zinc/17/79/38/262177938.db2.gz UODFLFZBPBYIPO-LLVKDONJSA-N 1 1 281.371 4.528 20 0 CJADMO C[C@H](c1ccc(F)c(F)c1)[N@@H+](C)Cc1ccc(Cl)cc1 ZINC000497587063 262177593 /nfs/dbraw/zinc/17/75/93/262177593.db2.gz GUTKLMMRSCCVMC-LLVKDONJSA-N 1 1 295.760 4.811 20 0 CJADMO C[C@@H](c1ccc(F)c(F)c1)[N@@H+](C)Cc1ccc(Cl)cc1 ZINC000497587064 262177716 /nfs/dbraw/zinc/17/77/16/262177716.db2.gz GUTKLMMRSCCVMC-NSHDSACASA-N 1 1 295.760 4.811 20 0 CJADMO C[C@H](c1ccc(Cl)cc1)[N@@H+](C)Cc1ccc(F)c(F)c1 ZINC000497590838 262177987 /nfs/dbraw/zinc/17/79/87/262177987.db2.gz ORHVOYNBNRMBDR-LLVKDONJSA-N 1 1 295.760 4.811 20 0 CJADMO C[C@@H](c1ccc(Cl)cc1)[N@@H+](C)Cc1ccc(F)c(F)c1 ZINC000497590839 262178309 /nfs/dbraw/zinc/17/83/09/262178309.db2.gz ORHVOYNBNRMBDR-NSHDSACASA-N 1 1 295.760 4.811 20 0 CJADMO C[C@H](c1ccc(F)c(F)c1)[N@@H+](C)Cc1ccccc1Cl ZINC000497591319 262178329 /nfs/dbraw/zinc/17/83/29/262178329.db2.gz YLBODVWBUJNQPU-LLVKDONJSA-N 1 1 295.760 4.811 20 0 CJADMO C[C@H](c1ccc(F)c(F)c1)[N@H+](C)Cc1ccccc1Cl ZINC000497591319 262178328 /nfs/dbraw/zinc/17/83/28/262178328.db2.gz YLBODVWBUJNQPU-LLVKDONJSA-N 1 1 295.760 4.811 20 0 CJADMO C[C@@H](c1ccc(F)c(F)c1)[N@@H+](C)Cc1ccccc1Cl ZINC000497591320 262178216 /nfs/dbraw/zinc/17/82/16/262178216.db2.gz YLBODVWBUJNQPU-NSHDSACASA-N 1 1 295.760 4.811 20 0 CJADMO C[C@@H](c1ccc(F)c(F)c1)[N@H+](C)Cc1ccccc1Cl ZINC000497591320 262178215 /nfs/dbraw/zinc/17/82/15/262178215.db2.gz YLBODVWBUJNQPU-NSHDSACASA-N 1 1 295.760 4.811 20 0 CJADMO C[C@@H](c1cccs1)[N@@H+](C)Cc1ccc(OC(F)F)cc1 ZINC000497599321 262179548 /nfs/dbraw/zinc/17/95/48/262179548.db2.gz AKJHUEVSVPTPLW-NSHDSACASA-N 1 1 297.370 4.543 20 0 CJADMO C[C@@H](c1ccc(Cl)cc1)[N@H+]1CCC[C@H](C(F)(F)F)C1 ZINC000497599752 262179661 /nfs/dbraw/zinc/17/96/61/262179661.db2.gz KUKXZYZXUMTVPK-JQWIXIFHSA-N 1 1 291.744 4.675 20 0 CJADMO C[C@H](c1ccc(Cl)cc1)[N@H+]1CCC[C@H](C(F)(F)F)C1 ZINC000497599753 262179475 /nfs/dbraw/zinc/17/94/75/262179475.db2.gz KUKXZYZXUMTVPK-PWSUYJOCSA-N 1 1 291.744 4.675 20 0 CJADMO C[C@@H]([NH2+]Cc1c(F)cccc1F)c1ccc2ccccc2c1 ZINC000497694121 262191249 /nfs/dbraw/zinc/19/12/49/262191249.db2.gz RCLMKQDRCGMTEL-CYBMUJFWSA-N 1 1 297.348 4.969 20 0 CJADMO C[C@H]([NH2+]Cc1c(F)cccc1F)c1ccc2ccccc2c1 ZINC000497694122 262191305 /nfs/dbraw/zinc/19/13/05/262191305.db2.gz RCLMKQDRCGMTEL-ZDUSSCGKSA-N 1 1 297.348 4.969 20 0 CJADMO c1c[nH]c([C@@H]2CCC[N@@H+]2Cc2cc3ccccc3s2)c1 ZINC000497754503 262201801 /nfs/dbraw/zinc/20/18/01/262201801.db2.gz XNILGOGQAYBYCV-INIZCTEOSA-N 1 1 282.412 4.567 20 0 CJADMO c1c[nH]c([C@H]2CCC[N@@H+]2Cc2cc3ccccc3s2)c1 ZINC000497754504 262201614 /nfs/dbraw/zinc/20/16/14/262201614.db2.gz XNILGOGQAYBYCV-MRXNPFEDSA-N 1 1 282.412 4.567 20 0 CJADMO CCCCc1nc(C[N@@H+](C)C2CCCCCC2)cs1 ZINC000497998861 262244549 /nfs/dbraw/zinc/24/45/49/262244549.db2.gz WZBPSQGLATYHHJ-UHFFFAOYSA-N 1 1 280.481 4.640 20 0 CJADMO Cc1cc(C[NH2+][C@@H](c2cc3ccccc3o2)C(C)(C)C)on1 ZINC000498432507 331816221 /nfs/dbraw/zinc/81/62/21/331816221.db2.gz DVYDNBWMNIAGSL-KRWDZBQOSA-N 1 1 298.386 4.606 20 0 CJADMO Cc1cc(C[NH2+][C@H](c2cc3ccccc3o2)C(C)(C)C)on1 ZINC000498432508 331816165 /nfs/dbraw/zinc/81/61/65/331816165.db2.gz DVYDNBWMNIAGSL-QGZVFWFLSA-N 1 1 298.386 4.606 20 0 CJADMO Cc1cc[nH+]c(NC2c3ccccc3-c3ccccc32)c1 ZINC000498755125 332572477 /nfs/dbraw/zinc/57/24/77/332572477.db2.gz LYAOLWODWWRCSX-UHFFFAOYSA-N 1 1 272.351 4.572 20 0 CJADMO C[C@H]([NH2+]Cc1ccc(F)cc1Cl)c1cccc(F)c1F ZINC000500249024 332603867 /nfs/dbraw/zinc/60/38/67/332603867.db2.gz IOPHPKAFBBGERB-VIFPVBQESA-N 1 1 299.723 4.608 20 0 CJADMO C[C@@H]1C[C@@]1([NH2+]Cc1ccc(Cl)o1)c1ccc(Cl)cc1 ZINC000500415001 332607886 /nfs/dbraw/zinc/60/78/86/332607886.db2.gz ISOPGHKTTUIOMO-BMIGLBTASA-N 1 1 296.197 4.611 20 0 CJADMO Cc1cc([C@H](C)[NH2+]Cc2ccc(-c3ccccc3)cc2)no1 ZINC000500550515 332612953 /nfs/dbraw/zinc/61/29/53/332612953.db2.gz ZFLUVKFAPDBZDM-HNNXBMFYSA-N 1 1 292.382 4.501 20 0 CJADMO Cc1[nH+]ccn1CCCCSCc1ccc(C)c(C)c1 ZINC000502118561 332649123 /nfs/dbraw/zinc/64/91/23/332649123.db2.gz KFHAPXDWUUZPRC-UHFFFAOYSA-N 1 1 288.460 4.522 20 0 CJADMO Cc1cc([C@@H](C)[NH2+]C2(c3cccc(Cl)c3)CC2)oc1C ZINC000502364553 332654943 /nfs/dbraw/zinc/65/49/43/332654943.db2.gz GVKIZAXWUKMFSQ-GFCCVEGCSA-N 1 1 289.806 4.890 20 0 CJADMO Cc1cc([C@H](C)[NH2+]C2(c3cccc(Cl)c3)CC2)oc1C ZINC000502364554 332654958 /nfs/dbraw/zinc/65/49/58/332654958.db2.gz GVKIZAXWUKMFSQ-LBPRGKRZSA-N 1 1 289.806 4.890 20 0 CJADMO Cc1cc([C@@H](C)[NH2+][C@H](C)c2cccc(F)c2F)oc1C ZINC000502366234 332654970 /nfs/dbraw/zinc/65/49/70/332654970.db2.gz NTUDIKHMTMGVEB-GHMZBOCLSA-N 1 1 279.330 4.586 20 0 CJADMO Cc1cc([C@H](C)[NH2+][C@H](C)c2cccc(F)c2F)oc1C ZINC000502366235 332655061 /nfs/dbraw/zinc/65/50/61/332655061.db2.gz NTUDIKHMTMGVEB-MNOVXSKESA-N 1 1 279.330 4.586 20 0 CJADMO Cc1cc([C@H](C)[NH2+][C@@H](C)c2cccc(F)c2F)oc1C ZINC000502366236 332654951 /nfs/dbraw/zinc/65/49/51/332654951.db2.gz NTUDIKHMTMGVEB-QWRGUYRKSA-N 1 1 279.330 4.586 20 0 CJADMO Cc1cc([C@@H](C)[NH2+][C@@H](C)c2cccc(F)c2F)oc1C ZINC000502366237 332655049 /nfs/dbraw/zinc/65/50/49/332655049.db2.gz NTUDIKHMTMGVEB-WDEREUQCSA-N 1 1 279.330 4.586 20 0 CJADMO Cc1cc([C@@H](C)[NH2+][C@H](C)c2ccc(F)cc2F)oc1C ZINC000502393788 332656242 /nfs/dbraw/zinc/65/62/42/332656242.db2.gz QUTWHZCCURNZDO-GHMZBOCLSA-N 1 1 279.330 4.586 20 0 CJADMO Cc1cc([C@@H](C)[NH2+][C@@H](C)c2ccc(F)cc2F)oc1C ZINC000502393791 332656192 /nfs/dbraw/zinc/65/61/92/332656192.db2.gz QUTWHZCCURNZDO-WDEREUQCSA-N 1 1 279.330 4.586 20 0 CJADMO CSc1ccc(F)cc1C[NH2+][C@H](C)c1cc(C)c(C)o1 ZINC000502404741 332657010 /nfs/dbraw/zinc/65/70/10/332657010.db2.gz KGSJAEHKTVMUGL-LLVKDONJSA-N 1 1 293.407 4.608 20 0 CJADMO CSc1ccc(F)cc1C[NH2+][C@@H](C)c1cc(C)c(C)o1 ZINC000502404742 332657033 /nfs/dbraw/zinc/65/70/33/332657033.db2.gz KGSJAEHKTVMUGL-NSHDSACASA-N 1 1 293.407 4.608 20 0 CJADMO Cc1cc([C@H](C)[NH2+]Cc2ccccc2OC2CCC2)oc1C ZINC000502412121 332657864 /nfs/dbraw/zinc/65/78/64/332657864.db2.gz DFILZSGSGAKYQC-AWEZNQCLSA-N 1 1 299.414 4.679 20 0 CJADMO Cc1cc([C@@H](C)[NH2+]Cc2ccccc2OC2CCC2)oc1C ZINC000502412122 332657869 /nfs/dbraw/zinc/65/78/69/332657869.db2.gz DFILZSGSGAKYQC-CQSZACIVSA-N 1 1 299.414 4.679 20 0 CJADMO CC[C@H]([NH2+][C@H](C)c1cc(C)c(C)o1)c1cc(F)ccc1F ZINC000502414515 332658039 /nfs/dbraw/zinc/65/80/39/332658039.db2.gz KLGSGUDTPXDPHB-BZNIZROVSA-N 1 1 293.357 4.977 20 0 CJADMO CC[C@@H]([NH2+][C@@H](C)c1cc(C)c(C)o1)c1cc(F)ccc1F ZINC000502414516 332658059 /nfs/dbraw/zinc/65/80/59/332658059.db2.gz KLGSGUDTPXDPHB-MEDUHNTESA-N 1 1 293.357 4.977 20 0 CJADMO Cc1cc([C@H](C)[NH2+]Cc2ccc(Cl)cc2F)oc1C ZINC000502430935 332659133 /nfs/dbraw/zinc/65/91/33/332659133.db2.gz WMLNMEYGDQKNMB-JTQLQIEISA-N 1 1 281.758 4.540 20 0 CJADMO Cc1cc([C@@H](C)[NH2+]Cc2ccc(Cl)cc2F)oc1C ZINC000502430936 332659039 /nfs/dbraw/zinc/65/90/39/332659039.db2.gz WMLNMEYGDQKNMB-SNVBAGLBSA-N 1 1 281.758 4.540 20 0 CJADMO CC[C@@H]([NH2+][C@H](C)c1cc(C)c(C)o1)c1ccc(F)cc1F ZINC000502433408 332659340 /nfs/dbraw/zinc/65/93/40/332659340.db2.gz WIBBLXJJHSDTKZ-BDJLRTHQSA-N 1 1 293.357 4.977 20 0 CJADMO CC[C@@H]([NH2+][C@@H](C)c1cc(C)c(C)o1)c1ccc(F)cc1F ZINC000502433410 332659293 /nfs/dbraw/zinc/65/92/93/332659293.db2.gz WIBBLXJJHSDTKZ-MEDUHNTESA-N 1 1 293.357 4.977 20 0 CJADMO CC[C@H]([NH2+][C@@H](C)c1cc(C)c(C)o1)c1ccc(F)cc1F ZINC000502433411 332659331 /nfs/dbraw/zinc/65/93/31/332659331.db2.gz WIBBLXJJHSDTKZ-ZBEGNZNMSA-N 1 1 293.357 4.977 20 0 CJADMO Cc1cc([C@H](C)[NH2+][C@H](C)c2ccccc2Cl)oc1C ZINC000502453628 332660795 /nfs/dbraw/zinc/66/07/95/332660795.db2.gz KXRZHHXDHZCOCM-NEPJUHHUSA-N 1 1 277.795 4.962 20 0 CJADMO Cc1cc([C@@H](C)[NH2+][C@H](C)c2ccccc2Cl)oc1C ZINC000502453629 332660805 /nfs/dbraw/zinc/66/08/05/332660805.db2.gz KXRZHHXDHZCOCM-VXGBXAGGSA-N 1 1 277.795 4.962 20 0 CJADMO C[N@@H+](Cc1ccoc1)Cc1ccc(-c2ccccc2)cc1 ZINC000502669187 262225320 /nfs/dbraw/zinc/22/53/20/262225320.db2.gz VOLXCYAZEFZRKD-UHFFFAOYSA-N 1 1 277.367 4.579 20 0 CJADMO Cc1cc([C@H](C)[NH2+]Cc2oc3ccccc3c2C)oc1C ZINC000502725047 332671537 /nfs/dbraw/zinc/67/15/37/332671537.db2.gz WLDIGELOOAHRJR-ZDUSSCGKSA-N 1 1 283.371 4.802 20 0 CJADMO Cc1ccc2ccccc2c1Cn1cc[nH+]c1C(C)C ZINC000502850126 332674035 /nfs/dbraw/zinc/67/40/35/332674035.db2.gz ZSXJECTUDDGBDS-UHFFFAOYSA-N 1 1 264.372 4.516 20 0 CJADMO Cc1cc([C@H](C)[NH2+]Cc2ccc(C3CCCCC3)cc2)no1 ZINC000503269942 332685263 /nfs/dbraw/zinc/68/52/63/332685263.db2.gz RABLRHSYRHZTCB-HNNXBMFYSA-N 1 1 298.430 4.882 20 0 CJADMO Cc1cc([C@@H](C)[NH2+]Cc2ccc(C3CCCCC3)cc2)no1 ZINC000503269944 332685273 /nfs/dbraw/zinc/68/52/73/332685273.db2.gz RABLRHSYRHZTCB-OAHLLOKOSA-N 1 1 298.430 4.882 20 0 CJADMO Cc1occc1C[NH2+]Cc1ccc(-c2ccccc2)cc1F ZINC000503556392 332691901 /nfs/dbraw/zinc/69/19/01/332691901.db2.gz COHRZBBRVNJOLK-UHFFFAOYSA-N 1 1 295.357 4.684 20 0 CJADMO C[C@H]([NH2+]Cc1ccc(-c2ccccc2)cc1F)c1ccco1 ZINC000503586459 332693446 /nfs/dbraw/zinc/69/34/46/332693446.db2.gz KXKLSGUPNWBHBM-AWEZNQCLSA-N 1 1 295.357 4.937 20 0 CJADMO C[C@@H]([NH2+]Cc1ccc(-c2ccccc2)cc1F)c1ccco1 ZINC000503586460 332693566 /nfs/dbraw/zinc/69/35/66/332693566.db2.gz KXKLSGUPNWBHBM-CQSZACIVSA-N 1 1 295.357 4.937 20 0 CJADMO CCSc1ccc([C@@H](C)[NH2+][C@@H](C)c2cc(C)on2)cc1 ZINC000503873824 332697192 /nfs/dbraw/zinc/69/71/92/332697192.db2.gz PVUTYZONBLGZRM-OLZOCXBDSA-N 1 1 290.432 4.507 20 0 CJADMO CCSc1ccc([C@H](C)[NH2+][C@@H](C)c2cc(C)on2)cc1 ZINC000503873828 262181009 /nfs/dbraw/zinc/18/10/09/262181009.db2.gz PVUTYZONBLGZRM-STQMWFEESA-N 1 1 290.432 4.507 20 0 CJADMO CC[C@@H](SCCn1cc[nH+]c1C)c1ccc(Cl)cc1 ZINC000503923983 332699334 /nfs/dbraw/zinc/69/93/34/332699334.db2.gz JFFZPYZGAQCPIG-OAHLLOKOSA-N 1 1 294.851 4.729 20 0 CJADMO Cc1[nH+]ccn1CCS[C@@H](C)c1ccc2ccccc2c1 ZINC000503939767 332700199 /nfs/dbraw/zinc/70/01/99/332700199.db2.gz FFWDDWRCARNCIM-AWEZNQCLSA-N 1 1 296.439 4.839 20 0 CJADMO Cc1[nH+]ccn1CCS[C@H](C)c1ccc2ccccc2c1 ZINC000503939768 332700146 /nfs/dbraw/zinc/70/01/46/332700146.db2.gz FFWDDWRCARNCIM-CQSZACIVSA-N 1 1 296.439 4.839 20 0 CJADMO C[C@@H]([NH2+]Cc1c(F)cccc1F)c1ccc(F)c(Cl)c1 ZINC000505463364 332741550 /nfs/dbraw/zinc/74/15/50/332741550.db2.gz ARWFNOKAXASFTC-SECBINFHSA-N 1 1 299.723 4.608 20 0 CJADMO C[C@H]([NH2+]Cc1c(F)cccc1F)c1ccc(F)c(Cl)c1 ZINC000505463365 332741362 /nfs/dbraw/zinc/74/13/62/332741362.db2.gz ARWFNOKAXASFTC-VIFPVBQESA-N 1 1 299.723 4.608 20 0 CJADMO CC(C)([NH2+]Cc1c(F)cccc1F)c1cccc(Cl)c1 ZINC000505464747 332741500 /nfs/dbraw/zinc/74/15/00/332741500.db2.gz NVYJLSHWUCQNIE-UHFFFAOYSA-N 1 1 295.760 4.643 20 0 CJADMO C[C@@H](Cc1[nH]cc[nH+]1)OCc1ccc(C2CCCCC2)cc1 ZINC000506396285 332772154 /nfs/dbraw/zinc/77/21/54/332772154.db2.gz JRJUWVHPVMLSSV-HNNXBMFYSA-N 1 1 298.430 4.605 20 0 CJADMO CSc1cccc(F)c1C[NH2+][C@H](C)c1ccccc1F ZINC000506616675 332775269 /nfs/dbraw/zinc/77/52/69/332775269.db2.gz MSZUZAPSFNGWCU-LLVKDONJSA-N 1 1 293.382 4.538 20 0 CJADMO CSc1cccc(F)c1C[NH2+][C@@H](C)c1ccccc1F ZINC000506616676 332775197 /nfs/dbraw/zinc/77/51/97/332775197.db2.gz MSZUZAPSFNGWCU-NSHDSACASA-N 1 1 293.382 4.538 20 0 CJADMO COc1cccc([C@@H](C)[N@@H+](C)Cc2ccc(Cl)s2)c1 ZINC000507190623 267905335 /nfs/dbraw/zinc/90/53/35/267905335.db2.gz DYBMTDOPCMSEPW-LLVKDONJSA-N 1 1 295.835 4.603 20 0 CJADMO CCCCc1nc(C[NH2+]C(C)(C)c2ccccc2)cs1 ZINC000507315513 332802550 /nfs/dbraw/zinc/80/25/50/332802550.db2.gz KAOATABZWSKYEY-UHFFFAOYSA-N 1 1 288.460 4.511 20 0 CJADMO Cc1cc(N[C@@H](C)c2ccco2)c[nH+]c1N1CCCC[C@H]1C ZINC000507397708 332804055 /nfs/dbraw/zinc/80/40/55/332804055.db2.gz GTVDRJUBJXLMOU-CABCVRRESA-N 1 1 299.418 4.535 20 0 CJADMO Cc1cc(N[C@@H](C)c2ccco2)c[nH+]c1N1CCCC[C@@H]1C ZINC000507397713 332804043 /nfs/dbraw/zinc/80/40/43/332804043.db2.gz GTVDRJUBJXLMOU-GJZGRUSLSA-N 1 1 299.418 4.535 20 0 CJADMO Cc1cc(N[C@H](C)c2ccco2)c[nH+]c1N1CCCC[C@H]1C ZINC000507397714 332803961 /nfs/dbraw/zinc/80/39/61/332803961.db2.gz GTVDRJUBJXLMOU-HUUCEWRRSA-N 1 1 299.418 4.535 20 0 CJADMO C[C@H]([NH2+]Cc1ccc(C2CCCCC2)cc1)c1ccon1 ZINC000509622708 332875491 /nfs/dbraw/zinc/87/54/91/332875491.db2.gz PJJXZTKPYAKRCB-AWEZNQCLSA-N 1 1 284.403 4.573 20 0 CJADMO Cc1ccc2cc([C@@H](C)[NH2+][C@H](C)c3ccncc3F)oc2c1 ZINC000511019945 332924503 /nfs/dbraw/zinc/92/45/03/332924503.db2.gz UXJOSKUZQNGKOX-CHWSQXEVSA-N 1 1 298.361 4.687 20 0 CJADMO Cc1ccc2cc([C@H](C)[NH2+][C@H](C)c3ccncc3F)oc2c1 ZINC000511019947 332924575 /nfs/dbraw/zinc/92/45/75/332924575.db2.gz UXJOSKUZQNGKOX-OLZOCXBDSA-N 1 1 298.361 4.687 20 0 CJADMO Cc1ccc2cc([C@H](C)[NH2+][C@@H](C)c3ccncc3F)oc2c1 ZINC000511019951 332924561 /nfs/dbraw/zinc/92/45/61/332924561.db2.gz UXJOSKUZQNGKOX-STQMWFEESA-N 1 1 298.361 4.687 20 0 CJADMO C[C@H]([NH2+]Cc1ccc2occc2c1)c1c(F)cccc1F ZINC000512108173 332953869 /nfs/dbraw/zinc/95/38/69/332953869.db2.gz SJFMRVIDSVWAEL-NSHDSACASA-N 1 1 287.309 4.562 20 0 CJADMO C[N@@H+](CCC(F)(F)F)[C@H]1CCCC[C@@H]1c1ccccc1 ZINC000513219457 333009312 /nfs/dbraw/zinc/00/93/12/333009312.db2.gz RWDDACWDNQEHFJ-CABCVRRESA-N 1 1 285.353 4.597 20 0 CJADMO C[N@@H+](CCC(F)(F)F)[C@H]1CCCC[C@H]1c1ccccc1 ZINC000513219459 333009446 /nfs/dbraw/zinc/00/94/46/333009446.db2.gz RWDDACWDNQEHFJ-GJZGRUSLSA-N 1 1 285.353 4.597 20 0 CJADMO C[N@@H+](CCC(F)(F)F)[C@@H]1CCCC[C@@H]1c1ccccc1 ZINC000513219461 333009210 /nfs/dbraw/zinc/00/92/10/333009210.db2.gz RWDDACWDNQEHFJ-HUUCEWRRSA-N 1 1 285.353 4.597 20 0 CJADMO C[N@@H+](CCC(F)(F)F)[C@@H]1CCCC[C@H]1c1ccccc1 ZINC000513219462 333009361 /nfs/dbraw/zinc/00/93/61/333009361.db2.gz RWDDACWDNQEHFJ-LSDHHAIUSA-N 1 1 285.353 4.597 20 0 CJADMO CCCC[N@@H+](Cc1cncs1)Cc1ccccc1Cl ZINC000513291031 333012653 /nfs/dbraw/zinc/01/26/53/333012653.db2.gz FPKHDPHRCJXWEH-UHFFFAOYSA-N 1 1 294.851 4.599 20 0 CJADMO CCCC[N@H+](Cc1cncs1)Cc1ccccc1Cl ZINC000513291031 333012651 /nfs/dbraw/zinc/01/26/51/333012651.db2.gz FPKHDPHRCJXWEH-UHFFFAOYSA-N 1 1 294.851 4.599 20 0 CJADMO COc1ccc(C[N@@H+](C)[C@H](C)c2cccs2)cc1Cl ZINC000513311914 333013484 /nfs/dbraw/zinc/01/34/84/333013484.db2.gz XIZRUMCGJFKFRQ-LLVKDONJSA-N 1 1 295.835 4.603 20 0 CJADMO COc1ccc(C[N@@H+](C)[C@@H](C)c2cccs2)cc1Cl ZINC000513311915 333013461 /nfs/dbraw/zinc/01/34/61/333013461.db2.gz XIZRUMCGJFKFRQ-NSHDSACASA-N 1 1 295.835 4.603 20 0 CJADMO COCc1ccccc1/C=C(\C)C[N@@H+](CC1CC1)C1CCC1 ZINC000513401304 333017377 /nfs/dbraw/zinc/01/73/77/333017377.db2.gz LDBCIWZGMDGASA-FOWTUZBSSA-N 1 1 299.458 4.501 20 0 CJADMO COCc1ccccc1/C=C(/C)C[N@@H+](CC1CC1)C1CCC1 ZINC000513401306 333017418 /nfs/dbraw/zinc/01/74/18/333017418.db2.gz LDBCIWZGMDGASA-VBKFSLOCSA-N 1 1 299.458 4.501 20 0 CJADMO Cc1ccc(C[N@H+](C)Cc2cc(C)nc3ccccc23)s1 ZINC000513440641 333019501 /nfs/dbraw/zinc/01/95/01/333019501.db2.gz WLIPGNYBILYWBH-UHFFFAOYSA-N 1 1 296.439 4.545 20 0 CJADMO Cc1ccc([C@H]2CCC[N@H+]2Cc2ccc(Cl)o2)s1 ZINC000513472190 333021448 /nfs/dbraw/zinc/02/14/48/333021448.db2.gz ACICQVSNDQNZKX-GFCCVEGCSA-N 1 1 281.808 4.640 20 0 CJADMO Cc1ccc([C@@H]2CCC[N@H+]2Cc2ccc(Cl)o2)s1 ZINC000513472191 333021510 /nfs/dbraw/zinc/02/15/10/333021510.db2.gz ACICQVSNDQNZKX-LBPRGKRZSA-N 1 1 281.808 4.640 20 0 CJADMO Fc1ccccc1C[N@@H+](Cc1cccnc1)C1CCCCC1 ZINC000513479212 333021963 /nfs/dbraw/zinc/02/19/63/333021963.db2.gz IZMHPHUVPXAHHH-UHFFFAOYSA-N 1 1 298.405 4.556 20 0 CJADMO Fc1ccccc1C[N@@H+](Cc1ccncc1)C1CCCCC1 ZINC000513486009 333022123 /nfs/dbraw/zinc/02/21/23/333022123.db2.gz VKWQWCNHPLQZSR-UHFFFAOYSA-N 1 1 298.405 4.556 20 0 CJADMO Fc1ccccc1C[N@@H+](Cc1ccccn1)C1CCCCC1 ZINC000513486206 333022127 /nfs/dbraw/zinc/02/21/27/333022127.db2.gz WVPYIJUXLXAEFV-UHFFFAOYSA-N 1 1 298.405 4.556 20 0 CJADMO Clc1ccc(Cl)c(C[NH2+]C2(c3ccccc3)CC2)c1 ZINC000513502404 333023306 /nfs/dbraw/zinc/02/33/06/333023306.db2.gz ZMOQCCQHPKAGFJ-UHFFFAOYSA-N 1 1 292.209 4.772 20 0 CJADMO Cc1ccc[nH+]c1NCc1ccc(-c2ccccc2Cl)o1 ZINC000513556059 333025051 /nfs/dbraw/zinc/02/50/51/333025051.db2.gz BIKSMOYDMPORDN-UHFFFAOYSA-N 1 1 298.773 4.916 20 0 CJADMO Cc1ccc[nH+]c1NCc1ccc(-c2ccccc2)s1 ZINC000513556644 333025054 /nfs/dbraw/zinc/02/50/54/333025054.db2.gz LQNXBYXCTKGLDB-UHFFFAOYSA-N 1 1 280.396 4.731 20 0 CJADMO Cc1ccc[nH+]c1NCc1ccc(-c2ccccc2F)s1 ZINC000513561868 333025297 /nfs/dbraw/zinc/02/52/97/333025297.db2.gz AXFSTUMHUCPATF-UHFFFAOYSA-N 1 1 298.386 4.870 20 0 CJADMO Cc1ccc(-c2ccc(CNc3[nH+]cccc3C)o2)cc1 ZINC000513563355 333025338 /nfs/dbraw/zinc/02/53/38/333025338.db2.gz RXNUEKQDYMPCNO-UHFFFAOYSA-N 1 1 278.355 4.571 20 0 CJADMO Cc1ccc[nH+]c1NCc1ccc(-c2ccc(F)cc2)s1 ZINC000513563749 333025208 /nfs/dbraw/zinc/02/52/08/333025208.db2.gz VSCVEENKGPYKEP-UHFFFAOYSA-N 1 1 298.386 4.870 20 0 CJADMO Fc1ccc(C[NH2+]Cc2ccc(-c3ccccc3)o2)c(F)c1 ZINC000513622699 333027317 /nfs/dbraw/zinc/02/73/17/333027317.db2.gz XEGWINSYQCCTIA-UHFFFAOYSA-N 1 1 299.320 4.515 20 0 CJADMO Cc1nocc1C[N@H+](CC(C)C)[C@@H](C)c1ccccc1C ZINC000513628176 333027592 /nfs/dbraw/zinc/02/75/92/333027592.db2.gz GCYHZMVSICCXRK-INIZCTEOSA-N 1 1 286.419 4.511 20 0 CJADMO Cc1nocc1C[N@H+](CC(C)C)[C@H](C)c1ccccc1C ZINC000513628177 333027452 /nfs/dbraw/zinc/02/74/52/333027452.db2.gz GCYHZMVSICCXRK-MRXNPFEDSA-N 1 1 286.419 4.511 20 0 CJADMO CN(Cc1cccs1)c1cc[nH+]c2ccc(Cl)cc21 ZINC000513641171 333028465 /nfs/dbraw/zinc/02/84/65/333028465.db2.gz WYTSAYHNTUNIBO-UHFFFAOYSA-N 1 1 288.803 4.586 20 0 CJADMO c1ccc2c(c1)cccc2[C@@H]1CCC[N@@H+]1C[C@@H]1CCCCO1 ZINC000513673450 333031389 /nfs/dbraw/zinc/03/13/89/333031389.db2.gz RHSGDYSPMMUFMS-PXNSSMCTSA-N 1 1 295.426 4.546 20 0 CJADMO c1ccc2c(c1)cccc2[C@@H]1CCC[N@@H+]1C[C@H]1CCCCO1 ZINC000513673451 333031405 /nfs/dbraw/zinc/03/14/05/333031405.db2.gz RHSGDYSPMMUFMS-XLIONFOSSA-N 1 1 295.426 4.546 20 0 CJADMO c1ccc2c(c1)cccc2[C@H]1CCC[N@@H+]1C[C@H]1CCCCO1 ZINC000513673452 333031420 /nfs/dbraw/zinc/03/14/20/333031420.db2.gz RHSGDYSPMMUFMS-YLJYHZDGSA-N 1 1 295.426 4.546 20 0 CJADMO c1c[nH]c([C@@H]2CCC[N@@H+]2Cc2csc3ccccc23)c1 ZINC000513698151 333033480 /nfs/dbraw/zinc/03/34/80/333033480.db2.gz XFGLNPFPICSLIB-INIZCTEOSA-N 1 1 282.412 4.567 20 0 CJADMO c1c[nH]c([C@H]2CCC[N@@H+]2Cc2csc3ccccc23)c1 ZINC000513698152 333033457 /nfs/dbraw/zinc/03/34/57/333033457.db2.gz XFGLNPFPICSLIB-MRXNPFEDSA-N 1 1 282.412 4.567 20 0 CJADMO C[N@@H+](Cc1ccsc1)Cc1csc2ccccc12 ZINC000513785508 333039055 /nfs/dbraw/zinc/03/90/55/333039055.db2.gz NUFFJDWYZKGWLF-UHFFFAOYSA-N 1 1 273.426 4.595 20 0 CJADMO C[N@@H+](Cc1cccs1)Cc1csc2ccccc12 ZINC000513786902 333039314 /nfs/dbraw/zinc/03/93/14/333039314.db2.gz OYQOBJDNRQDQQJ-UHFFFAOYSA-N 1 1 273.426 4.595 20 0 CJADMO FC(F)(F)[C@@H]1CCC[N@@H+](Cc2csc3ccccc23)C1 ZINC000513789647 333039490 /nfs/dbraw/zinc/03/94/90/333039490.db2.gz LPQYGLQMAVSTLP-GFCCVEGCSA-N 1 1 299.361 4.676 20 0 CJADMO FC(F)(F)[C@H]1CCC[N@@H+](Cc2csc3ccccc23)C1 ZINC000513789648 333039370 /nfs/dbraw/zinc/03/93/70/333039370.db2.gz LPQYGLQMAVSTLP-LBPRGKRZSA-N 1 1 299.361 4.676 20 0 CJADMO C[C@H](c1ccco1)[N@@H+](C)Cc1csc2ccccc12 ZINC000513821300 333041168 /nfs/dbraw/zinc/04/11/68/333041168.db2.gz GMRSIBHCQRZWAY-GFCCVEGCSA-N 1 1 271.385 4.687 20 0 CJADMO C[C@@H](c1ccco1)[N@@H+](C)Cc1csc2ccccc12 ZINC000513821301 333041084 /nfs/dbraw/zinc/04/10/84/333041084.db2.gz GMRSIBHCQRZWAY-LBPRGKRZSA-N 1 1 271.385 4.687 20 0 CJADMO C[C@H](c1cccs1)[N@@H+](C)C[C@H]1CCCC(F)(F)C1 ZINC000513880778 333046273 /nfs/dbraw/zinc/04/62/73/333046273.db2.gz DKPYDNUASDRKTG-NEPJUHHUSA-N 1 1 273.392 4.566 20 0 CJADMO C[C@@H](c1cccs1)[N@@H+](C)C[C@@H]1CCCC(F)(F)C1 ZINC000513880779 333046100 /nfs/dbraw/zinc/04/61/00/333046100.db2.gz DKPYDNUASDRKTG-NWDGAFQWSA-N 1 1 273.392 4.566 20 0 CJADMO C[C@@H](c1cccs1)[N@@H+](C)C[C@H]1CCCC(F)(F)C1 ZINC000513880780 333046219 /nfs/dbraw/zinc/04/62/19/333046219.db2.gz DKPYDNUASDRKTG-RYUDHWBXSA-N 1 1 273.392 4.566 20 0 CJADMO C[C@H](c1cccs1)[N@@H+](C)C[C@@H]1CCCC(F)(F)C1 ZINC000513880781 333046142 /nfs/dbraw/zinc/04/61/42/333046142.db2.gz DKPYDNUASDRKTG-VXGBXAGGSA-N 1 1 273.392 4.566 20 0 CJADMO C[N@@H+](Cc1ccoc1)C(c1ccccc1)c1ccccc1 ZINC000513901795 333049161 /nfs/dbraw/zinc/04/91/61/333049161.db2.gz ANQSLGLZJPTHOW-UHFFFAOYSA-N 1 1 277.367 4.501 20 0 CJADMO CC(C)[N@H+](Cc1cccs1)C[C@@H]1CCCC(F)(F)C1 ZINC000513903175 333049690 /nfs/dbraw/zinc/04/96/90/333049690.db2.gz BCZRZEJOAVVPFK-CYBMUJFWSA-N 1 1 287.419 4.784 20 0 CJADMO CC(C)[N@H+](Cc1cccs1)C[C@H]1CCCC(F)(F)C1 ZINC000513903176 333049715 /nfs/dbraw/zinc/04/97/15/333049715.db2.gz BCZRZEJOAVVPFK-ZDUSSCGKSA-N 1 1 287.419 4.784 20 0 CJADMO COc1ccc([C@H](C)[N@@H+](C)C[C@H]2CCCC(F)(F)C2)cc1 ZINC000513959605 333055118 /nfs/dbraw/zinc/05/51/18/333055118.db2.gz QHFHZXCILZZRNA-KBPBESRZSA-N 1 1 297.389 4.514 20 0 CJADMO COc1ccc([C@@H](C)[N@@H+](C)C[C@H]2CCCC(F)(F)C2)cc1 ZINC000513959606 333055059 /nfs/dbraw/zinc/05/50/59/333055059.db2.gz QHFHZXCILZZRNA-KGLIPLIRSA-N 1 1 297.389 4.514 20 0 CJADMO COc1ccc([C@H](C)[N@@H+](C)C[C@@H]2CCCC(F)(F)C2)cc1 ZINC000513959607 333055052 /nfs/dbraw/zinc/05/50/52/333055052.db2.gz QHFHZXCILZZRNA-UONOGXRCSA-N 1 1 297.389 4.514 20 0 CJADMO COc1ccc([C@@H](C)[N@@H+](C)C[C@@H]2CCCC(F)(F)C2)cc1 ZINC000513959608 333055073 /nfs/dbraw/zinc/05/50/73/333055073.db2.gz QHFHZXCILZZRNA-ZIAGYGMSSA-N 1 1 297.389 4.514 20 0 CJADMO C[C@H](c1ccc(F)cc1)[N@@H+](C)C[C@@H]1CCCC(F)(F)C1 ZINC000513960305 333055121 /nfs/dbraw/zinc/05/51/21/333055121.db2.gz FNFWHBZEGWMHGN-CHWSQXEVSA-N 1 1 285.353 4.644 20 0 CJADMO C[C@H](c1ccc(F)cc1)[N@@H+](C)C[C@H]1CCCC(F)(F)C1 ZINC000513960306 333054987 /nfs/dbraw/zinc/05/49/87/333054987.db2.gz FNFWHBZEGWMHGN-OLZOCXBDSA-N 1 1 285.353 4.644 20 0 CJADMO C[C@@H](c1ccc(F)cc1)[N@@H+](C)C[C@@H]1CCCC(F)(F)C1 ZINC000513960307 333055079 /nfs/dbraw/zinc/05/50/79/333055079.db2.gz FNFWHBZEGWMHGN-QWHCGFSZSA-N 1 1 285.353 4.644 20 0 CJADMO C[C@@H](c1ccc(F)cc1)[N@@H+](C)C[C@H]1CCCC(F)(F)C1 ZINC000513960308 333055176 /nfs/dbraw/zinc/05/51/76/333055176.db2.gz FNFWHBZEGWMHGN-STQMWFEESA-N 1 1 285.353 4.644 20 0 CJADMO C[C@@H](c1ccccc1)[N@@H+](C)C[C@H]1CCCC(F)(F)C1 ZINC000513962780 333055443 /nfs/dbraw/zinc/05/54/43/333055443.db2.gz FMSHOFACRCMAOP-KBPBESRZSA-N 1 1 267.363 4.505 20 0 CJADMO C[C@H](c1ccccc1)[N@@H+](C)C[C@H]1CCCC(F)(F)C1 ZINC000513962781 333055470 /nfs/dbraw/zinc/05/54/70/333055470.db2.gz FMSHOFACRCMAOP-KGLIPLIRSA-N 1 1 267.363 4.505 20 0 CJADMO C[C@@H](c1ccccc1)[N@@H+](C)C[C@@H]1CCCC(F)(F)C1 ZINC000513962782 333055567 /nfs/dbraw/zinc/05/55/67/333055567.db2.gz FMSHOFACRCMAOP-UONOGXRCSA-N 1 1 267.363 4.505 20 0 CJADMO C[C@H](c1ccccc1)[N@@H+](C)C[C@@H]1CCCC(F)(F)C1 ZINC000513962783 333055484 /nfs/dbraw/zinc/05/54/84/333055484.db2.gz FMSHOFACRCMAOP-ZIAGYGMSSA-N 1 1 267.363 4.505 20 0 CJADMO C[N@H+](Cc1ccc(Cl)s1)C[C@H]1CCCC(F)(F)C1 ZINC000513964661 333055858 /nfs/dbraw/zinc/05/58/58/333055858.db2.gz LUWYWSKKSWBQBW-JTQLQIEISA-N 1 1 293.810 4.659 20 0 CJADMO C[N@H+](Cc1ccc(Cl)s1)C[C@@H]1CCCC(F)(F)C1 ZINC000513964662 333055853 /nfs/dbraw/zinc/05/58/53/333055853.db2.gz LUWYWSKKSWBQBW-SNVBAGLBSA-N 1 1 293.810 4.659 20 0 CJADMO FC1(F)CCC[C@@H](C[N@@H+](Cc2cccs2)C2CC2)C1 ZINC000513964862 333055835 /nfs/dbraw/zinc/05/58/35/333055835.db2.gz PIYOPXJBPXAVSU-GFCCVEGCSA-N 1 1 285.403 4.538 20 0 CJADMO FC1(F)CCC[C@H](C[N@@H+](Cc2cccs2)C2CC2)C1 ZINC000513964863 333055723 /nfs/dbraw/zinc/05/57/23/333055723.db2.gz PIYOPXJBPXAVSU-LBPRGKRZSA-N 1 1 285.403 4.538 20 0 CJADMO FC1(F)CCC[C@H](C[N@H+]2CCC[C@@H]2c2ccsc2)C1 ZINC000513965528 333055806 /nfs/dbraw/zinc/05/58/06/333055806.db2.gz AKLQFIKLCWTKPF-GXTWGEPZSA-N 1 1 285.403 4.711 20 0 CJADMO FC1(F)CCC[C@H](C[N@H+]2CCC[C@H]2c2ccsc2)C1 ZINC000513965529 333055698 /nfs/dbraw/zinc/05/56/98/333055698.db2.gz AKLQFIKLCWTKPF-JSGCOSHPSA-N 1 1 285.403 4.711 20 0 CJADMO FC1(F)CCC[C@@H](C[N@H+]2CCC[C@H]2c2ccsc2)C1 ZINC000513965530 333055868 /nfs/dbraw/zinc/05/58/68/333055868.db2.gz AKLQFIKLCWTKPF-OCCSQVGLSA-N 1 1 285.403 4.711 20 0 CJADMO FC1(F)CCC[C@@H](C[N@H+]2CCC[C@@H]2c2ccsc2)C1 ZINC000513965531 333055802 /nfs/dbraw/zinc/05/58/02/333055802.db2.gz AKLQFIKLCWTKPF-TZMCWYRMSA-N 1 1 285.403 4.711 20 0 CJADMO FC1(F)CCC[C@@H](C[N@H+]2CCC[C@@H]2c2ccccc2)C1 ZINC000513970479 333056638 /nfs/dbraw/zinc/05/66/38/333056638.db2.gz QRVDVXRATYRPMZ-GDBMZVCRSA-N 1 1 279.374 4.649 20 0 CJADMO FC1(F)CCC[C@H](C[N@H+]2CCC[C@@H]2c2ccccc2)C1 ZINC000513970480 333056735 /nfs/dbraw/zinc/05/67/35/333056735.db2.gz QRVDVXRATYRPMZ-GOEBONIOSA-N 1 1 279.374 4.649 20 0 CJADMO FC1(F)CCC[C@H](C[N@H+]2CCC[C@H]2c2ccccc2)C1 ZINC000513970481 333056731 /nfs/dbraw/zinc/05/67/31/333056731.db2.gz QRVDVXRATYRPMZ-HOCLYGCPSA-N 1 1 279.374 4.649 20 0 CJADMO FC1(F)CCC[C@@H](C[N@H+]2CCC[C@H]2c2ccccc2)C1 ZINC000513970482 333056536 /nfs/dbraw/zinc/05/65/36/333056536.db2.gz QRVDVXRATYRPMZ-ZBFHGGJFSA-N 1 1 279.374 4.649 20 0 CJADMO CCCCC[N@@H+](Cc1nc(C(C)(C)C)no1)[C@@H](C)CCC ZINC000514001890 333058841 /nfs/dbraw/zinc/05/88/41/333058841.db2.gz PNXZZLAFRKJXRV-AWEZNQCLSA-N 1 1 295.471 4.548 20 0 CJADMO CCCCC[N@@H+](Cc1noc(C(C)(C)C)n1)[C@@H](C)CCC ZINC000514008193 333060007 /nfs/dbraw/zinc/06/00/07/333060007.db2.gz CRJFOKXWCIKLIU-AWEZNQCLSA-N 1 1 295.471 4.548 20 0 CJADMO CCCCC[N@H+](Cc1noc(C(C)(C)C)n1)[C@@H](C)CCC ZINC000514008193 333060006 /nfs/dbraw/zinc/06/00/06/333060006.db2.gz CRJFOKXWCIKLIU-AWEZNQCLSA-N 1 1 295.471 4.548 20 0 CJADMO C[N@@H+](Cc1ccccc1)Cc1ccc(Cl)c2cccnc12 ZINC000514076785 333065035 /nfs/dbraw/zinc/06/50/35/333065035.db2.gz FBZRBNWKAANWGJ-UHFFFAOYSA-N 1 1 296.801 4.520 20 0 CJADMO C[N@@H+](Cc1ccccc1)Cc1c(Cl)ccc2cccnc21 ZINC000514077624 333065029 /nfs/dbraw/zinc/06/50/29/333065029.db2.gz WADZQHVPXCCNOY-UHFFFAOYSA-N 1 1 296.801 4.520 20 0 CJADMO Cc1csc(C[NH2+][C@@H](C)c2cccc(CC(C)C)c2)n1 ZINC000514088505 262185336 /nfs/dbraw/zinc/18/53/36/262185336.db2.gz LVIRDQRQQFGETN-AWEZNQCLSA-N 1 1 288.460 4.501 20 0 CJADMO Cc1csc(C[NH2+][C@H](C)c2cccc(CC(C)C)c2)n1 ZINC000514088506 262185222 /nfs/dbraw/zinc/18/52/22/262185222.db2.gz LVIRDQRQQFGETN-CQSZACIVSA-N 1 1 288.460 4.501 20 0 CJADMO CC(C)[N@@H+](Cc1cccc(F)c1)Cc1cccc(F)c1F ZINC000514090270 262235260 /nfs/dbraw/zinc/23/52/60/262235260.db2.gz ULZLUKUMAKIXCC-UHFFFAOYSA-N 1 1 293.332 4.515 20 0 CJADMO CC(C)[N@H+](Cc1cccc(F)c1)Cc1cccc(F)c1F ZINC000514090270 262235259 /nfs/dbraw/zinc/23/52/59/262235259.db2.gz ULZLUKUMAKIXCC-UHFFFAOYSA-N 1 1 293.332 4.515 20 0 CJADMO CC(C)c1ncc(C[N@@H+](C)C[C@H](C)c2ccccc2)s1 ZINC000514090857 262242414 /nfs/dbraw/zinc/24/24/14/262242414.db2.gz WSRAXADZDYODCQ-AWEZNQCLSA-N 1 1 288.460 4.502 20 0 CJADMO CC(C)c1ncc(C[N@@H+](C)C[C@@H](C)c2ccccc2)s1 ZINC000514090858 262242402 /nfs/dbraw/zinc/24/24/02/262242402.db2.gz WSRAXADZDYODCQ-CQSZACIVSA-N 1 1 288.460 4.502 20 0 CJADMO C[C@H](c1ccco1)[N@@H+](C[C@@H]1CCCC(F)(F)C1)C1CC1 ZINC000514093244 263266998 /nfs/dbraw/zinc/26/69/98/263266998.db2.gz FJTFPMLQUJPYMT-CHWSQXEVSA-N 1 1 283.362 4.631 20 0 CJADMO C[C@H](c1ccco1)[N@@H+](C[C@H]1CCCC(F)(F)C1)C1CC1 ZINC000514093248 263267298 /nfs/dbraw/zinc/26/72/98/263267298.db2.gz FJTFPMLQUJPYMT-OLZOCXBDSA-N 1 1 283.362 4.631 20 0 CJADMO C[C@@H](c1ccco1)[N@@H+](C[C@@H]1CCCC(F)(F)C1)C1CC1 ZINC000514093250 263267446 /nfs/dbraw/zinc/26/74/46/263267446.db2.gz FJTFPMLQUJPYMT-QWHCGFSZSA-N 1 1 283.362 4.631 20 0 CJADMO C[C@@H](c1ccco1)[N@@H+](C[C@H]1CCCC(F)(F)C1)C1CC1 ZINC000514093251 263268039 /nfs/dbraw/zinc/26/80/39/263268039.db2.gz FJTFPMLQUJPYMT-STQMWFEESA-N 1 1 283.362 4.631 20 0 CJADMO C(=C\c1ccccc1)\C[N@H+]1CCC[C@H]1c1ccccc1 ZINC000514523611 265173520 /nfs/dbraw/zinc/17/35/20/265173520.db2.gz PLLNSXVOOVTBTE-ABMFHFBKSA-N 1 1 263.384 4.537 20 0 CJADMO C(=C/c1ccccc1)\C[N@H+]1CCC[C@@H]1c1ccccc1 ZINC000514523620 265173350 /nfs/dbraw/zinc/17/33/50/265173350.db2.gz PLLNSXVOOVTBTE-BQHJZSHBSA-N 1 1 263.384 4.537 20 0 CJADMO C(=C\c1ccccc1)\C[N@H+]1CCC[C@@H]1c1ccccc1 ZINC000514523621 265173055 /nfs/dbraw/zinc/17/30/55/265173055.db2.gz PLLNSXVOOVTBTE-KOTDBNOLSA-N 1 1 263.384 4.537 20 0 CJADMO C(=C/c1ccccc1)\C[N@H+]1CCC[C@H]1c1ccccc1 ZINC000514523622 265172881 /nfs/dbraw/zinc/17/28/81/265172881.db2.gz PLLNSXVOOVTBTE-SSVWKNEZSA-N 1 1 263.384 4.537 20 0 CJADMO CC[C@H](Nc1cc(C2CC2)cc[nH+]1)c1cccs1 ZINC000515344189 330475544 /nfs/dbraw/zinc/47/55/44/330475544.db2.gz ARZINONNYHRNKS-ZDUSSCGKSA-N 1 1 258.390 4.584 20 0 CJADMO CC[C@H](Nc1cc(C2CC2)cc[nH+]1)c1cccc(F)c1 ZINC000515716992 330481868 /nfs/dbraw/zinc/48/18/68/330481868.db2.gz YBNBUMDMAFWUCS-INIZCTEOSA-N 1 1 270.351 4.661 20 0 CJADMO CC(C)[N@@H+](C/C=C\c1ccccc1)Cc1cccs1 ZINC000516744898 333081625 /nfs/dbraw/zinc/08/16/25/333081625.db2.gz HOPPISCLTDIOSV-POHAHGRESA-N 1 1 271.429 4.672 20 0 CJADMO CC(C)[N@@H+](C/C=C/c1ccccc1)Cc1cccs1 ZINC000516744899 333081668 /nfs/dbraw/zinc/08/16/68/333081668.db2.gz HOPPISCLTDIOSV-UXBLZVDNSA-N 1 1 271.429 4.672 20 0 CJADMO CCc1ccc(C[N@@H+](C)[C@@H](C)c2cc3ccccc3o2)cn1 ZINC000516996376 333089184 /nfs/dbraw/zinc/08/91/84/333089184.db2.gz PPROBZGNUOXDPT-AWEZNQCLSA-N 1 1 294.398 4.583 20 0 CJADMO CCc1ccc(C[N@@H+](C)[C@H](C)c2cc3ccccc3o2)cn1 ZINC000516996377 333089125 /nfs/dbraw/zinc/08/91/25/333089125.db2.gz PPROBZGNUOXDPT-CQSZACIVSA-N 1 1 294.398 4.583 20 0 CJADMO C[C@@H](c1cccc(Cl)c1)[N@H+]1CCC=C(c2cccnc2)C1 ZINC000517227858 333095298 /nfs/dbraw/zinc/09/52/98/333095298.db2.gz AMCWEHZSRBYQIR-AWEZNQCLSA-N 1 1 298.817 4.585 20 0 CJADMO C[C@H](c1cccc(Cl)c1)[N@H+]1CCC=C(c2cccnc2)C1 ZINC000517227859 333095244 /nfs/dbraw/zinc/09/52/44/333095244.db2.gz AMCWEHZSRBYQIR-CQSZACIVSA-N 1 1 298.817 4.585 20 0 CJADMO CSc1ccc(CNc2cccc3cc[nH+]cc32)s1 ZINC000517265098 333096370 /nfs/dbraw/zinc/09/63/70/333096370.db2.gz LDTXLOFOPVYLKN-UHFFFAOYSA-N 1 1 286.425 4.630 20 0 CJADMO CCCCC[N@@H+](Cc1csc(-c2ccoc2)n1)C(C)C ZINC000517468316 333100227 /nfs/dbraw/zinc/10/02/27/333100227.db2.gz HDIMYPDNKYIQID-UHFFFAOYSA-N 1 1 292.448 4.804 20 0 CJADMO Fc1cccc(Oc2ccccc2C[NH2+]Cc2ccco2)c1 ZINC000517558491 333102615 /nfs/dbraw/zinc/10/26/15/333102615.db2.gz DZZAFOYFULIXEU-UHFFFAOYSA-N 1 1 297.329 4.501 20 0 CJADMO CCCCC[N@@H+](Cc1ncc(-c2cccs2)o1)C(C)C ZINC000517570366 333102689 /nfs/dbraw/zinc/10/26/89/333102689.db2.gz SLFYARXOQMHYKW-UHFFFAOYSA-N 1 1 292.448 4.804 20 0 CJADMO CCC(CC)[N@@H+](Cc1ncc(-c2cccs2)o1)C1CC1 ZINC000517573961 333102959 /nfs/dbraw/zinc/10/29/59/333102959.db2.gz DQCFYDRKYAPIGZ-UHFFFAOYSA-N 1 1 290.432 4.556 20 0 CJADMO CC[N@@H+](Cc1ccc(F)cc1)[C@H](C)c1ccc(F)cc1 ZINC000517628047 333104435 /nfs/dbraw/zinc/10/44/35/333104435.db2.gz RHPJDJKVJNJHLR-CYBMUJFWSA-N 1 1 275.342 4.548 20 0 CJADMO CC[N@@H+](Cc1ccc(F)cc1)[C@@H](C)c1ccc(F)cc1 ZINC000517628048 333104367 /nfs/dbraw/zinc/10/43/67/333104367.db2.gz RHPJDJKVJNJHLR-ZDUSSCGKSA-N 1 1 275.342 4.548 20 0 CJADMO CC[N@@H+](Cc1cccc(F)c1)[C@H](C)c1ccc(F)cc1 ZINC000517629307 333104239 /nfs/dbraw/zinc/10/42/39/333104239.db2.gz NJFBSEXHJXIWFO-CYBMUJFWSA-N 1 1 275.342 4.548 20 0 CJADMO CC[N@@H+](Cc1cccc(F)c1)[C@@H](C)c1ccc(F)cc1 ZINC000517629308 333104131 /nfs/dbraw/zinc/10/41/31/333104131.db2.gz NJFBSEXHJXIWFO-ZDUSSCGKSA-N 1 1 275.342 4.548 20 0 CJADMO CC[C@@H]1CCC[N@@H+](Cc2c(Cl)ccc3cccnc32)C1 ZINC000517629641 333104405 /nfs/dbraw/zinc/10/44/05/333104405.db2.gz GLSYBYAZYXFDFN-CYBMUJFWSA-N 1 1 288.822 4.510 20 0 CJADMO CC[C@H]1CCC[N@@H+](Cc2c(Cl)ccc3cccnc32)C1 ZINC000517629642 333104335 /nfs/dbraw/zinc/10/43/35/333104335.db2.gz GLSYBYAZYXFDFN-ZDUSSCGKSA-N 1 1 288.822 4.510 20 0 CJADMO FC(F)c1ccc(CNc2cc(C3CC3)cc[nH+]2)cc1 ZINC000517631561 333104551 /nfs/dbraw/zinc/10/45/51/333104551.db2.gz PFBSSMKHVNODCW-UHFFFAOYSA-N 1 1 274.314 4.509 20 0 CJADMO CCc1ccc(C[NH2+]Cc2ccc(-c3ccco3)cc2F)o1 ZINC000517846878 260311460 /nfs/dbraw/zinc/31/14/60/260311460.db2.gz CHKCKXGYMHDLFZ-UHFFFAOYSA-N 1 1 299.345 4.531 20 0 CJADMO C[C@@H](c1ccc2ccccc2c1)[N@@H+](CCCCCO)C1CC1 ZINC000517896338 260315841 /nfs/dbraw/zinc/31/58/41/260315841.db2.gz CPRVXVFQAFWKQN-INIZCTEOSA-N 1 1 297.442 4.528 20 0 CJADMO C[C@H](c1ccc2ccccc2c1)[N@@H+](CCCCCO)C1CC1 ZINC000517896339 260315745 /nfs/dbraw/zinc/31/57/45/260315745.db2.gz CPRVXVFQAFWKQN-MRXNPFEDSA-N 1 1 297.442 4.528 20 0 CJADMO CC(C)OCC[N@@H+]([C@H](C)c1ccc2ccccc2c1)C1CC1 ZINC000517898935 260315133 /nfs/dbraw/zinc/31/51/33/260315133.db2.gz YFTBTVPTKWBSSL-MRXNPFEDSA-N 1 1 297.442 4.790 20 0 CJADMO CCC(CC)[N@@H+](Cc1csc(C2CCCC2)n1)C1CC1 ZINC000517900576 260315708 /nfs/dbraw/zinc/31/57/08/260315708.db2.gz RBCCZTNBZQGUFZ-UHFFFAOYSA-N 1 1 292.492 4.954 20 0 CJADMO Cc1nc(C)c([C@H](C)[N@@H+](C)Cc2cc(C)ccc2C)s1 ZINC000518056981 260339401 /nfs/dbraw/zinc/33/94/01/260339401.db2.gz XGVWQMFRARJRTQ-AWEZNQCLSA-N 1 1 288.460 4.570 20 0 CJADMO Cc1nc(C)c([C@@H](C)[N@@H+](C)Cc2cc(C)ccc2C)s1 ZINC000518056982 260339083 /nfs/dbraw/zinc/33/90/83/260339083.db2.gz XGVWQMFRARJRTQ-CQSZACIVSA-N 1 1 288.460 4.570 20 0 CJADMO C[C@@H]([NH2+]Cc1ccc(-c2ccco2)cc1F)c1ccoc1 ZINC000518076523 260340294 /nfs/dbraw/zinc/34/02/94/260340294.db2.gz HYIZJUJFIQOLIG-GFCCVEGCSA-N 1 1 285.318 4.530 20 0 CJADMO C[C@H]([NH2+]Cc1ccc(-c2ccco2)cc1F)c1ccoc1 ZINC000518076524 260340404 /nfs/dbraw/zinc/34/04/04/260340404.db2.gz HYIZJUJFIQOLIG-LBPRGKRZSA-N 1 1 285.318 4.530 20 0 CJADMO CCCCC/C(=C/c1ccccc1)C[NH2+]Cc1cc(C)on1 ZINC000518277599 260367778 /nfs/dbraw/zinc/36/77/78/260367778.db2.gz JYSLETQVABZOMM-AQTBWJFISA-N 1 1 298.430 4.737 20 0 CJADMO CCCCC/C(=C\c1ccccc1)C[NH2+]Cc1cc(C)on1 ZINC000518277600 260367395 /nfs/dbraw/zinc/36/73/95/260367395.db2.gz JYSLETQVABZOMM-QGOAFFKASA-N 1 1 298.430 4.737 20 0 CJADMO Cc1nc2ccc(C[N@@H+](C3CC3)C3CCCC3)cc2s1 ZINC000518283750 260368081 /nfs/dbraw/zinc/36/80/81/260368081.db2.gz LFFAQVLMYXNKDA-UHFFFAOYSA-N 1 1 286.444 4.512 20 0 CJADMO CCC(CC)[N@@H+](Cc1csc(-c2ccoc2)n1)C1CC1 ZINC000518677360 327192327 /nfs/dbraw/zinc/19/23/27/327192327.db2.gz JWYOWABMHHBFIO-UHFFFAOYSA-N 1 1 290.432 4.556 20 0 CJADMO CCC(CC)C[N@@H+](CC)Cc1csc(-c2ccoc2)n1 ZINC000518677508 327192198 /nfs/dbraw/zinc/19/21/98/327192198.db2.gz RVOFMQBJCPBZPY-UHFFFAOYSA-N 1 1 292.448 4.661 20 0 CJADMO Fc1cccc(C[NH2+]Cc2ccc(-c3ccccc3)o2)c1F ZINC000518759776 261237820 /nfs/dbraw/zinc/23/78/20/261237820.db2.gz KKKSSPUHZJMPSL-UHFFFAOYSA-N 1 1 299.320 4.515 20 0 CJADMO C(=C\c1ccccc1)\C[NH2+][C@@H](c1ccco1)c1ccccc1 ZINC000518771298 261544971 /nfs/dbraw/zinc/54/49/71/261544971.db2.gz ULEQIRHDEAKNGR-RVPHRTOXSA-N 1 1 289.378 4.672 20 0 CJADMO C[C@@H](c1ccc2ccccc2c1)[N@@H+](C)Cc1ccco1 ZINC000518831506 265050181 /nfs/dbraw/zinc/05/01/81/265050181.db2.gz KFOSMAOCWIQZOV-AWEZNQCLSA-N 1 1 265.356 4.626 20 0 CJADMO C[C@H](c1ccc2ccccc2c1)[N@@H+](C)Cc1ccco1 ZINC000518831507 265050116 /nfs/dbraw/zinc/05/01/16/265050116.db2.gz KFOSMAOCWIQZOV-CQSZACIVSA-N 1 1 265.356 4.626 20 0 CJADMO CC(C)[C@H]1CCC[N@H+]1Cc1cc(Cl)cc2cccnc21 ZINC000518836299 265101353 /nfs/dbraw/zinc/10/13/53/265101353.db2.gz RGSLKYDFIWZAID-MRXNPFEDSA-N 1 1 288.822 4.509 20 0 CJADMO Clc1ccc(/C=C\C[N@H+]2CCC[C@@H]2c2ccncc2)cc1 ZINC000518838094 265122160 /nfs/dbraw/zinc/12/21/60/265122160.db2.gz LBKIUSNHLDVMRW-PBMKKYJASA-N 1 1 298.817 4.585 20 0 CJADMO Clc1ccc(/C=C\C[N@H+]2CCC[C@H]2c2ccncc2)cc1 ZINC000518838095 265122461 /nfs/dbraw/zinc/12/24/61/265122461.db2.gz LBKIUSNHLDVMRW-PFOXWKGBSA-N 1 1 298.817 4.585 20 0 CJADMO CSc1ccc([C@@H](C)Nc2cc(C3CC3)cc[nH+]2)cc1 ZINC000518843879 265179814 /nfs/dbraw/zinc/17/98/14/265179814.db2.gz CTYRYKFYJBEXQY-GFCCVEGCSA-N 1 1 284.428 4.854 20 0 CJADMO CSc1ccc([C@H](C)Nc2cc(C3CC3)cc[nH+]2)cc1 ZINC000518843880 265179318 /nfs/dbraw/zinc/17/93/18/265179318.db2.gz CTYRYKFYJBEXQY-LBPRGKRZSA-N 1 1 284.428 4.854 20 0 CJADMO Cc1occc1C[N@H+](C)[C@@H](C)c1cccc2ccccc21 ZINC000519000265 265292955 /nfs/dbraw/zinc/29/29/55/265292955.db2.gz CCXDTQWUUSUDLX-AWEZNQCLSA-N 1 1 279.383 4.934 20 0 CJADMO Cc1occc1C[N@H+](C)[C@H](C)c1cccc2ccccc21 ZINC000519000266 265293082 /nfs/dbraw/zinc/29/30/82/265293082.db2.gz CCXDTQWUUSUDLX-CQSZACIVSA-N 1 1 279.383 4.934 20 0 CJADMO CC(C)=CC[N@@H+](Cc1ccco1)Cc1ccc(C)s1 ZINC000519051785 265304493 /nfs/dbraw/zinc/30/44/93/265304493.db2.gz UTHCGMRGBZMEMT-UHFFFAOYSA-N 1 1 275.417 4.618 20 0 CJADMO CC(C)=CC[N@H+](Cc1ccco1)Cc1ccc(C)s1 ZINC000519051785 265304491 /nfs/dbraw/zinc/30/44/91/265304491.db2.gz UTHCGMRGBZMEMT-UHFFFAOYSA-N 1 1 275.417 4.618 20 0 CJADMO Fc1ccc(C[N@@H+](Cc2ccccn2)C2CCCCC2)cc1 ZINC000519160660 265347732 /nfs/dbraw/zinc/34/77/32/265347732.db2.gz YADRGWLDELYOBQ-UHFFFAOYSA-N 1 1 298.405 4.556 20 0 CJADMO CC[C@@H](C)[C@H](C)[N@@H+](Cc1coc(-c2ccccc2)n1)C1CC1 ZINC000519187804 265356993 /nfs/dbraw/zinc/35/69/93/265356993.db2.gz JFEINVXIDJNKHS-CABCVRRESA-N 1 1 298.430 4.741 20 0 CJADMO CC[C@H](C)[C@H](C)[N@@H+](Cc1coc(-c2ccccc2)n1)C1CC1 ZINC000519187805 265357670 /nfs/dbraw/zinc/35/76/70/265357670.db2.gz JFEINVXIDJNKHS-GJZGRUSLSA-N 1 1 298.430 4.741 20 0 CJADMO CC[C@@H](C)[C@@H](C)[N@@H+](Cc1coc(-c2ccccc2)n1)C1CC1 ZINC000519187806 265357255 /nfs/dbraw/zinc/35/72/55/265357255.db2.gz JFEINVXIDJNKHS-HUUCEWRRSA-N 1 1 298.430 4.741 20 0 CJADMO CC[C@H](C)[C@@H](C)[N@@H+](Cc1coc(-c2ccccc2)n1)C1CC1 ZINC000519187807 265357540 /nfs/dbraw/zinc/35/75/40/265357540.db2.gz JFEINVXIDJNKHS-LSDHHAIUSA-N 1 1 298.430 4.741 20 0 CJADMO N#Cc1cccc(C[N@H+]2CCCCC[C@H]2c2ccccc2)c1 ZINC000519219706 265369480 /nfs/dbraw/zinc/36/94/80/265369480.db2.gz JOIMSWHQGXNNLH-FQEVSTJZSA-N 1 1 290.410 4.676 20 0 CJADMO N#Cc1cccc(C[N@H+]2CCCCC[C@@H]2c2ccccc2)c1 ZINC000519219707 265369163 /nfs/dbraw/zinc/36/91/63/265369163.db2.gz JOIMSWHQGXNNLH-HXUWFJFHSA-N 1 1 290.410 4.676 20 0 CJADMO Cc1c(Cl)c(C[N@H+](C)[C@H](C)C(C)C)nc2ccccc12 ZINC000519226152 265370967 /nfs/dbraw/zinc/37/09/67/265370967.db2.gz MDJTZCVJOXBQBJ-CYBMUJFWSA-N 1 1 290.838 4.673 20 0 CJADMO Cc1c(Cl)c(C[N@H+](C)[C@@H](C)C(C)C)nc2ccccc12 ZINC000519226153 265370808 /nfs/dbraw/zinc/37/08/08/265370808.db2.gz MDJTZCVJOXBQBJ-ZDUSSCGKSA-N 1 1 290.838 4.673 20 0 CJADMO CC[N@@H+](Cc1coc(-c2ccc(C)cc2)n1)[C@H](C)C(C)C ZINC000519274348 265385696 /nfs/dbraw/zinc/38/56/96/265385696.db2.gz PAXNUHVGCQTKTM-OAHLLOKOSA-N 1 1 286.419 4.516 20 0 CJADMO CCC[N@H+](Cc1nc(-c2ccccc2)oc1C)CC(C)C ZINC000519906204 265651187 /nfs/dbraw/zinc/65/11/87/265651187.db2.gz PFGQLKKXJBHFER-UHFFFAOYSA-N 1 1 286.419 4.518 20 0 CJADMO C[C@@H](c1ccc(Cl)c(Cl)c1)[N@@H+](C)Cc1ccco1 ZINC000519940914 260025271 /nfs/dbraw/zinc/02/52/71/260025271.db2.gz ABDMSZZKBSSODO-JTQLQIEISA-N 1 1 284.186 4.779 20 0 CJADMO C[C@H](c1ccc(Cl)c(Cl)c1)[N@@H+](C)Cc1ccco1 ZINC000519940915 260025044 /nfs/dbraw/zinc/02/50/44/260025044.db2.gz ABDMSZZKBSSODO-SNVBAGLBSA-N 1 1 284.186 4.779 20 0 CJADMO Cc1oc(-c2ccccc2)nc1C[N@H+](C)[C@H]1CCC[C@@H](C)C1 ZINC000519969361 260035673 /nfs/dbraw/zinc/03/56/73/260035673.db2.gz RCOXVOLUOGZYIH-PBHICJAKSA-N 1 1 298.430 4.661 20 0 CJADMO Cc1oc(-c2ccccc2)nc1C[N@H+](C)[C@@H]1CCC[C@@H](C)C1 ZINC000519969362 260035705 /nfs/dbraw/zinc/03/57/05/260035705.db2.gz RCOXVOLUOGZYIH-RHSMWYFYSA-N 1 1 298.430 4.661 20 0 CJADMO Cc1oc(-c2ccccc2)nc1C[N@H+](C)[C@@H]1CCC[C@H](C)C1 ZINC000519969363 260035860 /nfs/dbraw/zinc/03/58/60/260035860.db2.gz RCOXVOLUOGZYIH-WMLDXEAASA-N 1 1 298.430 4.661 20 0 CJADMO Cc1oc(-c2ccccc2)nc1C[N@H+](C)[C@H]1CCC[C@H](C)C1 ZINC000519969364 260035924 /nfs/dbraw/zinc/03/59/24/260035924.db2.gz RCOXVOLUOGZYIH-YOEHRIQHSA-N 1 1 298.430 4.661 20 0 CJADMO CC[N@@H+](Cc1cccs1)Cc1ccccc1OC(C)C ZINC000519988706 260039901 /nfs/dbraw/zinc/03/99/01/260039901.db2.gz HNVDKNSAONNOEI-UHFFFAOYSA-N 1 1 289.444 4.557 20 0 CJADMO 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ZINC000522555046 333289730 /nfs/dbraw/zinc/28/97/30/333289730.db2.gz HAUXGHXLUQKVDQ-QGZVFWFLSA-N 1 1 288.822 4.564 20 0 CJADMO C[C@@H](C[N@@H+](C)Cc1nc2ccccc2s1)c1ccccc1 ZINC000522662806 333295264 /nfs/dbraw/zinc/29/52/64/333295264.db2.gz GSEZGXJJWXGACI-AWEZNQCLSA-N 1 1 296.439 4.532 20 0 CJADMO C[C@H](C[N@@H+](C)Cc1nc2ccccc2s1)c1ccccc1 ZINC000522662807 333295526 /nfs/dbraw/zinc/29/55/26/333295526.db2.gz GSEZGXJJWXGACI-CQSZACIVSA-N 1 1 296.439 4.532 20 0 CJADMO C[C@H](C[N@@H+](C)Cc1ccc(Cl)s1)c1ccccc1 ZINC000522662816 333295292 /nfs/dbraw/zinc/29/52/92/333295292.db2.gz HQYGZRALFUMGNA-GFCCVEGCSA-N 1 1 279.836 4.637 20 0 CJADMO C[C@@H](C[N@@H+](C)Cc1ccc(Cl)s1)c1ccccc1 ZINC000522662817 333295365 /nfs/dbraw/zinc/29/53/65/333295365.db2.gz HQYGZRALFUMGNA-LBPRGKRZSA-N 1 1 279.836 4.637 20 0 CJADMO C[C@H](C[N@H+]1CCC[C@@H]1c1cccs1)c1ccccc1 ZINC000522662887 333295469 /nfs/dbraw/zinc/29/54/69/333295469.db2.gz KBZGCCDAKVNQGZ-GDBMZVCRSA-N 1 1 271.429 4.689 20 0 CJADMO 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/nfs/dbraw/zinc/23/50/45/262235045.db2.gz HRVPVOBUMQFSFM-CQSZACIVSA-N 1 1 288.460 4.815 20 0 CJADMO CCc1cnc(C[N@H+]2CCCCC[C@@H]2c2cccc(C)c2)o1 ZINC000525785448 262235089 /nfs/dbraw/zinc/23/50/89/262235089.db2.gz AKQDEDYVNOIGKA-GOSISDBHSA-N 1 1 298.430 4.663 20 0 CJADMO CCc1cnc(C[N@H+]2CCCCC[C@H]2c2cccc(C)c2)o1 ZINC000525785449 262234657 /nfs/dbraw/zinc/23/46/57/262234657.db2.gz AKQDEDYVNOIGKA-SFHVURJKSA-N 1 1 298.430 4.663 20 0 CJADMO Cc1oc(-c2ccccc2)nc1C[N@H+]1CCC[C@H]1C(C)(C)C ZINC000525786308 262236369 /nfs/dbraw/zinc/23/63/69/262236369.db2.gz NMHJERRNDLIJCC-KRWDZBQOSA-N 1 1 298.430 4.661 20 0 CJADMO Cc1oc(-c2ccccc2)nc1C[N@H+]1CCC[C@@H]1C(C)(C)C ZINC000525786309 262236374 /nfs/dbraw/zinc/23/63/74/262236374.db2.gz NMHJERRNDLIJCC-QGZVFWFLSA-N 1 1 298.430 4.661 20 0 CJADMO CSCCC[N@H+]1CCCC[C@H]1c1cccc(C)c1C ZINC000525796013 262348063 /nfs/dbraw/zinc/34/80/63/262348063.db2.gz QJOUGYWTXDMCKD-KRWDZBQOSA-N 1 1 277.477 4.584 20 0 CJADMO CSCCC[N@H+]1CCCC[C@@H]1c1cccc(C)c1C ZINC000525796014 262348340 /nfs/dbraw/zinc/34/83/40/262348340.db2.gz QJOUGYWTXDMCKD-QGZVFWFLSA-N 1 1 277.477 4.584 20 0 CJADMO c1cc2cc[nH+]cc2c(NC[C@@H]2CCC3(CCCCC3)O2)c1 ZINC000527211449 330237072 /nfs/dbraw/zinc/23/70/72/330237072.db2.gz LYIBXCNYTYSXFM-INIZCTEOSA-N 1 1 296.414 4.529 20 0 CJADMO c1cc2cc[nH+]cc2c(NC[C@H]2CCC3(CCCCC3)O2)c1 ZINC000527211450 330237231 /nfs/dbraw/zinc/23/72/31/330237231.db2.gz LYIBXCNYTYSXFM-MRXNPFEDSA-N 1 1 296.414 4.529 20 0 CJADMO CC(C)[C@H](C[N@H+]1CCC[C@@H]1c1ccccn1)c1ccccc1 ZINC000527218434 330238445 /nfs/dbraw/zinc/23/84/45/330238445.db2.gz PCFQKCGZVIHFGJ-AZUAARDMSA-N 1 1 294.442 4.658 20 0 CJADMO CC(C)[C@H](C[N@H+]1CCC[C@H]1c1ccccn1)c1ccccc1 ZINC000527218435 330238428 /nfs/dbraw/zinc/23/84/28/330238428.db2.gz PCFQKCGZVIHFGJ-ICSRJNTNSA-N 1 1 294.442 4.658 20 0 CJADMO CC(C)[C@@H](C[N@H+]1CCC[C@H]1c1ccccn1)c1ccccc1 ZINC000527218436 330238280 /nfs/dbraw/zinc/23/82/80/330238280.db2.gz PCFQKCGZVIHFGJ-QUCCMNQESA-N 1 1 294.442 4.658 20 0 CJADMO CC(C)[C@@H](C[N@H+]1CCC[C@@H]1c1ccccn1)c1ccccc1 ZINC000527218437 330238414 /nfs/dbraw/zinc/23/84/14/330238414.db2.gz PCFQKCGZVIHFGJ-UYAOXDASSA-N 1 1 294.442 4.658 20 0 CJADMO CC(C)c1[nH+]ccn1Cc1cccc(N[C@@H](C)C2CCC2)c1 ZINC000527232161 330239229 /nfs/dbraw/zinc/23/92/29/330239229.db2.gz QMBOYXRBCSTDII-HNNXBMFYSA-N 1 1 297.446 4.655 20 0 CJADMO CC(C)c1[nH+]ccn1Cc1cccc(N[C@H](C)C2CCC2)c1 ZINC000527232163 330239263 /nfs/dbraw/zinc/23/92/63/330239263.db2.gz QMBOYXRBCSTDII-OAHLLOKOSA-N 1 1 297.446 4.655 20 0 CJADMO Cc1cccc([C@@H]([NH2+]Cc2ncc(Cl)s2)C(C)C)c1 ZINC000527814312 330284912 /nfs/dbraw/zinc/28/49/12/330284912.db2.gz QPEKLDOPYIUVCW-HNNXBMFYSA-N 1 1 294.851 4.592 20 0 CJADMO Cc1cccc([C@H]([NH2+]Cc2ncc(Cl)s2)C(C)C)c1 ZINC000527814315 330285007 /nfs/dbraw/zinc/28/50/07/330285007.db2.gz QPEKLDOPYIUVCW-OAHLLOKOSA-N 1 1 294.851 4.592 20 0 CJADMO CCc1nc(C[NH2+][C@@H](CC)c2cc(C)ccc2C)cs1 ZINC000527821317 330286306 /nfs/dbraw/zinc/28/63/06/330286306.db2.gz NCCVPRGJJPPLPY-INIZCTEOSA-N 1 1 288.460 4.563 20 0 CJADMO CCc1nc(C[NH2+][C@H](CC)c2cc(C)ccc2C)cs1 ZINC000527821320 330286210 /nfs/dbraw/zinc/28/62/10/330286210.db2.gz NCCVPRGJJPPLPY-MRXNPFEDSA-N 1 1 288.460 4.563 20 0 CJADMO CC[C@@H]([NH2+]Cc1ncc(Cl)s1)c1cc(C)ccc1C ZINC000527823102 330286415 /nfs/dbraw/zinc/28/64/15/330286415.db2.gz RNRUXLDLYFMCEN-CYBMUJFWSA-N 1 1 294.851 4.654 20 0 CJADMO CC[C@H]([NH2+]Cc1ncc(Cl)s1)c1cc(C)ccc1C ZINC000527823104 330286341 /nfs/dbraw/zinc/28/63/41/330286341.db2.gz RNRUXLDLYFMCEN-ZDUSSCGKSA-N 1 1 294.851 4.654 20 0 CJADMO C[C@H]([NH2+]Cc1ccc(C2CCCC2)cc1)c1ncccc1F ZINC000527827570 330286893 /nfs/dbraw/zinc/28/68/93/330286893.db2.gz GCNCBQWHUQCDNO-AWEZNQCLSA-N 1 1 298.405 4.729 20 0 CJADMO CC[C@H](C)c1ccc([C@@H](C)[NH2+]Cc2nc(C)cs2)cc1 ZINC000527847226 330287941 /nfs/dbraw/zinc/28/79/41/330287941.db2.gz MGHVBNWPOYRUFT-GXTWGEPZSA-N 1 1 288.460 4.816 20 0 CJADMO CC[C@H](C)c1ccc([C@H](C)[NH2+]Cc2nc(C)cs2)cc1 ZINC000527847227 330287861 /nfs/dbraw/zinc/28/78/61/330287861.db2.gz MGHVBNWPOYRUFT-JSGCOSHPSA-N 1 1 288.460 4.816 20 0 CJADMO CC[C@@H](C)c1ccc([C@H](C)[NH2+]Cc2nc(C)cs2)cc1 ZINC000527847229 330287913 /nfs/dbraw/zinc/28/79/13/330287913.db2.gz MGHVBNWPOYRUFT-OCCSQVGLSA-N 1 1 288.460 4.816 20 0 CJADMO CC[C@@H](C)c1ccc([C@@H](C)[NH2+]Cc2nc(C)cs2)cc1 ZINC000527847230 330287915 /nfs/dbraw/zinc/28/79/15/330287915.db2.gz MGHVBNWPOYRUFT-TZMCWYRMSA-N 1 1 288.460 4.816 20 0 CJADMO CC[C@@H](C)c1ccc([C@@H](C)[NH2+]Cc2nccs2)cc1 ZINC000527848669 330287993 /nfs/dbraw/zinc/28/79/93/330287993.db2.gz HOHYHVKHRITBRX-CHWSQXEVSA-N 1 1 274.433 4.507 20 0 CJADMO CC[C@@H](C)c1ccc([C@H](C)[NH2+]Cc2nccs2)cc1 ZINC000527848673 330287975 /nfs/dbraw/zinc/28/79/75/330287975.db2.gz HOHYHVKHRITBRX-OLZOCXBDSA-N 1 1 274.433 4.507 20 0 CJADMO CC[C@H](C)c1ccc([C@@H](C)[NH2+]Cc2nccs2)cc1 ZINC000527848676 330288029 /nfs/dbraw/zinc/28/80/29/330288029.db2.gz HOHYHVKHRITBRX-QWHCGFSZSA-N 1 1 274.433 4.507 20 0 CJADMO CC[C@H](C)c1ccc([C@H](C)[NH2+]Cc2nccs2)cc1 ZINC000527848680 330287995 /nfs/dbraw/zinc/28/79/95/330287995.db2.gz HOHYHVKHRITBRX-STQMWFEESA-N 1 1 274.433 4.507 20 0 CJADMO CC[C@@H](C)c1ccc([C@@H](C)[NH2+]Cc2cscn2)cc1 ZINC000527856590 330288925 /nfs/dbraw/zinc/28/89/25/330288925.db2.gz UNDYGPOSOJWRJT-CHWSQXEVSA-N 1 1 274.433 4.507 20 0 CJADMO CC[C@@H](C)c1ccc([C@H](C)[NH2+]Cc2cscn2)cc1 ZINC000527856591 330288932 /nfs/dbraw/zinc/28/89/32/330288932.db2.gz UNDYGPOSOJWRJT-OLZOCXBDSA-N 1 1 274.433 4.507 20 0 CJADMO CC[C@H](C)c1ccc([C@@H](C)[NH2+]Cc2cscn2)cc1 ZINC000527856593 330288833 /nfs/dbraw/zinc/28/88/33/330288833.db2.gz UNDYGPOSOJWRJT-QWHCGFSZSA-N 1 1 274.433 4.507 20 0 CJADMO CC[C@H](C)c1ccc([C@H](C)[NH2+]Cc2cscn2)cc1 ZINC000527856595 330288830 /nfs/dbraw/zinc/28/88/30/330288830.db2.gz UNDYGPOSOJWRJT-STQMWFEESA-N 1 1 274.433 4.507 20 0 CJADMO CC[C@@H](C)c1ccc([C@H](C)[NH2+]Cc2ccn(C(C)C)n2)cc1 ZINC000527861264 330289329 /nfs/dbraw/zinc/28/93/29/330289329.db2.gz CWHZFACNJBZVMO-CVEARBPZSA-N 1 1 299.462 4.828 20 0 CJADMO CC[C@H](C)c1ccc([C@H](C)[NH2+]Cc2ccn(C(C)C)n2)cc1 ZINC000527861267 330289333 /nfs/dbraw/zinc/28/93/33/330289333.db2.gz CWHZFACNJBZVMO-HOTGVXAUSA-N 1 1 299.462 4.828 20 0 CJADMO CC[C@@H](C)c1ccc([C@@H](C)[NH2+]Cc2ccn(C(C)C)n2)cc1 ZINC000527861270 330289376 /nfs/dbraw/zinc/28/93/76/330289376.db2.gz CWHZFACNJBZVMO-HZPDHXFCSA-N 1 1 299.462 4.828 20 0 CJADMO CC[C@H](C)c1ccc([C@@H](C)[NH2+]Cc2ccn(C(C)C)n2)cc1 ZINC000527861274 330289260 /nfs/dbraw/zinc/28/92/60/330289260.db2.gz CWHZFACNJBZVMO-JKSUJKDBSA-N 1 1 299.462 4.828 20 0 CJADMO CC[C@H](C)c1ccc([C@@H](C)[NH2+]Cc2ncc(C)s2)cc1 ZINC000527861958 330285216 /nfs/dbraw/zinc/28/52/16/330285216.db2.gz FCJPCJBMBQUOTC-GXTWGEPZSA-N 1 1 288.460 4.816 20 0 CJADMO CC[C@H](C)c1ccc([C@H](C)[NH2+]Cc2ncc(C)s2)cc1 ZINC000527861960 330285222 /nfs/dbraw/zinc/28/52/22/330285222.db2.gz FCJPCJBMBQUOTC-JSGCOSHPSA-N 1 1 288.460 4.816 20 0 CJADMO CC[C@@H](C)c1ccc([C@H](C)[NH2+]Cc2ncc(C)s2)cc1 ZINC000527861963 330285286 /nfs/dbraw/zinc/28/52/86/330285286.db2.gz FCJPCJBMBQUOTC-OCCSQVGLSA-N 1 1 288.460 4.816 20 0 CJADMO CC[C@@H](C)c1ccc([C@@H](C)[NH2+]Cc2ncc(C)s2)cc1 ZINC000527861966 330285240 /nfs/dbraw/zinc/28/52/40/330285240.db2.gz FCJPCJBMBQUOTC-TZMCWYRMSA-N 1 1 288.460 4.816 20 0 CJADMO CC(C)Cn1ccnc1C[NH2+][C@@H](C)c1cccc(C(C)C)c1 ZINC000527862671 330285257 /nfs/dbraw/zinc/28/52/57/330285257.db2.gz GJPADQJDDRYVAH-INIZCTEOSA-N 1 1 299.462 4.513 20 0 CJADMO CC(C)Cn1ccnc1C[NH2+][C@H](C)c1cccc(C(C)C)c1 ZINC000527862672 330285335 /nfs/dbraw/zinc/28/53/35/330285335.db2.gz GJPADQJDDRYVAH-MRXNPFEDSA-N 1 1 299.462 4.513 20 0 CJADMO CCc1nc(C[NH2+][C@H](C)c2cccc(C(C)C)c2)cs1 ZINC000527862973 330285260 /nfs/dbraw/zinc/28/52/60/330285260.db2.gz PNSURSBXDIXQAT-CYBMUJFWSA-N 1 1 288.460 4.680 20 0 CJADMO CCc1nc(C[NH2+][C@@H](C)c2cccc(C(C)C)c2)cs1 ZINC000527862986 330285299 /nfs/dbraw/zinc/28/52/99/330285299.db2.gz PNSURSBXDIXQAT-ZDUSSCGKSA-N 1 1 288.460 4.680 20 0 CJADMO CCc1cnc(C[NH2+][C@H](C)c2cccc(C(C)C)c2)s1 ZINC000527865046 330285497 /nfs/dbraw/zinc/28/54/97/330285497.db2.gz LUUHNNRXVKLUPQ-CYBMUJFWSA-N 1 1 288.460 4.680 20 0 CJADMO CCc1cnc(C[NH2+][C@@H](C)c2cccc(C(C)C)c2)s1 ZINC000527865049 330285603 /nfs/dbraw/zinc/28/56/03/330285603.db2.gz LUUHNNRXVKLUPQ-ZDUSSCGKSA-N 1 1 288.460 4.680 20 0 CJADMO CCc1cc(C[NH2+][C@@H](C)c2ccc([C@@H](C)CC)cc2)on1 ZINC000527868453 330285867 /nfs/dbraw/zinc/28/58/67/330285867.db2.gz PNORLGLWSCACDL-KBPBESRZSA-N 1 1 286.419 4.601 20 0 CJADMO CCc1cc(C[NH2+][C@@H](C)c2ccc([C@H](C)CC)cc2)on1 ZINC000527868456 330285792 /nfs/dbraw/zinc/28/57/92/330285792.db2.gz PNORLGLWSCACDL-KGLIPLIRSA-N 1 1 286.419 4.601 20 0 CJADMO CCc1cc(C[NH2+][C@H](C)c2ccc([C@@H](C)CC)cc2)on1 ZINC000527868460 330285859 /nfs/dbraw/zinc/28/58/59/330285859.db2.gz PNORLGLWSCACDL-UONOGXRCSA-N 1 1 286.419 4.601 20 0 CJADMO CCc1cc(C[NH2+][C@H](C)c2ccc([C@H](C)CC)cc2)on1 ZINC000527868463 330285906 /nfs/dbraw/zinc/28/59/06/330285906.db2.gz PNORLGLWSCACDL-ZIAGYGMSSA-N 1 1 286.419 4.601 20 0 CJADMO CC[C@H](C)c1ccc([C@H](C)[NH2+][C@H]2CCCc3c[nH]nc32)cc1 ZINC000527869190 330286060 /nfs/dbraw/zinc/28/60/60/330286060.db2.gz DPSIYZOFXRKVCJ-DEYYWGMASA-N 1 1 297.446 4.651 20 0 CJADMO CC[C@H](C)c1ccc([C@@H](C)[NH2+][C@H]2CCCc3c[nH]nc32)cc1 ZINC000527869194 330285934 /nfs/dbraw/zinc/28/59/34/330285934.db2.gz DPSIYZOFXRKVCJ-IYOUNJFTSA-N 1 1 297.446 4.651 20 0 CJADMO CC[C@H](C)c1ccc([C@@H](C)[NH2+][C@@H]2CCCc3c[nH]nc32)cc1 ZINC000527869198 330285930 /nfs/dbraw/zinc/28/59/30/330285930.db2.gz DPSIYZOFXRKVCJ-PMUMKWKESA-N 1 1 297.446 4.651 20 0 CJADMO CC[C@H](C)c1ccc([C@H](C)[NH2+][C@@H]2CCCc3c[nH]nc32)cc1 ZINC000527869201 330285991 /nfs/dbraw/zinc/28/59/91/330285991.db2.gz DPSIYZOFXRKVCJ-SUNYJGFJSA-N 1 1 297.446 4.651 20 0 CJADMO CC[C@H](C)c1ccc([C@H](C)[NH2+]Cc2ncccc2F)cc1 ZINC000527876958 330291383 /nfs/dbraw/zinc/29/13/83/330291383.db2.gz WTYMGPKHOBKAHW-KBPBESRZSA-N 1 1 286.394 4.585 20 0 CJADMO CC[C@@H](C)c1ccc([C@H](C)[NH2+]Cc2ncccc2F)cc1 ZINC000527876959 330291351 /nfs/dbraw/zinc/29/13/51/330291351.db2.gz WTYMGPKHOBKAHW-KGLIPLIRSA-N 1 1 286.394 4.585 20 0 CJADMO CC[C@H](C)c1ccc([C@@H](C)[NH2+]Cc2ncccc2F)cc1 ZINC000527876960 330291361 /nfs/dbraw/zinc/29/13/61/330291361.db2.gz WTYMGPKHOBKAHW-UONOGXRCSA-N 1 1 286.394 4.585 20 0 CJADMO CC[C@@H](C)c1ccc([C@@H](C)[NH2+]Cc2ncccc2F)cc1 ZINC000527876961 330291379 /nfs/dbraw/zinc/29/13/79/330291379.db2.gz WTYMGPKHOBKAHW-ZIAGYGMSSA-N 1 1 286.394 4.585 20 0 CJADMO CCC(CC)c1cc(CNc2[nH+]ccc3ccccc32)on1 ZINC000527904730 330289836 /nfs/dbraw/zinc/28/98/36/330289836.db2.gz DXTDRCUZBRIICS-UHFFFAOYSA-N 1 1 295.386 4.739 20 0 CJADMO CC[C@H](C)c1ccc([C@H](C)[NH2+][C@@H]2C[C@@H](C)n3ccnc32)cc1 ZINC000527905174 330289833 /nfs/dbraw/zinc/28/98/33/330289833.db2.gz GPFLVABUIZIGKY-JTOWHCCKSA-N 1 1 297.446 4.753 20 0 CJADMO CC[C@H](C)c1ccc([C@H](C)[NH2+][C@H]2C[C@@H](C)n3ccnc32)cc1 ZINC000527905179 330289749 /nfs/dbraw/zinc/28/97/49/330289749.db2.gz GPFLVABUIZIGKY-KRXQYRFLSA-N 1 1 297.446 4.753 20 0 CJADMO CC[C@H](C)c1ccc([C@H](C)[NH2+][C@H]2C[C@H](C)n3ccnc32)cc1 ZINC000527905183 330289968 /nfs/dbraw/zinc/28/99/68/330289968.db2.gz GPFLVABUIZIGKY-XSWJXKHESA-N 1 1 297.446 4.753 20 0 CJADMO CC[C@H](C)c1ccc([C@H](C)[NH2+][C@@H]2C[C@H](C)n3ccnc32)cc1 ZINC000527905187 330289887 /nfs/dbraw/zinc/28/98/87/330289887.db2.gz GPFLVABUIZIGKY-YRBFXIGRSA-N 1 1 297.446 4.753 20 0 CJADMO CC[C@H](C)c1ccc([C@@H](C)[NH2+][C@H](C)c2nccn2CC)cc1 ZINC000527906298 330290168 /nfs/dbraw/zinc/29/01/68/330290168.db2.gz MHNCRCHILQHVDX-ARFHVFGLSA-N 1 1 299.462 4.828 20 0 CJADMO CC[C@H](C)c1ccc([C@H](C)[NH2+][C@H](C)c2nccn2CC)cc1 ZINC000527906299 330290284 /nfs/dbraw/zinc/29/02/84/330290284.db2.gz MHNCRCHILQHVDX-HRCADAONSA-N 1 1 299.462 4.828 20 0 CJADMO CC[C@H](C)c1ccc([C@H](C)[NH2+][C@@H](C)c2nccn2CC)cc1 ZINC000527906300 330290145 /nfs/dbraw/zinc/29/01/45/330290145.db2.gz MHNCRCHILQHVDX-JYJNAYRXSA-N 1 1 299.462 4.828 20 0 CJADMO CC[C@H](C)c1ccc([C@@H](C)[NH2+][C@@H](C)c2nccn2CC)cc1 ZINC000527906301 330290141 /nfs/dbraw/zinc/29/01/41/330290141.db2.gz MHNCRCHILQHVDX-XHSDSOJGSA-N 1 1 299.462 4.828 20 0 CJADMO CC(C)c1cccc([C@@H](C)[NH2+][C@@H](C)c2nccs2)c1 ZINC000527911068 330290676 /nfs/dbraw/zinc/29/06/76/330290676.db2.gz WVUZRYDHTINJTF-OLZOCXBDSA-N 1 1 274.433 4.678 20 0 CJADMO CC(C)c1cccc([C@H](C)[NH2+][C@@H](C)c2nccs2)c1 ZINC000527911072 330290766 /nfs/dbraw/zinc/29/07/66/330290766.db2.gz WVUZRYDHTINJTF-STQMWFEESA-N 1 1 274.433 4.678 20 0 CJADMO CC[C@@H]([NH2+][C@@H](C)c1cscn1)c1cc(C)ccc1C ZINC000527911572 330290853 /nfs/dbraw/zinc/29/08/53/330290853.db2.gz GDORLAAEEJGNDF-DZGCQCFKSA-N 1 1 274.433 4.562 20 0 CJADMO CC[C@H]([NH2+][C@H](C)c1cscn1)c1cc(C)ccc1C ZINC000527911573 330290797 /nfs/dbraw/zinc/29/07/97/330290797.db2.gz GDORLAAEEJGNDF-HIFRSBDPSA-N 1 1 274.433 4.562 20 0 CJADMO CC[C@@H]([NH2+][C@H](C)c1cscn1)c1cc(C)ccc1C ZINC000527911574 330290828 /nfs/dbraw/zinc/29/08/28/330290828.db2.gz GDORLAAEEJGNDF-UKRRQHHQSA-N 1 1 274.433 4.562 20 0 CJADMO CC[C@H]([NH2+][C@@H](C)c1cscn1)c1cc(C)ccc1C ZINC000527911576 330290826 /nfs/dbraw/zinc/29/08/26/330290826.db2.gz GDORLAAEEJGNDF-ZFWWWQNUSA-N 1 1 274.433 4.562 20 0 CJADMO CC(C)c1cccc([C@@H](C)[NH2+][C@H](C)c2cscn2)c1 ZINC000527914567 330295039 /nfs/dbraw/zinc/29/50/39/330295039.db2.gz MKDQNZKUALJYTB-CHWSQXEVSA-N 1 1 274.433 4.678 20 0 CJADMO CC(C)c1cccc([C@@H](C)[NH2+][C@@H](C)c2cscn2)c1 ZINC000527914572 330295009 /nfs/dbraw/zinc/29/50/09/330295009.db2.gz MKDQNZKUALJYTB-OLZOCXBDSA-N 1 1 274.433 4.678 20 0 CJADMO CC(C)c1cccc([C@H](C)[NH2+][C@H](C)c2cscn2)c1 ZINC000527914575 330295053 /nfs/dbraw/zinc/29/50/53/330295053.db2.gz MKDQNZKUALJYTB-QWHCGFSZSA-N 1 1 274.433 4.678 20 0 CJADMO CC(C)c1cccc([C@H](C)[NH2+][C@@H](C)c2cscn2)c1 ZINC000527914581 330295026 /nfs/dbraw/zinc/29/50/26/330295026.db2.gz MKDQNZKUALJYTB-STQMWFEESA-N 1 1 274.433 4.678 20 0 CJADMO Cc1nc([C@@H](C)[NH2+]Cc2ccccc2CC(C)C)cs1 ZINC000527919758 330295524 /nfs/dbraw/zinc/29/55/24/330295524.db2.gz KAXGHJPUWQEMCE-CYBMUJFWSA-N 1 1 288.460 4.501 20 0 CJADMO Cc1nc([C@H](C)[NH2+]Cc2ccccc2CC(C)C)cs1 ZINC000527919760 330295479 /nfs/dbraw/zinc/29/54/79/330295479.db2.gz KAXGHJPUWQEMCE-ZDUSSCGKSA-N 1 1 288.460 4.501 20 0 CJADMO c1ccc2c(c1)cc[nH+]c2N[C@H]1CCOC2(CCCCC2)C1 ZINC000527928740 330296858 /nfs/dbraw/zinc/29/68/58/330296858.db2.gz HBXVBVQKCDJMOC-INIZCTEOSA-N 1 1 296.414 4.529 20 0 CJADMO c1ccc2c(c1)cc[nH+]c2N[C@@H]1CCOC2(CCCCC2)C1 ZINC000527928742 330296837 /nfs/dbraw/zinc/29/68/37/330296837.db2.gz HBXVBVQKCDJMOC-MRXNPFEDSA-N 1 1 296.414 4.529 20 0 CJADMO CC[C@@H]([NH2+][C@@H](C)c1ncccc1F)c1ccc(Cl)s1 ZINC000528034766 330302405 /nfs/dbraw/zinc/30/24/05/330302405.db2.gz BRSHSSZJDYVPDO-GXSJLCMTSA-N 1 1 298.814 4.738 20 0 CJADMO CC[C@H]([NH2+][C@@H](C)c1ncccc1F)c1ccc(Cl)s1 ZINC000528034767 330302355 /nfs/dbraw/zinc/30/23/55/330302355.db2.gz BRSHSSZJDYVPDO-ONGXEEELSA-N 1 1 298.814 4.738 20 0 CJADMO CC[C@H]([NH2+][C@@H](C)c1ncccc1F)c1cccc(Cl)c1 ZINC000528034829 330302399 /nfs/dbraw/zinc/30/23/99/330302399.db2.gz ABLMSPYHUMCTMW-NHYWBVRUSA-N 1 1 292.785 4.676 20 0 CJADMO CC[C@@H]([NH2+][C@@H](C)c1ncccc1F)c1cccc(Cl)c1 ZINC000528034830 330302319 /nfs/dbraw/zinc/30/23/19/330302319.db2.gz ABLMSPYHUMCTMW-XHDPSFHLSA-N 1 1 292.785 4.676 20 0 CJADMO C[C@H]([NH2+][C@@H](C)c1ncccc1F)c1ccc2c(c1)CCCC2 ZINC000528035500 330302539 /nfs/dbraw/zinc/30/25/39/330302539.db2.gz HTDOZRXZWMLTBK-KBPBESRZSA-N 1 1 298.405 4.511 20 0 CJADMO C[C@@H]([NH2+][C@@H](C)c1ncccc1F)c1ccc2c(c1)CCCC2 ZINC000528035501 330302488 /nfs/dbraw/zinc/30/24/88/330302488.db2.gz HTDOZRXZWMLTBK-KGLIPLIRSA-N 1 1 298.405 4.511 20 0 CJADMO CC[C@H]([NH2+][C@@H](C)c1ncccc1F)c1ccc(Cl)cc1 ZINC000528035519 330302521 /nfs/dbraw/zinc/30/25/21/330302521.db2.gz IRCNWDUAKOBGIY-NHYWBVRUSA-N 1 1 292.785 4.676 20 0 CJADMO CC[C@@H]([NH2+][C@@H](C)c1ncccc1F)c1ccc(Cl)cc1 ZINC000528035520 330302441 /nfs/dbraw/zinc/30/24/41/330302441.db2.gz IRCNWDUAKOBGIY-XHDPSFHLSA-N 1 1 292.785 4.676 20 0 CJADMO Cc1c2ccccc2oc1[C@@H](C)[NH2+][C@@H](C)c1ncccc1F ZINC000528035744 330302670 /nfs/dbraw/zinc/30/26/70/330302670.db2.gz JZWCUSZQXKEOAU-QWHCGFSZSA-N 1 1 298.361 4.687 20 0 CJADMO Cc1c2ccccc2oc1[C@H](C)[NH2+][C@@H](C)c1ncccc1F ZINC000528035745 330302726 /nfs/dbraw/zinc/30/27/26/330302726.db2.gz JZWCUSZQXKEOAU-STQMWFEESA-N 1 1 298.361 4.687 20 0 CJADMO CCCc1ccc([C@H](C)[NH2+][C@@H](C)c2ncccc2F)cc1 ZINC000528036117 330302623 /nfs/dbraw/zinc/30/26/23/330302623.db2.gz OAHJCFUMGHRICO-KBPBESRZSA-N 1 1 286.394 4.585 20 0 CJADMO CCCc1ccc([C@@H](C)[NH2+][C@@H](C)c2ncccc2F)cc1 ZINC000528036118 330302685 /nfs/dbraw/zinc/30/26/85/330302685.db2.gz OAHJCFUMGHRICO-KGLIPLIRSA-N 1 1 286.394 4.585 20 0 CJADMO CC(C)[C@H]1C[C@@H]([NH2+][C@@H](C)c2ncccc2F)c2ccccc21 ZINC000528036208 330302720 /nfs/dbraw/zinc/30/27/20/330302720.db2.gz PFYRFDNQNUTPBO-FDQGKXFDSA-N 1 1 298.405 4.756 20 0 CJADMO CC(C)[C@@H]1C[C@H]([NH2+][C@@H](C)c2ncccc2F)c2ccccc21 ZINC000528036209 330302687 /nfs/dbraw/zinc/30/26/87/330302687.db2.gz PFYRFDNQNUTPBO-OWQGQXMQSA-N 1 1 298.405 4.756 20 0 CJADMO CC(C)[C@@H]1C[C@@H]([NH2+][C@@H](C)c2ncccc2F)c2ccccc21 ZINC000528036210 330302636 /nfs/dbraw/zinc/30/26/36/330302636.db2.gz PFYRFDNQNUTPBO-QANKJYHBSA-N 1 1 298.405 4.756 20 0 CJADMO CC(C)[C@H]1C[C@H]([NH2+][C@@H](C)c2ncccc2F)c2ccccc21 ZINC000528036211 330302699 /nfs/dbraw/zinc/30/26/99/330302699.db2.gz PFYRFDNQNUTPBO-XCRHUMRWSA-N 1 1 298.405 4.756 20 0 CJADMO C[C@H]([NH2+][C@H]1CCC(C)(C)c2ccccc21)c1ncccc1F ZINC000528036275 330302885 /nfs/dbraw/zinc/30/28/85/330302885.db2.gz QTWBBXZSACINRQ-GUYCJALGSA-N 1 1 298.405 4.684 20 0 CJADMO C[C@H]([NH2+][C@@H]1CCC(C)(C)c2ccccc21)c1ncccc1F ZINC000528036276 330302879 /nfs/dbraw/zinc/30/28/79/330302879.db2.gz QTWBBXZSACINRQ-SUMWQHHRSA-N 1 1 298.405 4.684 20 0 CJADMO CC(C)c1ccc([C@H](C)[NH2+][C@@H](C)c2ncccc2F)cc1 ZINC000528036899 330303033 /nfs/dbraw/zinc/30/30/33/330303033.db2.gz WUTYRDQOHPLDKH-KBPBESRZSA-N 1 1 286.394 4.756 20 0 CJADMO CC(C)c1ccc([C@@H](C)[NH2+][C@@H](C)c2ncccc2F)cc1 ZINC000528036900 330303141 /nfs/dbraw/zinc/30/31/41/330303141.db2.gz WUTYRDQOHPLDKH-KGLIPLIRSA-N 1 1 286.394 4.756 20 0 CJADMO Cc1cc(C)c([C@@H](C)[NH2+][C@@H](C)c2ncccc2F)cc1C ZINC000528036918 330303118 /nfs/dbraw/zinc/30/31/18/330303118.db2.gz XHEDSVKOSXWVIY-CABCVRRESA-N 1 1 286.394 4.558 20 0 CJADMO Cc1cc(C)c([C@H](C)[NH2+][C@@H](C)c2ncccc2F)cc1C ZINC000528036919 330303101 /nfs/dbraw/zinc/30/31/01/330303101.db2.gz XHEDSVKOSXWVIY-GJZGRUSLSA-N 1 1 286.394 4.558 20 0 CJADMO C[C@H]([NH2+][C@H]1CC[C@H](C)c2ccccc21)c1ncccc1F ZINC000528037000 330303163 /nfs/dbraw/zinc/30/31/63/330303163.db2.gz ZRTAJTMBXNWUFC-DCGLDWPTSA-N 1 1 284.378 4.510 20 0 CJADMO C[C@H]([NH2+][C@@H]1CC[C@H](C)c2ccccc21)c1ncccc1F ZINC000528037001 330303173 /nfs/dbraw/zinc/30/31/73/330303173.db2.gz ZRTAJTMBXNWUFC-GDZNZVCISA-N 1 1 284.378 4.510 20 0 CJADMO C[C@H]([NH2+][C@H]1CC[C@@H](C)c2ccccc21)c1ncccc1F ZINC000528037002 330303112 /nfs/dbraw/zinc/30/31/12/330303112.db2.gz ZRTAJTMBXNWUFC-IGCXYCKISA-N 1 1 284.378 4.510 20 0 CJADMO C[C@H]([NH2+][C@@H]1CC[C@@H](C)c2ccccc21)c1ncccc1F ZINC000528037003 330303153 /nfs/dbraw/zinc/30/31/53/330303153.db2.gz ZRTAJTMBXNWUFC-IIYDPXPESA-N 1 1 284.378 4.510 20 0 CJADMO C[C@@H]([NH2+][C@@H](C)c1ncccc1F)c1cccc(C2CC2)c1 ZINC000528037233 330303065 /nfs/dbraw/zinc/30/30/65/330303065.db2.gz GIMPJLQSBWFLPA-OLZOCXBDSA-N 1 1 284.378 4.510 20 0 CJADMO C[C@H]([NH2+][C@@H](C)c1ncccc1F)c1cccc(C2CC2)c1 ZINC000528037234 330303039 /nfs/dbraw/zinc/30/30/39/330303039.db2.gz GIMPJLQSBWFLPA-STQMWFEESA-N 1 1 284.378 4.510 20 0 CJADMO CC(C)(C)[C@@H]([NH2+]Cc1ncccc1Cl)c1ccccc1 ZINC000528405790 333434927 /nfs/dbraw/zinc/43/49/27/333434927.db2.gz CAINYRTWTIWNFW-INIZCTEOSA-N 1 1 288.822 4.612 20 0 CJADMO CC[C@H]([NH2+]Cc1ncccc1Cl)c1ccc(Cl)cc1 ZINC000528431165 333436951 /nfs/dbraw/zinc/43/69/51/333436951.db2.gz KCJGLEGQHSPFBV-AWEZNQCLSA-N 1 1 295.213 4.629 20 0 CJADMO C/C(Cl)=C/C[NH2+][C@@H](C)c1nc(-c2ccccc2)cs1 ZINC000528451411 333438775 /nfs/dbraw/zinc/43/87/75/333438775.db2.gz YHVPZMLRUXQPIK-KGTBHZDVSA-N 1 1 292.835 4.603 20 0 CJADMO C/C(Cl)=C/C[NH2+][C@H](C)c1nc(-c2ccccc2)cs1 ZINC000528451412 333438845 /nfs/dbraw/zinc/43/88/45/333438845.db2.gz YHVPZMLRUXQPIK-NXIHDVOMSA-N 1 1 292.835 4.603 20 0 CJADMO C/C(Cl)=C\C[NH2+][C@@H](C)c1nc(-c2ccccc2)cs1 ZINC000528451414 333438847 /nfs/dbraw/zinc/43/88/47/333438847.db2.gz YHVPZMLRUXQPIK-OBIHZWKSSA-N 1 1 292.835 4.603 20 0 CJADMO Cc1cc(C)c([C@@H](C)[NH2+][C@@H](C)c2ncccc2F)c(C)c1 ZINC000528823679 333460286 /nfs/dbraw/zinc/46/02/86/333460286.db2.gz NDRYFEZEBJFVBZ-CABCVRRESA-N 1 1 286.394 4.558 20 0 CJADMO Cc1cc(C[N@@H+](CCC(F)(F)F)CC2CC2)c(C)s1 ZINC000530992637 327120998 /nfs/dbraw/zinc/12/09/98/327120998.db2.gz WIMCWJSQFOPOTN-UHFFFAOYSA-N 1 1 291.382 4.529 20 0 CJADMO C[C@@H]([N@@H+](C)Cc1ccc(Cl)c2cccnc12)C1(C)CC1 ZINC000530992987 327121616 /nfs/dbraw/zinc/12/16/16/327121616.db2.gz DBUXSGNDJCMEID-GFCCVEGCSA-N 1 1 288.822 4.509 20 0 CJADMO C[C@H]([N@@H+](C)Cc1ccc(Cl)c2cccnc12)C1(C)CC1 ZINC000530993015 327121608 /nfs/dbraw/zinc/12/16/08/327121608.db2.gz DBUXSGNDJCMEID-LBPRGKRZSA-N 1 1 288.822 4.509 20 0 CJADMO C[C@H]([C@@H](C)c1ccc(Cl)cc1)[N@@H+](C)CCC(F)(F)F ZINC000531103477 327247476 /nfs/dbraw/zinc/24/74/76/327247476.db2.gz CMUKIHIIPKACPW-GHMZBOCLSA-N 1 1 293.760 4.716 20 0 CJADMO C[C@@H](c1ccc(Cl)cc1)[C@H](C)[N@@H+](C)CCC(F)(F)F ZINC000531103481 327247467 /nfs/dbraw/zinc/24/74/67/327247467.db2.gz CMUKIHIIPKACPW-MNOVXSKESA-N 1 1 293.760 4.716 20 0 CJADMO C[C@H](c1ccc(Cl)cc1)[C@H](C)[N@@H+](C)CCC(F)(F)F ZINC000531103482 327247420 /nfs/dbraw/zinc/24/74/20/327247420.db2.gz CMUKIHIIPKACPW-QWRGUYRKSA-N 1 1 293.760 4.716 20 0 CJADMO C[C@H](c1ccc(Cl)cc1)[C@@H](C)[N@@H+](C)CCC(F)(F)F ZINC000531103484 327247411 /nfs/dbraw/zinc/24/74/11/327247411.db2.gz CMUKIHIIPKACPW-WDEREUQCSA-N 1 1 293.760 4.716 20 0 CJADMO Cc1ccc(C[NH2+]Cc2ccco2)c(Oc2ccccc2)c1 ZINC000531525684 328014798 /nfs/dbraw/zinc/01/47/98/328014798.db2.gz VKTWUBZNHZPTIT-UHFFFAOYSA-N 1 1 293.366 4.670 20 0 CJADMO C[C@@H](c1cccc2ccccc21)[N@@H+](C)CCC1CCOCC1 ZINC000531562511 328018343 /nfs/dbraw/zinc/01/83/43/328018343.db2.gz SDDIXVKMUNFYCB-INIZCTEOSA-N 1 1 297.442 4.649 20 0 CJADMO C[C@H](c1cccc2ccccc21)[N@@H+](C)CCC1CCOCC1 ZINC000531562512 328018232 /nfs/dbraw/zinc/01/82/32/328018232.db2.gz SDDIXVKMUNFYCB-MRXNPFEDSA-N 1 1 297.442 4.649 20 0 CJADMO Clc1cccc(Cl)c1C1([NH2+]Cc2ccccc2)CC1 ZINC000531595980 328016639 /nfs/dbraw/zinc/01/66/39/328016639.db2.gz YQUHXOBRPRKPEM-UHFFFAOYSA-N 1 1 292.209 4.772 20 0 CJADMO CCc1ccc(C[NH2+][C@@H](C)c2cccc(Cl)c2Cl)o1 ZINC000531612323 328019012 /nfs/dbraw/zinc/01/90/12/328019012.db2.gz MQEVLGZJHAHFQC-JTQLQIEISA-N 1 1 298.213 5.000 20 0 CJADMO CCc1ccc(C[NH2+][C@H](C)c2cccc(Cl)c2Cl)o1 ZINC000531612324 328019051 /nfs/dbraw/zinc/01/90/51/328019051.db2.gz MQEVLGZJHAHFQC-SNVBAGLBSA-N 1 1 298.213 5.000 20 0 CJADMO CCc1ccc([C@H](C)[NH2+]Cc2cccc(Cl)c2Cl)o1 ZINC000531694162 328025103 /nfs/dbraw/zinc/02/51/03/328025103.db2.gz XIKZHUCLUHXSNP-JTQLQIEISA-N 1 1 298.213 5.000 20 0 CJADMO CCc1ccc([C@@H](C)[NH2+]Cc2cccc(Cl)c2Cl)o1 ZINC000531694163 328025112 /nfs/dbraw/zinc/02/51/12/328025112.db2.gz XIKZHUCLUHXSNP-SNVBAGLBSA-N 1 1 298.213 5.000 20 0 CJADMO COc1cc(C)ccc1[C@H](C)[NH2+]Cc1ccc([C@@H]2C[C@@H]2C)o1 ZINC000531699782 328025793 /nfs/dbraw/zinc/02/57/93/328025793.db2.gz GNJVCCUHZBCETN-GRDNDAEWSA-N 1 1 299.414 4.571 20 0 CJADMO COc1cc(C)ccc1[C@H](C)[NH2+]Cc1ccc([C@@H]2C[C@H]2C)o1 ZINC000531699783 328025622 /nfs/dbraw/zinc/02/56/22/328025622.db2.gz GNJVCCUHZBCETN-JKIFEVAISA-N 1 1 299.414 4.571 20 0 CJADMO COc1cc(C)ccc1[C@H](C)[NH2+]Cc1ccc([C@H]2C[C@H]2C)o1 ZINC000531699785 328025761 /nfs/dbraw/zinc/02/57/61/328025761.db2.gz GNJVCCUHZBCETN-KEYYUXOJSA-N 1 1 299.414 4.571 20 0 CJADMO COc1cc(C)ccc1[C@H](C)[NH2+]Cc1ccc([C@H]2C[C@@H]2C)o1 ZINC000531699787 328025709 /nfs/dbraw/zinc/02/57/09/328025709.db2.gz GNJVCCUHZBCETN-ZQIUZPCESA-N 1 1 299.414 4.571 20 0 CJADMO C[C@H]([NH2+]Cc1ccc([C@H]2C[C@H]2C)o1)c1cc(F)cc(F)c1 ZINC000531699795 328025744 /nfs/dbraw/zinc/02/57/44/328025744.db2.gz ISYSIKXTYCGQFD-GDLVEWKHSA-N 1 1 291.341 4.532 20 0 CJADMO C[C@H]([NH2+]Cc1ccc([C@H]2C[C@@H]2C)o1)c1cc(F)cc(F)c1 ZINC000531699803 328025691 /nfs/dbraw/zinc/02/56/91/328025691.db2.gz ISYSIKXTYCGQFD-MMPTUQATSA-N 1 1 291.341 4.532 20 0 CJADMO C[C@H]([NH2+]Cc1ccc([C@@H]2C[C@H]2C)o1)c1cc(F)cc(F)c1 ZINC000531699806 328025714 /nfs/dbraw/zinc/02/57/14/328025714.db2.gz ISYSIKXTYCGQFD-OHUAYANFSA-N 1 1 291.341 4.532 20 0 CJADMO C[C@H]([NH2+]Cc1ccc([C@@H]2C[C@@H]2C)o1)c1cc(F)cc(F)c1 ZINC000531699807 328025783 /nfs/dbraw/zinc/02/57/83/328025783.db2.gz ISYSIKXTYCGQFD-XMZIXOGTSA-N 1 1 291.341 4.532 20 0 CJADMO CCc1nc([C@H](C)[NH2+][C@@H](C)c2cc(C)ccc2C)cs1 ZINC000531715183 328028175 /nfs/dbraw/zinc/02/81/75/328028175.db2.gz VOSCWHYTJIJFSF-KBPBESRZSA-N 1 1 288.460 4.734 20 0 CJADMO CCc1nc([C@H](C)[NH2+][C@H](C)c2cc(C)ccc2C)cs1 ZINC000531715184 328028271 /nfs/dbraw/zinc/02/82/71/328028271.db2.gz VOSCWHYTJIJFSF-KGLIPLIRSA-N 1 1 288.460 4.734 20 0 CJADMO CCc1nc([C@@H](C)[NH2+][C@@H](C)c2cc(C)ccc2C)cs1 ZINC000531715185 328028188 /nfs/dbraw/zinc/02/81/88/328028188.db2.gz VOSCWHYTJIJFSF-UONOGXRCSA-N 1 1 288.460 4.734 20 0 CJADMO CCc1nc([C@@H](C)[NH2+][C@H](C)c2cc(C)ccc2C)cs1 ZINC000531715186 328028165 /nfs/dbraw/zinc/02/81/65/328028165.db2.gz VOSCWHYTJIJFSF-ZIAGYGMSSA-N 1 1 288.460 4.734 20 0 CJADMO Cc1ccc(C[NH2+][C@@H](c2ccc(F)cc2F)C(C)(C)C)o1 ZINC000531817966 328038737 /nfs/dbraw/zinc/03/87/37/328038737.db2.gz LNCFJBPFLQGTGN-INIZCTEOSA-N 1 1 293.357 4.743 20 0 CJADMO Cc1ccc(C[NH2+][C@H](c2ccc(F)cc2F)C(C)(C)C)o1 ZINC000531817967 328038800 /nfs/dbraw/zinc/03/88/00/328038800.db2.gz LNCFJBPFLQGTGN-MRXNPFEDSA-N 1 1 293.357 4.743 20 0 CJADMO Cc1cc[nH+]c(N[C@H](C)c2ccccc2C(F)(F)F)c1 ZINC000531842293 328044696 /nfs/dbraw/zinc/04/46/96/328044696.db2.gz GLYXIGPVZJYHKL-LLVKDONJSA-N 1 1 280.293 4.582 20 0 CJADMO Cc1cc[nH+]c(N[C@@H](C)c2ccccc2C(F)(F)F)c1 ZINC000531842294 328044556 /nfs/dbraw/zinc/04/45/56/328044556.db2.gz GLYXIGPVZJYHKL-NSHDSACASA-N 1 1 280.293 4.582 20 0 CJADMO Clc1cccc(Cl)c1C1([NH2+]Cc2cccs2)CC1 ZINC000531848721 328046078 /nfs/dbraw/zinc/04/60/78/328046078.db2.gz AJONWAXLQAJMTJ-UHFFFAOYSA-N 1 1 298.238 4.834 20 0 CJADMO CCc1ccc(C[NH2+][C@H](c2ccc(F)cc2F)C(C)C)o1 ZINC000531863702 328050651 /nfs/dbraw/zinc/05/06/51/328050651.db2.gz SINKVXVFFJNPNF-KRWDZBQOSA-N 1 1 293.357 4.607 20 0 CJADMO CCc1ccc(C[NH2+][C@@H](c2ccc(F)cc2F)C(C)C)o1 ZINC000531863710 328050579 /nfs/dbraw/zinc/05/05/79/328050579.db2.gz SINKVXVFFJNPNF-QGZVFWFLSA-N 1 1 293.357 4.607 20 0 CJADMO Cc1cccc([C@H](C)[NH2+][C@@H](C)c2c(F)cccc2F)c1C ZINC000531938730 328322465 /nfs/dbraw/zinc/32/24/65/328322465.db2.gz ZZHAIQHRULOVED-KBPBESRZSA-N 1 1 289.369 4.993 20 0 CJADMO Cc1cccc([C@@H](C)[NH2+][C@@H](C)c2c(F)cccc2F)c1C ZINC000531938731 328322498 /nfs/dbraw/zinc/32/24/98/328322498.db2.gz ZZHAIQHRULOVED-KGLIPLIRSA-N 1 1 289.369 4.993 20 0 CJADMO Cc1cccc([C@H](C)[NH2+][C@H](C)c2c(F)cccc2F)c1C ZINC000531938732 328322539 /nfs/dbraw/zinc/32/25/39/328322539.db2.gz ZZHAIQHRULOVED-UONOGXRCSA-N 1 1 289.369 4.993 20 0 CJADMO Cc1cccc([C@@H](C)[NH2+][C@H](C)c2c(F)cccc2F)c1C ZINC000531938733 328322545 /nfs/dbraw/zinc/32/25/45/328322545.db2.gz ZZHAIQHRULOVED-ZIAGYGMSSA-N 1 1 289.369 4.993 20 0 CJADMO CC[C@@H]([NH2+][C@@H](C)c1ccccc1F)c1ccc(F)cc1F ZINC000531968850 328358227 /nfs/dbraw/zinc/35/82/27/328358227.db2.gz RDDORRYYJDSMMN-APPDUMDISA-N 1 1 293.332 4.906 20 0 CJADMO CC[C@H]([NH2+][C@H](C)c1ccccc1F)c1ccc(F)cc1F ZINC000531968851 328358291 /nfs/dbraw/zinc/35/82/91/328358291.db2.gz RDDORRYYJDSMMN-DIFFPNOSSA-N 1 1 293.332 4.906 20 0 CJADMO CC[C@H]([NH2+][C@@H](C)c1ccccc1F)c1ccc(F)cc1F ZINC000531968852 328358159 /nfs/dbraw/zinc/35/81/59/328358159.db2.gz RDDORRYYJDSMMN-GTNSWQLSSA-N 1 1 293.332 4.906 20 0 CJADMO CC[C@@H]([NH2+][C@H](C)c1ccccc1F)c1ccc(F)cc1F ZINC000531968853 328358177 /nfs/dbraw/zinc/35/81/77/328358177.db2.gz RDDORRYYJDSMMN-PIGZYNQJSA-N 1 1 293.332 4.906 20 0 CJADMO Cc1ccoc1C[NH2+][C@@H](c1ccc(F)cc1F)C(C)(C)C ZINC000532074838 328444359 /nfs/dbraw/zinc/44/43/59/328444359.db2.gz LZQDXMTVOYAGQR-INIZCTEOSA-N 1 1 293.357 4.743 20 0 CJADMO Cc1ccoc1C[NH2+][C@H](c1ccc(F)cc1F)C(C)(C)C ZINC000532074850 328444348 /nfs/dbraw/zinc/44/43/48/328444348.db2.gz LZQDXMTVOYAGQR-MRXNPFEDSA-N 1 1 293.357 4.743 20 0 CJADMO C[C@H]([NH2+]Cc1ccc(-c2ccccc2)o1)c1ccccc1F ZINC000532195153 328704381 /nfs/dbraw/zinc/70/43/81/328704381.db2.gz BUMZULFGWZABFY-AWEZNQCLSA-N 1 1 295.357 4.937 20 0 CJADMO CC(C)[C@H]([NH2+]Cc1ccc(Cl)o1)c1ccc(F)cc1F ZINC000532328577 328768618 /nfs/dbraw/zinc/76/86/18/328768618.db2.gz AJEMRJCQBZYNHG-HNNXBMFYSA-N 1 1 299.748 4.698 20 0 CJADMO CC(C)[C@@H]([NH2+]Cc1ccc(Cl)o1)c1ccc(F)cc1F ZINC000532328578 328768533 /nfs/dbraw/zinc/76/85/33/328768533.db2.gz AJEMRJCQBZYNHG-OAHLLOKOSA-N 1 1 299.748 4.698 20 0 CJADMO CCOc1ccccc1[C@H](C)[NH2+]Cc1ccc([C@H]2C[C@H]2C)o1 ZINC000532475759 328782734 /nfs/dbraw/zinc/78/27/34/328782734.db2.gz YGKTYEBGBGENNW-KEYYUXOJSA-N 1 1 299.414 4.653 20 0 CJADMO CC(C)C[C@H]([NH2+]Cc1ccc([C@H]2C[C@@H]2C)o1)c1ccccn1 ZINC000532476431 328782638 /nfs/dbraw/zinc/78/26/38/328782638.db2.gz ZFIYWIJVAGWIKO-ZVZYQTTQSA-N 1 1 298.430 4.675 20 0 CJADMO c1ccc2sc([C@@H]3CCC[N@@H+]3CC3CCCC3)nc2c1 ZINC000532904245 329340431 /nfs/dbraw/zinc/34/04/31/329340431.db2.gz NLCFAFLOEDAULC-HNNXBMFYSA-N 1 1 286.444 4.623 20 0 CJADMO c1ccc2sc([C@H]3CCC[N@@H+]3CC3CCCC3)nc2c1 ZINC000532904246 329340526 /nfs/dbraw/zinc/34/05/26/329340526.db2.gz NLCFAFLOEDAULC-OAHLLOKOSA-N 1 1 286.444 4.623 20 0 CJADMO Cc1ccc(C[N@H+](C)[C@H](C)c2ccc(F)cc2F)s1 ZINC000532952351 330322910 /nfs/dbraw/zinc/32/29/10/330322910.db2.gz AFPFOKHLQPNXMX-LLVKDONJSA-N 1 1 281.371 4.528 20 0 CJADMO Cc1ccc(C[N@@H+](C)[C@H](C)c2ccc(F)cc2F)s1 ZINC000532952351 330322909 /nfs/dbraw/zinc/32/29/09/330322909.db2.gz AFPFOKHLQPNXMX-LLVKDONJSA-N 1 1 281.371 4.528 20 0 CJADMO Cc1ccc(C[N@H+](C)[C@@H](C)c2ccc(F)cc2F)s1 ZINC000532952355 330322871 /nfs/dbraw/zinc/32/28/71/330322871.db2.gz AFPFOKHLQPNXMX-NSHDSACASA-N 1 1 281.371 4.528 20 0 CJADMO Cc1ccc(C[N@@H+](C)[C@@H](C)c2ccc(F)cc2F)s1 ZINC000532952355 330322870 /nfs/dbraw/zinc/32/28/70/330322870.db2.gz AFPFOKHLQPNXMX-NSHDSACASA-N 1 1 281.371 4.528 20 0 CJADMO Fc1cccc(C[N@@H+](CCC(F)(F)F)C2CCCC2)c1 ZINC000533027213 330324732 /nfs/dbraw/zinc/32/47/32/330324732.db2.gz AMUHVZWZTRTLJV-UHFFFAOYSA-N 1 1 289.316 4.523 20 0 CJADMO COCCCCC[N@@H+]([C@@H](C)c1ccc(Cl)cc1)C1CC1 ZINC000533031292 330324797 /nfs/dbraw/zinc/32/47/97/330324797.db2.gz YNFDGIOHEUYOQI-AWEZNQCLSA-N 1 1 295.854 4.682 20 0 CJADMO COCCCCC[N@@H+]([C@H](C)c1ccc(Cl)cc1)C1CC1 ZINC000533031297 330324893 /nfs/dbraw/zinc/32/48/93/330324893.db2.gz YNFDGIOHEUYOQI-CQSZACIVSA-N 1 1 295.854 4.682 20 0 CJADMO C[N@@H+](CCCc1cccc2ccccc21)CCC(F)(F)F ZINC000533032576 330324819 /nfs/dbraw/zinc/32/48/19/330324819.db2.gz KPPMJCCPLCFNLY-UHFFFAOYSA-N 1 1 295.348 4.657 20 0 CJADMO CC(C)[N@@H+](Cc1cc(-c2cccs2)on1)C1CCCC1 ZINC000533045682 330326221 /nfs/dbraw/zinc/32/62/21/330326221.db2.gz DRNFPURWAHCYSX-UHFFFAOYSA-N 1 1 290.432 4.556 20 0 CJADMO CC(C)[N@@H+](Cc1ncc(C(C)(C)C)o1)C1CCCCC1 ZINC000533048496 330326362 /nfs/dbraw/zinc/32/63/62/330326362.db2.gz HQHLOSCSEQUPKB-UHFFFAOYSA-N 1 1 278.440 4.515 20 0 CJADMO CC[C@H](c1ccccc1)[N@H+](Cc1nccn1CC)CC(C)C ZINC000533064328 330325472 /nfs/dbraw/zinc/32/54/72/330325472.db2.gz RNYPLDNXKUQYLP-GOSISDBHSA-N 1 1 299.462 4.512 20 0 CJADMO CC[C@@H](c1ccccc1)[N@H+](Cc1nccn1CC)CC(C)C ZINC000533064329 330325431 /nfs/dbraw/zinc/32/54/31/330325431.db2.gz RNYPLDNXKUQYLP-SFHVURJKSA-N 1 1 299.462 4.512 20 0 CJADMO CC[C@H](c1ccccc1)[N@H+](Cc1cc(C)no1)CC(C)C ZINC000533064694 330325590 /nfs/dbraw/zinc/32/55/90/330325590.db2.gz QHZJQPJWBISTRD-GOSISDBHSA-N 1 1 286.419 4.592 20 0 CJADMO CC[C@@H](c1ccccc1)[N@H+](Cc1cc(C)no1)CC(C)C ZINC000533064695 330325587 /nfs/dbraw/zinc/32/55/87/330325587.db2.gz QHZJQPJWBISTRD-SFHVURJKSA-N 1 1 286.419 4.592 20 0 CJADMO CC(C)[N@@H+](Cc1ccc(Cl)c2cccnc12)C1CCC1 ZINC000533071544 330326859 /nfs/dbraw/zinc/32/68/59/330326859.db2.gz QDSSILIRIGUBTR-UHFFFAOYSA-N 1 1 288.822 4.651 20 0 CJADMO CC(C)[N@@H+](Cc1cc(Cl)cc2cccnc21)C1CCC1 ZINC000533074406 330327157 /nfs/dbraw/zinc/32/71/57/330327157.db2.gz AACONQLKRXYJDC-UHFFFAOYSA-N 1 1 288.822 4.651 20 0 CJADMO c1ccc2oc([C@@H]3CCCC[N@@H+]3CC3CCCC3)nc2c1 ZINC000533078643 330330649 /nfs/dbraw/zinc/33/06/49/330330649.db2.gz TZZCRMLCDOHSJJ-INIZCTEOSA-N 1 1 284.403 4.545 20 0 CJADMO c1ccc2oc([C@H]3CCCC[N@@H+]3CC3CCCC3)nc2c1 ZINC000533078644 330330697 /nfs/dbraw/zinc/33/06/97/330330697.db2.gz TZZCRMLCDOHSJJ-MRXNPFEDSA-N 1 1 284.403 4.545 20 0 CJADMO C[N@@H+](CCCCC(F)(F)F)[C@H]1CCCc2ccccc21 ZINC000533096926 330334670 /nfs/dbraw/zinc/33/46/70/330334670.db2.gz ROZIJNQBZUGRFG-HNNXBMFYSA-N 1 1 285.353 4.728 20 0 CJADMO C[N@@H+](CCCCC(F)(F)F)[C@@H]1CCCc2ccccc21 ZINC000533096927 330334686 /nfs/dbraw/zinc/33/46/86/330334686.db2.gz ROZIJNQBZUGRFG-OAHLLOKOSA-N 1 1 285.353 4.728 20 0 CJADMO Fc1ccc2oc(CNc3cccc4cc[nH+]cc43)cc2c1 ZINC000533213521 330354008 /nfs/dbraw/zinc/35/40/08/330354008.db2.gz RIWUPHCPQXAYGQ-UHFFFAOYSA-N 1 1 292.313 4.732 20 0 CJADMO c1nc(C2CCC2)sc1CNc1cccc2cc[nH+]cc21 ZINC000533213961 330353957 /nfs/dbraw/zinc/35/39/57/330353957.db2.gz AJOLZBPLBOEVNZ-UHFFFAOYSA-N 1 1 295.411 4.571 20 0 CJADMO C[C@H](c1cccc(F)c1)[N@H+]1CCC[C@H]1c1cccs1 ZINC000533223849 330353566 /nfs/dbraw/zinc/35/35/66/330353566.db2.gz NJTUEKKACOYRSA-DOMZBBRYSA-N 1 1 275.392 4.785 20 0 CJADMO C[C@H](c1cccc(F)c1)[N@H+]1CCC[C@@H]1c1cccs1 ZINC000533223850 330353608 /nfs/dbraw/zinc/35/36/08/330353608.db2.gz NJTUEKKACOYRSA-IUODEOHRSA-N 1 1 275.392 4.785 20 0 CJADMO C[C@@H](c1cccc(F)c1)[N@H+]1CCC[C@@H]1c1cccs1 ZINC000533223851 330353556 /nfs/dbraw/zinc/35/35/56/330353556.db2.gz NJTUEKKACOYRSA-SWLSCSKDSA-N 1 1 275.392 4.785 20 0 CJADMO C[C@@H](c1cccc(F)c1)[N@H+]1CCC[C@H]1c1cccs1 ZINC000533223852 330353673 /nfs/dbraw/zinc/35/36/73/330353673.db2.gz NJTUEKKACOYRSA-WFASDCNBSA-N 1 1 275.392 4.785 20 0 CJADMO C[C@@H](c1ccccc1F)[N@H+]1CCC[C@@H]1c1ccsc1 ZINC000533238782 330354551 /nfs/dbraw/zinc/35/45/51/330354551.db2.gz OJSQOLMXUREEBB-BLLLJJGKSA-N 1 1 275.392 4.785 20 0 CJADMO C[C@@H](c1ccccc1F)[N@H+]1CCC[C@H]1c1ccsc1 ZINC000533238783 330354432 /nfs/dbraw/zinc/35/44/32/330354432.db2.gz OJSQOLMXUREEBB-LRDDRELGSA-N 1 1 275.392 4.785 20 0 CJADMO C[C@H](c1ccccc1F)[N@H+]1CCC[C@@H]1c1ccsc1 ZINC000533238784 330354463 /nfs/dbraw/zinc/35/44/63/330354463.db2.gz OJSQOLMXUREEBB-MLGOLLRUSA-N 1 1 275.392 4.785 20 0 CJADMO C[C@H](c1ccccc1F)[N@H+]1CCC[C@H]1c1ccsc1 ZINC000533238785 330354566 /nfs/dbraw/zinc/35/45/66/330354566.db2.gz OJSQOLMXUREEBB-WBMJQRKESA-N 1 1 275.392 4.785 20 0 CJADMO Cc1ncc(C[N@H+](C)[C@@H](C)c2c(C)cc(C)cc2C)s1 ZINC000533240110 330354409 /nfs/dbraw/zinc/35/44/09/330354409.db2.gz LUUFOGUFJSIKRZ-AWEZNQCLSA-N 1 1 288.460 4.570 20 0 CJADMO Cc1ncc(C[N@H+](C)[C@H](C)c2c(C)cc(C)cc2C)s1 ZINC000533240111 330354554 /nfs/dbraw/zinc/35/45/54/330354554.db2.gz LUUFOGUFJSIKRZ-CQSZACIVSA-N 1 1 288.460 4.570 20 0 CJADMO C[C@H](c1cccnc1)[N@@H+](C)Cc1cc(Cl)cc(Cl)c1 ZINC000533240696 330354478 /nfs/dbraw/zinc/35/44/78/330354478.db2.gz MHFFZORBSBMNMB-LLVKDONJSA-N 1 1 295.213 4.581 20 0 CJADMO C[C@@H](c1cccnc1)[N@@H+](C)Cc1cc(Cl)cc(Cl)c1 ZINC000533240697 330354541 /nfs/dbraw/zinc/35/45/41/330354541.db2.gz MHFFZORBSBMNMB-NSHDSACASA-N 1 1 295.213 4.581 20 0 CJADMO Cc1ncc(C[N@H+](C)[C@H](C)c2cccc3ccccc32)s1 ZINC000533240745 330354460 /nfs/dbraw/zinc/35/44/60/330354460.db2.gz SXEZSLUUMXHYJC-CYBMUJFWSA-N 1 1 296.439 4.798 20 0 CJADMO Cc1ccc(-c2cnc(C[N@H+](C)[C@@H](C)C(C)(C)C)o2)cc1 ZINC000533249234 330355182 /nfs/dbraw/zinc/35/51/82/330355182.db2.gz BQBOJFDWXQGROH-AWEZNQCLSA-N 1 1 286.419 4.516 20 0 CJADMO Cc1ccc(-c2cnc(C[N@H+](C)[C@H](C)C(C)(C)C)o2)cc1 ZINC000533249235 330355251 /nfs/dbraw/zinc/35/52/51/330355251.db2.gz BQBOJFDWXQGROH-CQSZACIVSA-N 1 1 286.419 4.516 20 0 CJADMO C[C@@H]([N@@H+](C)Cc1csc(-c2ccsc2)n1)C(C)(C)C ZINC000533249983 330355330 /nfs/dbraw/zinc/35/53/30/330355330.db2.gz MKYHZTFCYXRMQC-LLVKDONJSA-N 1 1 294.489 4.738 20 0 CJADMO C[C@H]([N@@H+](C)Cc1csc(-c2ccsc2)n1)C(C)(C)C ZINC000533249984 330355396 /nfs/dbraw/zinc/35/53/96/330355396.db2.gz MKYHZTFCYXRMQC-NSHDSACASA-N 1 1 294.489 4.738 20 0 CJADMO CC(C)[N@@H+](Cc1ccccc1)Cc1ccnc2ccccc12 ZINC000533254209 330354728 /nfs/dbraw/zinc/35/47/28/330354728.db2.gz ZGFUQNNEIWWMGY-UHFFFAOYSA-N 1 1 290.410 4.645 20 0 CJADMO C[C@@H](c1ccc2ccccc2c1)[N@@H+](Cc1ccno1)C1CC1 ZINC000533288109 330355858 /nfs/dbraw/zinc/35/58/58/330355858.db2.gz OMXXVDFIJOFZIR-AWEZNQCLSA-N 1 1 292.382 4.553 20 0 CJADMO C[C@H](c1ccc2ccccc2c1)[N@@H+](Cc1ccno1)C1CC1 ZINC000533288110 330355884 /nfs/dbraw/zinc/35/58/84/330355884.db2.gz OMXXVDFIJOFZIR-CQSZACIVSA-N 1 1 292.382 4.553 20 0 CJADMO C[C@H](c1ccc2ccccc2c1)[N@@H+](C)CCC(F)(F)F ZINC000533355384 330359370 /nfs/dbraw/zinc/35/93/70/330359370.db2.gz ZSMBZYBWUXKDOJ-GFCCVEGCSA-N 1 1 281.321 4.785 20 0 CJADMO C[C@@H](c1ccc2ccccc2c1)[N@@H+](C)CCC(F)(F)F ZINC000533355385 330359393 /nfs/dbraw/zinc/35/93/93/330359393.db2.gz ZSMBZYBWUXKDOJ-LBPRGKRZSA-N 1 1 281.321 4.785 20 0 CJADMO CC(C)[N@H+](Cc1cc(Cl)cc2cccnc21)CC1CC1 ZINC000533356763 330359543 /nfs/dbraw/zinc/35/95/43/330359543.db2.gz SSUFYNFCMJZVKE-UHFFFAOYSA-N 1 1 288.822 4.509 20 0 CJADMO CC(C)[N@H+](Cc1ccc(Cl)c2cccnc12)CC1CC1 ZINC000533357543 330359454 /nfs/dbraw/zinc/35/94/54/330359454.db2.gz SEBJYAQGGRTXPI-UHFFFAOYSA-N 1 1 288.822 4.509 20 0 CJADMO Cc1csc(C[NH2+][C@H](C)c2ccccc2C(C)(C)C)n1 ZINC000533625249 326882329 /nfs/dbraw/zinc/88/23/29/326882329.db2.gz KJJVVPGMUXSCQT-CYBMUJFWSA-N 1 1 288.460 4.600 20 0 CJADMO Cc1cnc(C[NH2+][C@H](C)c2ccccc2C(C)(C)C)s1 ZINC000533626069 326883877 /nfs/dbraw/zinc/88/38/77/326883877.db2.gz NMCSVXNKJUCHSH-CYBMUJFWSA-N 1 1 288.460 4.600 20 0 CJADMO CCC(CC)[N@@H+](Cc1ncc(-c2ccccc2C)o1)C1CC1 ZINC000533815139 327103082 /nfs/dbraw/zinc/10/30/82/327103082.db2.gz GJZSTDHDARSLSR-UHFFFAOYSA-N 1 1 298.430 4.803 20 0 CJADMO CCC[N@H+](Cc1ncc(-c2ccccc2C)o1)CC(C)C ZINC000533816063 327104829 /nfs/dbraw/zinc/10/48/29/327104829.db2.gz STZOKDRQNTZFEI-UHFFFAOYSA-N 1 1 286.419 4.518 20 0 CJADMO Cc1ccccc1-c1cnc(C[N@@H+]2CCC[C@H]2CC(C)C)o1 ZINC000533816092 327105528 /nfs/dbraw/zinc/10/55/28/327105528.db2.gz UAQRAMSQGOACAZ-INIZCTEOSA-N 1 1 298.430 4.661 20 0 CJADMO Cc1ccccc1-c1cnc(C[N@@H+]2CCC[C@@H]2CC(C)C)o1 ZINC000533816093 327105496 /nfs/dbraw/zinc/10/54/96/327105496.db2.gz UAQRAMSQGOACAZ-MRXNPFEDSA-N 1 1 298.430 4.661 20 0 CJADMO Cc1ccccc1-c1cnc(C[N@@H+]2CCCC[C@H]2C(C)C)o1 ZINC000533816218 327105651 /nfs/dbraw/zinc/10/56/51/327105651.db2.gz WXJJJHNLKLJOBY-KRWDZBQOSA-N 1 1 298.430 4.661 20 0 CJADMO Cc1ccccc1-c1cnc(C[N@@H+]2CCCC[C@@H]2C(C)C)o1 ZINC000533816220 327105961 /nfs/dbraw/zinc/10/59/61/327105961.db2.gz WXJJJHNLKLJOBY-QGZVFWFLSA-N 1 1 298.430 4.661 20 0 CJADMO CCCC[N@@H+](Cc1ncc(C2CC2)o1)[C@@H](C)c1ccccc1 ZINC000534119455 328036255 /nfs/dbraw/zinc/03/62/55/328036255.db2.gz MRQCGUFVKAQNPT-HNNXBMFYSA-N 1 1 298.430 4.915 20 0 CJADMO CCCC[N@H+](Cc1ncc(C2CC2)o1)[C@@H](C)c1ccccc1 ZINC000534119455 328036254 /nfs/dbraw/zinc/03/62/54/328036254.db2.gz MRQCGUFVKAQNPT-HNNXBMFYSA-N 1 1 298.430 4.915 20 0 CJADMO CCCC[N@@H+](Cc1ncc(C2CC2)o1)[C@H](C)c1ccccc1 ZINC000534119456 328036099 /nfs/dbraw/zinc/03/60/99/328036099.db2.gz MRQCGUFVKAQNPT-OAHLLOKOSA-N 1 1 298.430 4.915 20 0 CJADMO CCCC[N@H+](Cc1ncc(C2CC2)o1)[C@H](C)c1ccccc1 ZINC000534119456 328036097 /nfs/dbraw/zinc/03/60/97/328036097.db2.gz MRQCGUFVKAQNPT-OAHLLOKOSA-N 1 1 298.430 4.915 20 0 CJADMO Cc1cccc([C@@H]2CCC[N@H+]2Cc2ncc(C3CC3)o2)c1C ZINC000534119761 328036191 /nfs/dbraw/zinc/03/61/91/328036191.db2.gz YYESXDDXPCHHGO-KRWDZBQOSA-N 1 1 296.414 4.506 20 0 CJADMO Cc1cccc([C@H]2CCC[N@H+]2Cc2ncc(C3CC3)o2)c1C ZINC000534119762 328036302 /nfs/dbraw/zinc/03/63/02/328036302.db2.gz YYESXDDXPCHHGO-QGZVFWFLSA-N 1 1 296.414 4.506 20 0 CJADMO Cc1ccc([C@@H]2CCCC[N@H+]2Cc2ncc(C3CC3)o2)cc1 ZINC000534120072 328036261 /nfs/dbraw/zinc/03/62/61/328036261.db2.gz VUHWUIWIJBINHV-KRWDZBQOSA-N 1 1 296.414 4.588 20 0 CJADMO Cc1ccc([C@@H]2CCCC[N@@H+]2Cc2ncc(C3CC3)o2)cc1 ZINC000534120072 328036259 /nfs/dbraw/zinc/03/62/59/328036259.db2.gz VUHWUIWIJBINHV-KRWDZBQOSA-N 1 1 296.414 4.588 20 0 CJADMO Cc1ccc([C@H]2CCCC[N@H+]2Cc2ncc(C3CC3)o2)cc1 ZINC000534120073 328036239 /nfs/dbraw/zinc/03/62/39/328036239.db2.gz VUHWUIWIJBINHV-QGZVFWFLSA-N 1 1 296.414 4.588 20 0 CJADMO Cc1ccc([C@H]2CCCC[N@@H+]2Cc2ncc(C3CC3)o2)cc1 ZINC000534120073 328036237 /nfs/dbraw/zinc/03/62/37/328036237.db2.gz VUHWUIWIJBINHV-QGZVFWFLSA-N 1 1 296.414 4.588 20 0 CJADMO CC(C)[N@@H+](Cc1cccnc1)Cc1cccc2ccccc21 ZINC000534201944 328038287 /nfs/dbraw/zinc/03/82/87/328038287.db2.gz PEPQJODMBVOJAL-UHFFFAOYSA-N 1 1 290.410 4.645 20 0 CJADMO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1cccc2ccccc21 ZINC000534219212 328039900 /nfs/dbraw/zinc/03/99/00/328039900.db2.gz SMGZGKORTJIKQS-FQEVSTJZSA-N 1 1 290.410 4.818 20 0 CJADMO CC[C@H](c1ccncc1)[N@@H+](C)Cc1cccc2ccccc21 ZINC000534219213 328039795 /nfs/dbraw/zinc/03/97/95/328039795.db2.gz 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ZINC000534545315 328306350 /nfs/dbraw/zinc/30/63/50/328306350.db2.gz JCVCULKPCVOHBN-JTQLQIEISA-N 1 1 289.728 4.595 20 0 CJADMO C[C@H](c1ccccc1Cl)[N@@H+]1CC=C(C(F)(F)F)CC1 ZINC000534545316 328306206 /nfs/dbraw/zinc/30/62/06/328306206.db2.gz JCVCULKPCVOHBN-SNVBAGLBSA-N 1 1 289.728 4.595 20 0 CJADMO C[C@H](c1ccccc1Cl)[N@H+]1CC=C(C(F)(F)F)CC1 ZINC000534545316 328306204 /nfs/dbraw/zinc/30/62/04/328306204.db2.gz JCVCULKPCVOHBN-SNVBAGLBSA-N 1 1 289.728 4.595 20 0 CJADMO c1oc(-c2ccccc2)nc1C[N@H+]1CCCC12CCCCC2 ZINC000534666571 328345450 /nfs/dbraw/zinc/34/54/50/328345450.db2.gz LQLXMFQIMIIXGF-UHFFFAOYSA-N 1 1 296.414 4.640 20 0 CJADMO Cc1ccc(C)c([C@@H]2CCC[N@H+]2Cc2ncc(C3CC3)o2)c1 ZINC000534843286 328363825 /nfs/dbraw/zinc/36/38/25/328363825.db2.gz UCHNOSIPVHTNMW-KRWDZBQOSA-N 1 1 296.414 4.506 20 0 CJADMO Cc1ccc(C)c([C@H]2CCC[N@H+]2Cc2ncc(C3CC3)o2)c1 ZINC000534843287 328363930 /nfs/dbraw/zinc/36/39/30/328363930.db2.gz UCHNOSIPVHTNMW-QGZVFWFLSA-N 1 1 296.414 4.506 20 0 CJADMO CCC[N@@H+](Cc1ncc(C2CC2)o1)[C@@H](CC)c1ccccc1 ZINC000534848210 328364050 /nfs/dbraw/zinc/36/40/50/328364050.db2.gz HEVFRIWFWAGJNJ-KRWDZBQOSA-N 1 1 298.430 4.915 20 0 CJADMO CCC[N@@H+](Cc1ncc(C2CC2)o1)[C@H](CC)c1ccccc1 ZINC000534848211 328364245 /nfs/dbraw/zinc/36/42/45/328364245.db2.gz HEVFRIWFWAGJNJ-QGZVFWFLSA-N 1 1 298.430 4.915 20 0 CJADMO Cc1ccc([C@@H]2CCC[N@H+]2Cc2ncc(C3CC3)o2)cc1C ZINC000534848383 328364074 /nfs/dbraw/zinc/36/40/74/328364074.db2.gz MWYGFCYDQRHZED-KRWDZBQOSA-N 1 1 296.414 4.506 20 0 CJADMO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2ncc(C3CC3)o2)cc1C ZINC000534848383 328364072 /nfs/dbraw/zinc/36/40/72/328364072.db2.gz MWYGFCYDQRHZED-KRWDZBQOSA-N 1 1 296.414 4.506 20 0 CJADMO Cc1ccc([C@H]2CCC[N@H+]2Cc2ncc(C3CC3)o2)cc1C ZINC000534848384 328364251 /nfs/dbraw/zinc/36/42/51/328364251.db2.gz MWYGFCYDQRHZED-QGZVFWFLSA-N 1 1 296.414 4.506 20 0 CJADMO Cc1ccc([C@H]2CCC[N@@H+]2Cc2ncc(C3CC3)o2)cc1C ZINC000534848384 328364250 /nfs/dbraw/zinc/36/42/50/328364250.db2.gz MWYGFCYDQRHZED-QGZVFWFLSA-N 1 1 296.414 4.506 20 0 CJADMO CCCCC[N@@H+](Cc1ncc(C2CC2)o1)[C@@H](C)CCC ZINC000534858472 328365575 /nfs/dbraw/zinc/36/55/75/328365575.db2.gz ZSJBLMKDRFTEBT-AWEZNQCLSA-N 1 1 278.440 4.733 20 0 CJADMO CCCCC[N@@H+](Cc1ncc(C2CC2)o1)[C@H](C)CCC ZINC000534858473 328365555 /nfs/dbraw/zinc/36/55/55/328365555.db2.gz ZSJBLMKDRFTEBT-CQSZACIVSA-N 1 1 278.440 4.733 20 0 CJADMO CC[N@@H+](Cc1ccccn1)[C@@H](C)c1cccc2ccccc21 ZINC000535011252 328376520 /nfs/dbraw/zinc/37/65/20/328376520.db2.gz LKMMISBZEPRTSP-INIZCTEOSA-N 1 1 290.410 4.818 20 0 CJADMO CC[N@@H+](Cc1ccccn1)[C@H](C)c1cccc2ccccc21 ZINC000535011259 328376565 /nfs/dbraw/zinc/37/65/65/328376565.db2.gz LKMMISBZEPRTSP-MRXNPFEDSA-N 1 1 290.410 4.818 20 0 CJADMO Cc1[nH+]ccn1CCS[C@@H](C)c1cccc2ccccc21 ZINC000535059028 328381693 /nfs/dbraw/zinc/38/16/93/328381693.db2.gz ZIOUTOCVQNAHSG-AWEZNQCLSA-N 1 1 296.439 4.839 20 0 CJADMO Cc1[nH+]ccn1CCS[C@H](C)c1cccc2ccccc21 ZINC000535059029 328381690 /nfs/dbraw/zinc/38/16/90/328381690.db2.gz ZIOUTOCVQNAHSG-CQSZACIVSA-N 1 1 296.439 4.839 20 0 CJADMO CC(C)[N@@H+](Cc1cccs1)Cc1ccnc2ccccc12 ZINC000535067173 328382818 /nfs/dbraw/zinc/38/28/18/328382818.db2.gz HGNNSBHIZMMFQA-UHFFFAOYSA-N 1 1 296.439 4.707 20 0 CJADMO c1c2ccccc2sc1C[N@H+]1CCC[C@H]1c1ccccn1 ZINC000535067661 328383035 /nfs/dbraw/zinc/38/30/35/328383035.db2.gz XPUKMGXLOLWNHC-KRWDZBQOSA-N 1 1 294.423 4.633 20 0 CJADMO c1c2ccccc2sc1C[N@H+]1CCC[C@@H]1c1ccccn1 ZINC000535067662 328382948 /nfs/dbraw/zinc/38/29/48/328382948.db2.gz XPUKMGXLOLWNHC-QGZVFWFLSA-N 1 1 294.423 4.633 20 0 CJADMO c1cncc(-c2cccc(C[N@@H+](C3CC3)C3CCCC3)c2)c1 ZINC000535069263 328383524 /nfs/dbraw/zinc/38/35/24/328383524.db2.gz NLKZJABVHAQBQG-UHFFFAOYSA-N 1 1 292.426 4.656 20 0 CJADMO c1nc(C2CCCC2)sc1C[N@@H+](C1CC1)C1CCCC1 ZINC000535069373 328383604 /nfs/dbraw/zinc/38/36/04/328383604.db2.gz AUDRSOYGCDXYRZ-UHFFFAOYSA-N 1 1 290.476 4.708 20 0 CJADMO Cc1cccc([C@@H]2CCC[N@H+]2Cc2cnc(C3CC3)s2)c1 ZINC000535072180 328383999 /nfs/dbraw/zinc/38/39/99/328383999.db2.gz VUOOIAGAASQOTL-KRWDZBQOSA-N 1 1 298.455 4.666 20 0 CJADMO Cc1cccc([C@H]2CCC[N@H+]2Cc2cnc(C3CC3)s2)c1 ZINC000535072181 328384033 /nfs/dbraw/zinc/38/40/33/328384033.db2.gz VUOOIAGAASQOTL-QGZVFWFLSA-N 1 1 298.455 4.666 20 0 CJADMO Cc1ccsc1C[N@H+](C)[C@H](C)c1c(F)cccc1F ZINC000535072258 328384044 /nfs/dbraw/zinc/38/40/44/328384044.db2.gz YTISNJDUJGEUMI-LLVKDONJSA-N 1 1 281.371 4.528 20 0 CJADMO Cc1ccsc1C[N@@H+](C)[C@H](C)c1c(F)cccc1F ZINC000535072258 328384043 /nfs/dbraw/zinc/38/40/43/328384043.db2.gz YTISNJDUJGEUMI-LLVKDONJSA-N 1 1 281.371 4.528 20 0 CJADMO Cc1ccsc1C[N@H+](C)[C@@H](C)c1c(F)cccc1F ZINC000535072259 328384147 /nfs/dbraw/zinc/38/41/47/328384147.db2.gz YTISNJDUJGEUMI-NSHDSACASA-N 1 1 281.371 4.528 20 0 CJADMO Cc1ccsc1C[N@@H+](C)[C@@H](C)c1c(F)cccc1F ZINC000535072259 328384146 /nfs/dbraw/zinc/38/41/46/328384146.db2.gz YTISNJDUJGEUMI-NSHDSACASA-N 1 1 281.371 4.528 20 0 CJADMO CC(C)[N@H+](Cc1ccc(-c2ccncc2)cc1F)CC1CC1 ZINC000535072815 328384395 /nfs/dbraw/zinc/38/43/95/328384395.db2.gz XGSQZSJLOAQVAI-UHFFFAOYSA-N 1 1 298.405 4.508 20 0 CJADMO CC(C)[N@@H+](Cc1csc2ccccc12)Cc1ccccn1 ZINC000535082849 328385494 /nfs/dbraw/zinc/38/54/94/328385494.db2.gz GYBMEGAVUFHCNS-UHFFFAOYSA-N 1 1 296.439 4.707 20 0 CJADMO C[C@@H]([N@@H+](C)Cc1cnc(-c2ccsc2)s1)C(C)(C)C ZINC000535085108 328386424 /nfs/dbraw/zinc/38/64/24/328386424.db2.gz PFNYGJOERNARKS-LLVKDONJSA-N 1 1 294.489 4.738 20 0 CJADMO C[C@H]([N@@H+](C)Cc1cnc(-c2ccsc2)s1)C(C)(C)C ZINC000535085109 328386410 /nfs/dbraw/zinc/38/64/10/328386410.db2.gz PFNYGJOERNARKS-NSHDSACASA-N 1 1 294.489 4.738 20 0 CJADMO Cc1nc(C(C)C)sc1[C@H](C)[N@@H+](C)Cc1ccccc1 ZINC000535212181 328394896 /nfs/dbraw/zinc/39/48/96/328394896.db2.gz OOFJMLDOJIYESU-AWEZNQCLSA-N 1 1 288.460 4.768 20 0 CJADMO Cc1nc(C(C)C)sc1[C@@H](C)[N@@H+](C)Cc1ccccc1 ZINC000535212191 328394779 /nfs/dbraw/zinc/39/47/79/328394779.db2.gz OOFJMLDOJIYESU-CQSZACIVSA-N 1 1 288.460 4.768 20 0 CJADMO CC[C@H]1CCCCC[N@H+]1Cc1ncc(-c2ccccc2C)o1 ZINC000535260319 328398657 /nfs/dbraw/zinc/39/86/57/328398657.db2.gz IJVCEIYHISEVFC-INIZCTEOSA-N 1 1 298.430 4.805 20 0 CJADMO CC[C@@H]1CCCCC[N@H+]1Cc1ncc(-c2ccccc2C)o1 ZINC000535260331 328398740 /nfs/dbraw/zinc/39/87/40/328398740.db2.gz IJVCEIYHISEVFC-MRXNPFEDSA-N 1 1 298.430 4.805 20 0 CJADMO CC[N@@H+](Cc1ncc(-c2ccccc2C)o1)C1CCCCC1 ZINC000535260522 328398858 /nfs/dbraw/zinc/39/88/58/328398858.db2.gz KQWXLHPCUXYURS-UHFFFAOYSA-N 1 1 298.430 4.805 20 0 CJADMO Cc1ccccc1-c1cnc(C[N@H+](C)C2CCC(C)CC2)o1 ZINC000535260551 328398667 /nfs/dbraw/zinc/39/86/67/328398667.db2.gz KYNWYDJSLYPEPU-UHFFFAOYSA-N 1 1 298.430 4.661 20 0 CJADMO Cc1ccccc1-c1cnc(C[N@H+]2CCCC(C)(C)CC2)o1 ZINC000535261287 328399033 /nfs/dbraw/zinc/39/90/33/328399033.db2.gz OLEHNZMZYXCJLX-UHFFFAOYSA-N 1 1 298.430 4.662 20 0 CJADMO Cc1ccccc1-c1cnc(C[N@H+](CCC(C)C)C2CC2)o1 ZINC000535261625 328399081 /nfs/dbraw/zinc/39/90/81/328399081.db2.gz RYZLXIIWISOMMZ-UHFFFAOYSA-N 1 1 298.430 4.661 20 0 CJADMO CC[N@@H+](Cc1ncc(-c2ccccc2C)o1)[C@@H](C)C(C)C ZINC000535261681 328399017 /nfs/dbraw/zinc/39/90/17/328399017.db2.gz UFLDBNHRGYECOC-HNNXBMFYSA-N 1 1 286.419 4.516 20 0 CJADMO CC[N@@H+](Cc1ncc(-c2ccccc2C)o1)[C@H](C)C(C)C ZINC000535261691 328398958 /nfs/dbraw/zinc/39/89/58/328398958.db2.gz UFLDBNHRGYECOC-OAHLLOKOSA-N 1 1 286.419 4.516 20 0 CJADMO Cc1ccccc1-c1cnc(C[N@H+](C)[C@@H]2CCC[C@@H](C)C2)o1 ZINC000535262299 328399430 /nfs/dbraw/zinc/39/94/30/328399430.db2.gz XAEDPPQJICRVLI-GDBMZVCRSA-N 1 1 298.430 4.661 20 0 CJADMO Cc1ccccc1-c1cnc(C[N@H+](C)[C@@H]2CCC[C@H](C)C2)o1 ZINC000535262302 328399419 /nfs/dbraw/zinc/39/94/19/328399419.db2.gz XAEDPPQJICRVLI-GOEBONIOSA-N 1 1 298.430 4.661 20 0 CJADMO Cc1ccccc1-c1cnc(C[N@H+](C)[C@H]2CCC[C@H](C)C2)o1 ZINC000535262303 328399594 /nfs/dbraw/zinc/39/95/94/328399594.db2.gz XAEDPPQJICRVLI-HOCLYGCPSA-N 1 1 298.430 4.661 20 0 CJADMO Cc1ccccc1-c1cnc(C[N@H+](C)[C@H]2CCC[C@@H](C)C2)o1 ZINC000535262309 328399776 /nfs/dbraw/zinc/39/97/76/328399776.db2.gz XAEDPPQJICRVLI-ZBFHGGJFSA-N 1 1 298.430 4.661 20 0 CJADMO CCSc1ccc([C@@H](C)[NH2+][C@@H](C)c2cscn2)cc1 ZINC000535780011 328631164 /nfs/dbraw/zinc/63/11/64/328631164.db2.gz PJWSLGCZBBMABG-NEPJUHHUSA-N 1 1 292.473 4.667 20 0 CJADMO CCSc1ccc([C@H](C)[NH2+][C@H](C)c2cscn2)cc1 ZINC000535780012 328631336 /nfs/dbraw/zinc/63/13/36/328631336.db2.gz PJWSLGCZBBMABG-NWDGAFQWSA-N 1 1 292.473 4.667 20 0 CJADMO CCSc1ccc([C@H](C)[NH2+][C@@H](C)c2cscn2)cc1 ZINC000535780013 328631340 /nfs/dbraw/zinc/63/13/40/328631340.db2.gz PJWSLGCZBBMABG-RYUDHWBXSA-N 1 1 292.473 4.667 20 0 CJADMO CCSc1ccc([C@@H](C)[NH2+][C@H](C)c2cscn2)cc1 ZINC000535780014 328631329 /nfs/dbraw/zinc/63/13/29/328631329.db2.gz PJWSLGCZBBMABG-VXGBXAGGSA-N 1 1 292.473 4.667 20 0 CJADMO Cc1ccccc1[C@H](C(C)C)[N@@H+](C)Cc1ncc(C2CC2)o1 ZINC000536365361 327232124 /nfs/dbraw/zinc/23/21/24/327232124.db2.gz PKTHERYMFKMILF-IBGZPJMESA-N 1 1 298.430 4.690 20 0 CJADMO Cc1ccccc1[C@@H](C(C)C)[N@@H+](C)Cc1ncc(C2CC2)o1 ZINC000536365362 327232044 /nfs/dbraw/zinc/23/20/44/327232044.db2.gz PKTHERYMFKMILF-LJQANCHMSA-N 1 1 298.430 4.690 20 0 CJADMO Clc1oc2ccccc2c1C[NH2+]C1(c2ccccc2)CC1 ZINC000536409849 327236320 /nfs/dbraw/zinc/23/63/20/327236320.db2.gz MSRQXWYEVYHXAH-UHFFFAOYSA-N 1 1 297.785 4.865 20 0 CJADMO c1ccc2c(c1)cccc2C[N@H+]1CCC[C@H]1c1ccncc1 ZINC000536460785 327240106 /nfs/dbraw/zinc/24/01/06/327240106.db2.gz XFHSWUXOYYVGDJ-FQEVSTJZSA-N 1 1 288.394 4.572 20 0 CJADMO c1ccc2c(c1)cccc2C[N@H+]1CCC[C@@H]1c1ccncc1 ZINC000536460805 327240043 /nfs/dbraw/zinc/24/00/43/327240043.db2.gz XFHSWUXOYYVGDJ-HXUWFJFHSA-N 1 1 288.394 4.572 20 0 CJADMO C[C@@H](c1ccncc1)[N@@H+](C)Cc1ccc(C(C)(C)C)cc1 ZINC000536475047 327241016 /nfs/dbraw/zinc/24/10/16/327241016.db2.gz GJHIFTRTTLHKQR-HNNXBMFYSA-N 1 1 282.431 4.572 20 0 CJADMO C[C@H](c1ccncc1)[N@@H+](C)Cc1ccc(C(C)(C)C)cc1 ZINC000536475068 327241039 /nfs/dbraw/zinc/24/10/39/327241039.db2.gz GJHIFTRTTLHKQR-OAHLLOKOSA-N 1 1 282.431 4.572 20 0 CJADMO Cc1[nH+]ccn1CCCS[C@H](C)c1ccc(Cl)cc1 ZINC000536524250 327253547 /nfs/dbraw/zinc/25/35/47/327253547.db2.gz RKFCZGOXODVLBG-GFCCVEGCSA-N 1 1 294.851 4.729 20 0 CJADMO Cc1[nH+]ccn1CCCS[C@@H](C)c1ccc(Cl)cc1 ZINC000536524251 327253449 /nfs/dbraw/zinc/25/34/49/327253449.db2.gz RKFCZGOXODVLBG-LBPRGKRZSA-N 1 1 294.851 4.729 20 0 CJADMO C[C@H]([NH2+][C@H](c1ccc(Cl)cc1)C1CC1)c1cscn1 ZINC000536626319 328670252 /nfs/dbraw/zinc/67/02/52/328670252.db2.gz ZGRSZWFIZQQTGB-BONVTDFDSA-N 1 1 292.835 4.598 20 0 CJADMO C[C@H]([NH2+][C@@H](c1ccc(Cl)cc1)C1CC1)c1cscn1 ZINC000536626321 328670226 /nfs/dbraw/zinc/67/02/26/328670226.db2.gz ZGRSZWFIZQQTGB-ZUZCIYMTSA-N 1 1 292.835 4.598 20 0 CJADMO CCC(C)(C)c1ccc(C[NH2+][C@H](C)c2cscn2)cc1 ZINC000536836344 330231873 /nfs/dbraw/zinc/23/18/73/330231873.db2.gz AAXHOVITACNAPV-CYBMUJFWSA-N 1 1 288.460 4.682 20 0 CJADMO CCC(C)(C)c1ccc(C[NH2+][C@@H](C)c2cscn2)cc1 ZINC000536836345 330231842 /nfs/dbraw/zinc/23/18/42/330231842.db2.gz AAXHOVITACNAPV-ZDUSSCGKSA-N 1 1 288.460 4.682 20 0 CJADMO CCc1ccc([C@@H](C)[NH2+][C@H](CC)c2cc(F)ccc2F)o1 ZINC000536869062 330264235 /nfs/dbraw/zinc/26/42/35/330264235.db2.gz IAUDUJAEMVKPBV-BDJLRTHQSA-N 1 1 293.357 4.922 20 0 CJADMO CCc1ccc([C@@H](C)[NH2+][C@@H](CC)c2cc(F)ccc2F)o1 ZINC000536869119 330264169 /nfs/dbraw/zinc/26/41/69/330264169.db2.gz IAUDUJAEMVKPBV-BZNIZROVSA-N 1 1 293.357 4.922 20 0 CJADMO CCc1ccc([C@H](C)[NH2+][C@H](CC)c2cc(F)ccc2F)o1 ZINC000536869121 330264184 /nfs/dbraw/zinc/26/41/84/330264184.db2.gz IAUDUJAEMVKPBV-MEDUHNTESA-N 1 1 293.357 4.922 20 0 CJADMO CCc1ccc([C@H](C)[NH2+][C@@H](CC)c2cc(F)ccc2F)o1 ZINC000536869124 330264280 /nfs/dbraw/zinc/26/42/80/330264280.db2.gz IAUDUJAEMVKPBV-ZBEGNZNMSA-N 1 1 293.357 4.922 20 0 CJADMO CC(C)C[C@H]([NH2+][C@H](C)c1cscn1)c1cccs1 ZINC000536875578 330310485 /nfs/dbraw/zinc/31/04/85/330310485.db2.gz JDACTUPGAYSJKB-NEPJUHHUSA-N 1 1 280.462 4.643 20 0 CJADMO CC(C)C[C@@H]([NH2+][C@@H](C)c1cscn1)c1cccs1 ZINC000536875582 330310528 /nfs/dbraw/zinc/31/05/28/330310528.db2.gz JDACTUPGAYSJKB-NWDGAFQWSA-N 1 1 280.462 4.643 20 0 CJADMO CC(C)C[C@H]([NH2+][C@@H](C)c1cscn1)c1cccs1 ZINC000536875584 330310448 /nfs/dbraw/zinc/31/04/48/330310448.db2.gz JDACTUPGAYSJKB-RYUDHWBXSA-N 1 1 280.462 4.643 20 0 CJADMO CC(C)C[C@@H]([NH2+][C@H](C)c1cscn1)c1cccs1 ZINC000536875585 330310495 /nfs/dbraw/zinc/31/04/95/330310495.db2.gz JDACTUPGAYSJKB-VXGBXAGGSA-N 1 1 280.462 4.643 20 0 CJADMO CCC[C@H]([NH2+]Cc1nc2ccc(F)cc2o1)c1ccccc1 ZINC000537040703 330393748 /nfs/dbraw/zinc/39/37/48/330393748.db2.gz OCCLRUHKLZLKOE-HNNXBMFYSA-N 1 1 298.361 4.598 20 0 CJADMO CCC[C@@H]([NH2+]Cc1nc2ccc(F)cc2o1)c1ccccc1 ZINC000537040704 330393701 /nfs/dbraw/zinc/39/37/01/330393701.db2.gz OCCLRUHKLZLKOE-OAHLLOKOSA-N 1 1 298.361 4.598 20 0 CJADMO CCC[C@H]([NH2+]Cc1ccon1)c1ccc(Cl)c(Cl)c1 ZINC000537060330 330395944 /nfs/dbraw/zinc/39/59/44/330395944.db2.gz YRXQNLVMAKFHII-AWEZNQCLSA-N 1 1 299.201 4.612 20 0 CJADMO CCC[C@@H]([NH2+]Cc1ccon1)c1ccc(Cl)c(Cl)c1 ZINC000537060331 330395967 /nfs/dbraw/zinc/39/59/67/330395967.db2.gz YRXQNLVMAKFHII-CQSZACIVSA-N 1 1 299.201 4.612 20 0 CJADMO CCC(CC)[C@H]([NH2+]Cc1nc(C)c(C)o1)c1cccs1 ZINC000537078932 330398350 /nfs/dbraw/zinc/39/83/50/330398350.db2.gz XCYFDMORKPPVAN-INIZCTEOSA-N 1 1 292.448 4.620 20 0 CJADMO CCC(CC)[C@@H]([NH2+]Cc1nc(C)c(C)o1)c1cccs1 ZINC000537078933 330398319 /nfs/dbraw/zinc/39/83/19/330398319.db2.gz XCYFDMORKPPVAN-MRXNPFEDSA-N 1 1 292.448 4.620 20 0 CJADMO CC(C)(C)c1cnc(C[NH2+]C2(c3ccccc3)CCCC2)o1 ZINC000537087017 330397652 /nfs/dbraw/zinc/39/76/52/330397652.db2.gz XHJZBWSBKNHCGM-UHFFFAOYSA-N 1 1 298.430 4.531 20 0 CJADMO Cc1ccccc1-c1cnc(C[NH2+][C@@H](C)c2ccccc2)o1 ZINC000537099260 330399341 /nfs/dbraw/zinc/39/93/41/330399341.db2.gz PSRYOKGRHGZLAJ-HNNXBMFYSA-N 1 1 292.382 4.501 20 0 CJADMO Cc1ccccc1-c1cnc(C[NH2+][C@H](C)c2ccccc2)o1 ZINC000537100930 330399320 /nfs/dbraw/zinc/39/93/20/330399320.db2.gz PSRYOKGRHGZLAJ-OAHLLOKOSA-N 1 1 292.382 4.501 20 0 CJADMO Cc1ccc(-c2nc(C[NH2+][C@H](C)c3ccccc3)cs2)o1 ZINC000537102701 330399402 /nfs/dbraw/zinc/39/94/02/330399402.db2.gz OUMXSHOFDXBIID-CYBMUJFWSA-N 1 1 298.411 4.562 20 0 CJADMO Cc1[nH+]ccn1CCCSCc1ccc2ccccc2c1 ZINC000537317860 330432573 /nfs/dbraw/zinc/43/25/73/330432573.db2.gz LQGIIPKWMZPUCZ-UHFFFAOYSA-N 1 1 296.439 4.668 20 0 CJADMO CC1(C)CC[C@@H]2C[C@@H]([NH2+]Cc3cscn3)c3cccc1c32 ZINC000537384498 330435525 /nfs/dbraw/zinc/43/55/25/330435525.db2.gz SANKCOLQMBKDGG-MLGOLLRUSA-N 1 1 298.455 4.533 20 0 CJADMO CCc1ccc([C@H](C)Nc2ccc([NH+]3CCCC3)cc2C)o1 ZINC000537406895 330434866 /nfs/dbraw/zinc/43/48/66/330434866.db2.gz HQMJZBNXDVHCSX-HNNXBMFYSA-N 1 1 298.430 4.924 20 0 CJADMO CCSc1ccccc1[C@@H](C)Nc1cc(C)cc[nH+]1 ZINC000537407447 330434908 /nfs/dbraw/zinc/43/49/08/330434908.db2.gz PNNUZBZOAGPMCH-CYBMUJFWSA-N 1 1 272.417 4.675 20 0 CJADMO CC[C@H](Nc1cc(C)cc[nH+]1)c1ccc(Cl)s1 ZINC000537408031 330435006 /nfs/dbraw/zinc/43/50/06/330435006.db2.gz ZVVAGKGCXISEIR-JTQLQIEISA-N 1 1 266.797 4.668 20 0 CJADMO CC[C@@H](Nc1cc(C)cc[nH+]1)c1ccc(Cl)s1 ZINC000537408044 330435015 /nfs/dbraw/zinc/43/50/15/330435015.db2.gz ZVVAGKGCXISEIR-SNVBAGLBSA-N 1 1 266.797 4.668 20 0 CJADMO COc1ccc2cc([C@H](C)Nc3cc(C)cc[nH+]3)ccc2c1 ZINC000537409527 330435158 /nfs/dbraw/zinc/43/51/58/330435158.db2.gz RWDUFULEYXSRLY-AWEZNQCLSA-N 1 1 292.382 4.725 20 0 CJADMO COc1ccc2cc([C@@H](C)Nc3cc(C)cc[nH+]3)ccc2c1 ZINC000537409528 330435169 /nfs/dbraw/zinc/43/51/69/330435169.db2.gz RWDUFULEYXSRLY-CQSZACIVSA-N 1 1 292.382 4.725 20 0 CJADMO CC[C@@H](C)[C@H](C)Nc1cccc(Cn2cc[nH+]c2C(C)C)c1 ZINC000537425419 330436505 /nfs/dbraw/zinc/43/65/05/330436505.db2.gz OJAHWMZZIMHVSQ-CVEARBPZSA-N 1 1 299.462 4.901 20 0 CJADMO CC[C@H](C)[C@H](C)Nc1cccc(Cn2cc[nH+]c2C(C)C)c1 ZINC000537425665 330436550 /nfs/dbraw/zinc/43/65/50/330436550.db2.gz OJAHWMZZIMHVSQ-HOTGVXAUSA-N 1 1 299.462 4.901 20 0 CJADMO C[C@@H](Nc1ccc2c(c1)[nH+]c(C(C)(C)C)n2C)c1ccco1 ZINC000537524838 330439826 /nfs/dbraw/zinc/43/98/26/330439826.db2.gz VYOLYNYDAMASDF-GFCCVEGCSA-N 1 1 297.402 4.637 20 0 CJADMO C[C@H](Nc1ccc2c(c1)[nH+]c(C(C)(C)C)n2C)c1ccco1 ZINC000537524840 330439828 /nfs/dbraw/zinc/43/98/28/330439828.db2.gz VYOLYNYDAMASDF-LBPRGKRZSA-N 1 1 297.402 4.637 20 0 CJADMO CCc1ccc([C@@H](C)[NH2+][C@@H]2CCOc3c(CC)cccc32)o1 ZINC000537974024 333552396 /nfs/dbraw/zinc/55/23/96/333552396.db2.gz KMUBSIOSDBJOKS-CXAGYDPISA-N 1 1 299.414 4.579 20 0 CJADMO CCc1ccc([C@H](C)[NH2+][C@H]2CCOc3c(CC)cccc32)o1 ZINC000537974026 333552700 /nfs/dbraw/zinc/55/27/00/333552700.db2.gz KMUBSIOSDBJOKS-GUYCJALGSA-N 1 1 299.414 4.579 20 0 CJADMO CCc1ccc([C@H](C)[NH2+][C@@H]2CCOc3c(CC)cccc32)o1 ZINC000537974027 333552694 /nfs/dbraw/zinc/55/26/94/333552694.db2.gz KMUBSIOSDBJOKS-SUMWQHHRSA-N 1 1 299.414 4.579 20 0 CJADMO Cc1ccccc1[C@H]([NH2+]Cc1ccon1)[C@@H]1CCC[C@@H](C)C1 ZINC000538160669 333577202 /nfs/dbraw/zinc/57/72/02/333577202.db2.gz LRYYGYOSSVPFJJ-IDHHARJASA-N 1 1 298.430 4.640 20 0 CJADMO Cc1ccccc1[C@H]([NH2+]Cc1ccon1)[C@@H]1CCC[C@H](C)C1 ZINC000538160672 326982932 /nfs/dbraw/zinc/98/29/32/326982932.db2.gz LRYYGYOSSVPFJJ-ZSZQSSIHSA-N 1 1 298.430 4.640 20 0 CJADMO CSc1ccc([C@H](C)[C@@H](C)c2[nH+]ccn2C)c(Cl)c1 ZINC000538208818 333579462 /nfs/dbraw/zinc/57/94/62/333579462.db2.gz SDDGODZBZAAPCD-GHMZBOCLSA-N 1 1 294.851 4.703 20 0 CJADMO CSc1ccc([C@@H](C)[C@H](C)c2[nH+]ccn2C)c(Cl)c1 ZINC000538208823 333579141 /nfs/dbraw/zinc/57/91/41/333579141.db2.gz SDDGODZBZAAPCD-QWRGUYRKSA-N 1 1 294.851 4.703 20 0 CJADMO CSc1ccc([C@@H](C)[C@@H](C)c2[nH+]ccn2C)c(Cl)c1 ZINC000538208824 333579148 /nfs/dbraw/zinc/57/91/48/333579148.db2.gz SDDGODZBZAAPCD-WDEREUQCSA-N 1 1 294.851 4.703 20 0 CJADMO CC[C@@H](C)[C@H]([NH2+]Cc1ncc(C)o1)c1ccc(Cl)cc1 ZINC000538215979 333579923 /nfs/dbraw/zinc/57/99/23/333579923.db2.gz WWRYBIDNEYKDAQ-BZNIZROVSA-N 1 1 292.810 4.513 20 0 CJADMO CC[C@H](C)[C@@H]([NH2+]Cc1ncc(C)o1)c1ccc(Cl)cc1 ZINC000538215980 333579926 /nfs/dbraw/zinc/57/99/26/333579926.db2.gz WWRYBIDNEYKDAQ-MEDUHNTESA-N 1 1 292.810 4.513 20 0 CJADMO CC[C@H](C)[C@H]([NH2+]Cc1ncc(C)o1)c1ccc(Cl)cc1 ZINC000538215981 333580019 /nfs/dbraw/zinc/58/00/19/333580019.db2.gz WWRYBIDNEYKDAQ-ZBEGNZNMSA-N 1 1 292.810 4.513 20 0 CJADMO CCc1cnc(C[NH2+][C@H](CC2CCCC2)c2ccccc2)o1 ZINC000538230291 333580386 /nfs/dbraw/zinc/58/03/86/333580386.db2.gz ZESXKBFKKFPBBN-GOSISDBHSA-N 1 1 298.430 4.648 20 0 CJADMO CC[C@@H](SCCCn1cc[nH+]c1C)c1ccc(F)cc1 ZINC000538414848 333589657 /nfs/dbraw/zinc/58/96/57/333589657.db2.gz QGUSZGBNXUUQPT-MRXNPFEDSA-N 1 1 292.423 4.605 20 0 CJADMO Cc1cc[nH+]c(N[C@H](CC(C)C)c2cccs2)c1 ZINC000538509407 333601523 /nfs/dbraw/zinc/60/15/23/333601523.db2.gz RARGVIFFTOQTDT-CYBMUJFWSA-N 1 1 260.406 4.651 20 0 CJADMO Cc1cc[nH+]c(N[C@@H](CC(C)C)c2cccs2)c1 ZINC000538509408 333601518 /nfs/dbraw/zinc/60/15/18/333601518.db2.gz RARGVIFFTOQTDT-ZDUSSCGKSA-N 1 1 260.406 4.651 20 0 CJADMO Cc1cc[nH+]c(N[C@@H](C)[C@@H](C)c2nc3ccccc3s2)c1 ZINC000538509978 333601721 /nfs/dbraw/zinc/60/17/21/333601721.db2.gz FZDATIGCXBVDME-OLZOCXBDSA-N 1 1 297.427 4.604 20 0 CJADMO Cc1cc[nH+]c(N[C@@H](C)[C@H](C)c2nc3ccccc3s2)c1 ZINC000538509980 333601626 /nfs/dbraw/zinc/60/16/26/333601626.db2.gz FZDATIGCXBVDME-STQMWFEESA-N 1 1 297.427 4.604 20 0 CJADMO CC[C@@H](Nc1cccc(Cn2cc[nH+]c2C(C)C)c1)C1CC1 ZINC000538528665 333604336 /nfs/dbraw/zinc/60/43/36/333604336.db2.gz SUBMRXLSLGFGEA-GOSISDBHSA-N 1 1 297.446 4.655 20 0 CJADMO C[C@@H]([NH2+]C1(c2cccc(F)c2)CC1)c1ccccc1Cl ZINC000538551071 333605500 /nfs/dbraw/zinc/60/55/00/333605500.db2.gz AQVLZUROQDQZCW-GFCCVEGCSA-N 1 1 289.781 4.819 20 0 CJADMO C[C@H]([NH2+]C1(c2cccc(F)c2)CC1)c1ccccc1Cl ZINC000538551072 333605505 /nfs/dbraw/zinc/60/55/05/333605505.db2.gz AQVLZUROQDQZCW-LBPRGKRZSA-N 1 1 289.781 4.819 20 0 CJADMO CCOc1ccccc1[C@H](C)[NH2+]C1(c2ccccc2F)CC1 ZINC000538551117 333605536 /nfs/dbraw/zinc/60/55/36/333605536.db2.gz DGDGNXQLRUZSEV-AWEZNQCLSA-N 1 1 299.389 4.564 20 0 CJADMO C[C@@H]([NH2+]C1(c2ccccc2F)CC1)c1cc2ccccc2o1 ZINC000538554031 333605927 /nfs/dbraw/zinc/60/59/27/333605927.db2.gz OYZFCUIFQPUUBG-CYBMUJFWSA-N 1 1 295.357 4.912 20 0 CJADMO C[C@H]([NH2+]C1(c2ccccc2F)CC1)c1cc2ccccc2o1 ZINC000538554032 333606008 /nfs/dbraw/zinc/60/60/08/333606008.db2.gz OYZFCUIFQPUUBG-ZDUSSCGKSA-N 1 1 295.357 4.912 20 0 CJADMO CC(C)CCOc1ccccc1C[NH2+][C@@H](C)c1ccoc1 ZINC000538566763 333606655 /nfs/dbraw/zinc/60/66/55/333606655.db2.gz CZTJGRXZEXYPEF-HNNXBMFYSA-N 1 1 287.403 4.555 20 0 CJADMO C[C@H](Nc1ccc2c(c1)[nH+]c(C1CC1)n2C)c1ccccc1 ZINC000538627033 333609362 /nfs/dbraw/zinc/60/93/62/333609362.db2.gz GDFFIGONDZKSDZ-ZDUSSCGKSA-N 1 1 291.398 4.624 20 0 CJADMO C[C@H](Nc1cccc2cc[nH+]cc21)c1ccc2ccccc2n1 ZINC000538628365 333609413 /nfs/dbraw/zinc/60/94/13/333609413.db2.gz NGDZAUNRCSGHCG-AWEZNQCLSA-N 1 1 299.377 4.956 20 0 CJADMO C[C@@H](Nc1cccc2cc[nH+]cc21)c1ccc2ccccc2n1 ZINC000538628366 333609502 /nfs/dbraw/zinc/60/95/02/333609502.db2.gz NGDZAUNRCSGHCG-CQSZACIVSA-N 1 1 299.377 4.956 20 0 CJADMO Cc1ccncc1[C@H](C)[NH2+]Cc1c(Cl)cccc1Cl ZINC000538988053 333647795 /nfs/dbraw/zinc/64/77/95/333647795.db2.gz UUWBQWQKDSGFOZ-NSHDSACASA-N 1 1 295.213 4.548 20 0 CJADMO CCC(CC)[C@H]([NH2+]Cc1ncc(C2CC2)o1)c1ccccc1 ZINC000539253560 333663309 /nfs/dbraw/zinc/66/33/09/333663309.db2.gz NNVRRBVNYMEBEF-IBGZPJMESA-N 1 1 298.430 4.819 20 0 CJADMO CC[C@H]([NH2+]Cc1ncc(C(C)(C)C)o1)c1ccc(C)cc1 ZINC000539256213 333663334 /nfs/dbraw/zinc/66/33/34/333663334.db2.gz WTIMPDPGKIQMTG-HNNXBMFYSA-N 1 1 286.419 4.521 20 0 CJADMO CCC(CC)n1ccc(C[NH2+][C@@H](C)c2cccc(C)c2C)n1 ZINC000539286734 333663958 /nfs/dbraw/zinc/66/39/58/333663958.db2.gz JTIOQGULQOTWNC-INIZCTEOSA-N 1 1 299.462 4.712 20 0 CJADMO Cc1oc(-c2ccsc2)nc1C[NH2+][C@@H](C)c1ccccc1 ZINC000539303669 333665183 /nfs/dbraw/zinc/66/51/83/333665183.db2.gz QTHOOLFTAOOHDN-LBPRGKRZSA-N 1 1 298.411 4.562 20 0 CJADMO Cc1cc[nH+]c(N[C@@H]2CCSc3c(Cl)cccc32)c1 ZINC000539609403 333680827 /nfs/dbraw/zinc/68/08/27/333680827.db2.gz MDDOZTDFOJODLE-CYBMUJFWSA-N 1 1 290.819 4.692 20 0 CJADMO Cc1cc[nH+]c(N[C@H]2CCSc3c(Cl)cccc32)c1 ZINC000539609405 333680962 /nfs/dbraw/zinc/68/09/62/333680962.db2.gz MDDOZTDFOJODLE-ZDUSSCGKSA-N 1 1 290.819 4.692 20 0 CJADMO CC[C@H](Nc1cc(C)cc[nH+]1)c1ccc(OC(F)F)cc1 ZINC000539609529 333680929 /nfs/dbraw/zinc/68/09/29/333680929.db2.gz JKNIXMPQGHVIJY-AWEZNQCLSA-N 1 1 292.329 4.555 20 0 CJADMO CC[C@@H](Nc1cc(C)cc[nH+]1)c1ccc(OC(F)F)cc1 ZINC000539609530 333680907 /nfs/dbraw/zinc/68/09/07/333680907.db2.gz JKNIXMPQGHVIJY-CQSZACIVSA-N 1 1 292.329 4.555 20 0 CJADMO Cc1cc[nH+]c(N[C@H](C)c2ccc(-c3ccncc3)cc2)c1 ZINC000539609578 333680919 /nfs/dbraw/zinc/68/09/19/333680919.db2.gz UZOKJQWTIIAXSY-OAHLLOKOSA-N 1 1 289.382 4.625 20 0 CJADMO Cc1[nH+]ccn1-c1ccc([C@H](C)Nc2cccc(C)c2)cc1 ZINC000539611325 333681278 /nfs/dbraw/zinc/68/12/78/333681278.db2.gz FIALIBPHIQFZLE-HNNXBMFYSA-N 1 1 291.398 4.662 20 0 CJADMO Cc1[nH+]ccn1-c1ccc([C@@H](C)Nc2cccc(C)c2)cc1 ZINC000539611326 333681308 /nfs/dbraw/zinc/68/13/08/333681308.db2.gz FIALIBPHIQFZLE-OAHLLOKOSA-N 1 1 291.398 4.662 20 0 CJADMO CC[C@H]([NH2+]Cc1ccc([C@H]2C[C@@H]2C)o1)c1ccccc1F ZINC000539809089 333691801 /nfs/dbraw/zinc/69/18/01/333691801.db2.gz ITXJVZUBJCNWST-NUTKFTJISA-N 1 1 287.378 4.783 20 0 CJADMO CC[C@H](C)CNc1cccc(Cn2cc[nH+]c2C(C)C)c1 ZINC000540070533 333708571 /nfs/dbraw/zinc/70/85/71/333708571.db2.gz IKPVJTXJLXBVDD-HNNXBMFYSA-N 1 1 285.435 4.513 20 0 CJADMO CC[C@@H](C)CNc1cccc(Cn2cc[nH+]c2C(C)C)c1 ZINC000540070542 333708543 /nfs/dbraw/zinc/70/85/43/333708543.db2.gz IKPVJTXJLXBVDD-OAHLLOKOSA-N 1 1 285.435 4.513 20 0 CJADMO CCc1cnc(C[NH2+][C@H](c2cccs2)C(CC)CC)o1 ZINC000540380748 333727370 /nfs/dbraw/zinc/72/73/70/333727370.db2.gz QBZVAUPWZQGGKK-INIZCTEOSA-N 1 1 292.448 4.566 20 0 CJADMO CCc1cnc(C[NH2+][C@@H](c2cccs2)C(CC)CC)o1 ZINC000540380749 333727484 /nfs/dbraw/zinc/72/74/84/333727484.db2.gz QBZVAUPWZQGGKK-MRXNPFEDSA-N 1 1 292.448 4.566 20 0 CJADMO Cc1ccc(-c2cnc(C[NH2+][C@H](C)c3ccccc3)o2)cc1 ZINC000540400902 333728440 /nfs/dbraw/zinc/72/84/40/333728440.db2.gz PLOBYOMBYZDLSW-OAHLLOKOSA-N 1 1 292.382 4.501 20 0 CJADMO Cc1ccc(-c2cnc(C[NH2+][C@@H](C)c3ccccc3)o2)cc1 ZINC000540404513 333728768 /nfs/dbraw/zinc/72/87/68/333728768.db2.gz PLOBYOMBYZDLSW-HNNXBMFYSA-N 1 1 292.382 4.501 20 0 CJADMO CC[C@@H](C)[C@H]([NH2+]Cc1cc(C)on1)c1ccc(Cl)cc1 ZINC000540410834 333728912 /nfs/dbraw/zinc/72/89/12/333728912.db2.gz DXHNGXYVMRHCRA-BZNIZROVSA-N 1 1 292.810 4.513 20 0 CJADMO CC[C@H](C)[C@@H]([NH2+]Cc1cc(C)on1)c1ccc(Cl)cc1 ZINC000540410835 333728857 /nfs/dbraw/zinc/72/88/57/333728857.db2.gz DXHNGXYVMRHCRA-MEDUHNTESA-N 1 1 292.810 4.513 20 0 CJADMO Cc1[nH+]ccn1CCCSCc1cccc2ccccc21 ZINC000540614352 333738309 /nfs/dbraw/zinc/73/83/09/333738309.db2.gz ICKOFFQTSVRFRN-UHFFFAOYSA-N 1 1 296.439 4.668 20 0 CJADMO COc1ccc([C@@H](C)Nc2cc(C)cc[nH+]2)c2ccccc12 ZINC000540710816 333743225 /nfs/dbraw/zinc/74/32/25/333743225.db2.gz QHQXFJBRYJADOB-CQSZACIVSA-N 1 1 292.382 4.725 20 0 CJADMO CC(C)c1[nH+]ccn1Cc1cccc(N[C@@H](C)C(C)(C)C)c1 ZINC000540727463 333744146 /nfs/dbraw/zinc/74/41/46/333744146.db2.gz HKVSENHKKGGMEB-HNNXBMFYSA-N 1 1 299.462 4.901 20 0 CJADMO CC(C)c1[nH+]ccn1Cc1cccc(N[C@H](C)C(C)(C)C)c1 ZINC000540727468 333744142 /nfs/dbraw/zinc/74/41/42/333744142.db2.gz HKVSENHKKGGMEB-OAHLLOKOSA-N 1 1 299.462 4.901 20 0 CJADMO C[C@@H]([NH2+]C1(c2ccccc2F)CC1)c1ccccc1Cl ZINC000540754643 333746012 /nfs/dbraw/zinc/74/60/12/333746012.db2.gz WGOQKSRXNPXMEY-GFCCVEGCSA-N 1 1 289.781 4.819 20 0 CJADMO CC(C)CCOc1ccccc1C[NH2+][C@@H](C)c1ccco1 ZINC000540767637 333746537 /nfs/dbraw/zinc/74/65/37/333746537.db2.gz YFJNYIYRXRALFR-HNNXBMFYSA-N 1 1 287.403 4.555 20 0 CJADMO C[C@@H](Nc1ccc2c(c1)[nH+]c(C(C)(C)C)n2C)c1ccoc1 ZINC000540827419 333748953 /nfs/dbraw/zinc/74/89/53/333748953.db2.gz VUCKHDUHWWIFPI-GFCCVEGCSA-N 1 1 297.402 4.637 20 0 CJADMO C[C@H]([NH2+][C@@H](C)c1cccc(-c2ccccc2)c1)c1ccon1 ZINC000541767824 333791194 /nfs/dbraw/zinc/79/11/94/333791194.db2.gz LAKOMVYFGNPDRI-GJZGRUSLSA-N 1 1 292.382 4.753 20 0 CJADMO C[C@@H]([NH2+][C@@H](C)c1ccon1)c1ccc(-c2ccccc2)cc1 ZINC000541767985 333791318 /nfs/dbraw/zinc/79/13/18/333791318.db2.gz POUNMOQYLLOHHY-CABCVRRESA-N 1 1 292.382 4.753 20 0 CJADMO C[C@H]([NH2+][C@@H](C)c1ccc(-c2ccccc2)cc1)c1ccon1 ZINC000541767986 333791361 /nfs/dbraw/zinc/79/13/61/333791361.db2.gz POUNMOQYLLOHHY-GJZGRUSLSA-N 1 1 292.382 4.753 20 0 CJADMO C[C@@H]([NH2+][C@@H](C)c1ccc(-c2ccccc2)cc1)c1ccon1 ZINC000541767989 333791369 /nfs/dbraw/zinc/79/13/69/333791369.db2.gz POUNMOQYLLOHHY-LSDHHAIUSA-N 1 1 292.382 4.753 20 0 CJADMO CC(C)c1ccc2c(c1)[C@H]([NH2+][C@H](C)c1ccon1)CCC2 ZINC000541769572 333791523 /nfs/dbraw/zinc/79/15/23/333791523.db2.gz JJSZMXNVDSELRF-FZKQIMNGSA-N 1 1 284.403 4.526 20 0 CJADMO CC(C)c1ccc2c(c1)[C@@H]([NH2+][C@@H](C)c1ccon1)CCC2 ZINC000541769574 333791432 /nfs/dbraw/zinc/79/14/32/333791432.db2.gz JJSZMXNVDSELRF-UGSOOPFHSA-N 1 1 284.403 4.526 20 0 CJADMO CC[C@@H]([NH2+][C@H](C)c1ccon1)c1ccc(Cl)c(Cl)c1 ZINC000541772375 333791961 /nfs/dbraw/zinc/79/19/61/333791961.db2.gz YMMPCQRISZSVHT-NOZJJQNGSA-N 1 1 299.201 4.783 20 0 CJADMO CC[C@H]([NH2+][C@H](C)c1ccon1)c1ccc(Cl)c(Cl)c1 ZINC000541772376 333791787 /nfs/dbraw/zinc/79/17/87/333791787.db2.gz YMMPCQRISZSVHT-RNCFNFMXSA-N 1 1 299.201 4.783 20 0 CJADMO CC[C@H]([NH2+][C@@H](C)c1ccon1)c1ccc(Cl)c(Cl)c1 ZINC000541772379 333791627 /nfs/dbraw/zinc/79/16/27/333791627.db2.gz YMMPCQRISZSVHT-ZANVPECISA-N 1 1 299.201 4.783 20 0 CJADMO C[C@@H]([NH2+][C@@H](C)c1ccc(-c2cccs2)cc1)c1ccon1 ZINC000542698462 329189012 /nfs/dbraw/zinc/18/90/12/329189012.db2.gz RUNPQTNHAKRILK-QWHCGFSZSA-N 1 1 298.411 4.815 20 0 CJADMO C[C@H]([NH2+][C@@H](C)c1ccc(-c2cccs2)cc1)c1ccon1 ZINC000542698463 329188993 /nfs/dbraw/zinc/18/89/93/329188993.db2.gz RUNPQTNHAKRILK-STQMWFEESA-N 1 1 298.411 4.815 20 0 CJADMO C[C@@H]([NH2+][C@H](C)c1ccc(-c2ccccc2)s1)c1ccon1 ZINC000542700320 333837408 /nfs/dbraw/zinc/83/74/08/333837408.db2.gz QQFGZVWOIFYNDS-CHWSQXEVSA-N 1 1 298.411 4.815 20 0 CJADMO C[C@@H]([NH2+][C@@H](C)c1ccon1)c1ccc(-c2ccccc2)s1 ZINC000542700323 333837469 /nfs/dbraw/zinc/83/74/69/333837469.db2.gz QQFGZVWOIFYNDS-QWHCGFSZSA-N 1 1 298.411 4.815 20 0 CJADMO C[C@H]([NH2+][C@@H](C)c1ccc(-c2ccccc2)s1)c1ccon1 ZINC000542700324 333837399 /nfs/dbraw/zinc/83/73/99/333837399.db2.gz QQFGZVWOIFYNDS-STQMWFEESA-N 1 1 298.411 4.815 20 0 CJADMO Cc1ccc(-c2ccc(C[NH2+][C@H](C)c3ccon3)s2)cc1 ZINC000542707735 333838129 /nfs/dbraw/zinc/83/81/29/333838129.db2.gz DSEJXFBHTAWUBR-CYBMUJFWSA-N 1 1 298.411 4.562 20 0 CJADMO Cc1ccc(-c2ccc(C[NH2+][C@@H](C)c3ccon3)s2)cc1 ZINC000542707741 333838126 /nfs/dbraw/zinc/83/81/26/333838126.db2.gz DSEJXFBHTAWUBR-ZDUSSCGKSA-N 1 1 298.411 4.562 20 0 CJADMO Cc1ccc(C[NH2+][C@H](c2ccc(Cl)cc2F)C(C)C)o1 ZINC000542853978 333845576 /nfs/dbraw/zinc/84/55/76/333845576.db2.gz KDHACSWYDCHJNQ-INIZCTEOSA-N 1 1 295.785 4.867 20 0 CJADMO Cc1ccc(C[NH2+][C@@H](c2ccc(Cl)cc2F)C(C)C)o1 ZINC000542853979 333845761 /nfs/dbraw/zinc/84/57/61/333845761.db2.gz KDHACSWYDCHJNQ-MRXNPFEDSA-N 1 1 295.785 4.867 20 0 CJADMO CC(C)([NH2+]Cc1c(F)cccc1Cl)c1cccs1 ZINC000543501585 333878367 /nfs/dbraw/zinc/87/83/67/333878367.db2.gz WEQGCOQFGGMUDY-UHFFFAOYSA-N 1 1 283.799 4.566 20 0 CJADMO C[C@@H]([NH2+]C(C)(C)c1cccs1)c1c(F)cccc1F ZINC000543503448 333878346 /nfs/dbraw/zinc/87/83/46/333878346.db2.gz PJWGJIZHCJQQMJ-SNVBAGLBSA-N 1 1 281.371 4.612 20 0 CJADMO CCC[C@H]([NH2+][C@@H](C)c1ccon1)c1ccc(Cl)cc1 ZINC000543628148 333884699 /nfs/dbraw/zinc/88/46/99/333884699.db2.gz LUVJEQCWOHHGDC-NHYWBVRUSA-N 1 1 278.783 4.520 20 0 CJADMO CCC[C@@H]([NH2+][C@@H](C)c1ccon1)c1ccc(Cl)cc1 ZINC000543628149 333884733 /nfs/dbraw/zinc/88/47/33/333884733.db2.gz LUVJEQCWOHHGDC-XHDPSFHLSA-N 1 1 278.783 4.520 20 0 CJADMO Cc1ccoc1C[NH2+][C@H](c1ccc(Cl)cc1F)C(C)C ZINC000543783573 333898666 /nfs/dbraw/zinc/89/86/66/333898666.db2.gz XJHXZPASHQXBOF-INIZCTEOSA-N 1 1 295.785 4.867 20 0 CJADMO Cc1ccoc1C[NH2+][C@@H](c1ccc(Cl)cc1F)C(C)C ZINC000543783574 333898669 /nfs/dbraw/zinc/89/86/69/333898669.db2.gz XJHXZPASHQXBOF-MRXNPFEDSA-N 1 1 295.785 4.867 20 0 CJADMO CC[C@@H](Nc1cccc(Cn2cc[nH+]c2C(C)C)c1)C(C)C ZINC000544038751 333911734 /nfs/dbraw/zinc/91/17/34/333911734.db2.gz NGBZFDQBDQUQAQ-GOSISDBHSA-N 1 1 299.462 4.901 20 0 CJADMO CC[C@H](Nc1cccc(Cn2cc[nH+]c2C(C)C)c1)C(C)C ZINC000544038752 333911731 /nfs/dbraw/zinc/91/17/31/333911731.db2.gz NGBZFDQBDQUQAQ-SFHVURJKSA-N 1 1 299.462 4.901 20 0 CJADMO CC(C)Sc1ccc([C@@H](C)[NH2+][C@H](C)c2ccon2)cc1 ZINC000544606254 333939820 /nfs/dbraw/zinc/93/98/20/333939820.db2.gz ISQCLTLHCMLHSA-CHWSQXEVSA-N 1 1 290.432 4.587 20 0 CJADMO CC(C)Sc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccon2)cc1 ZINC000544606452 333939953 /nfs/dbraw/zinc/93/99/53/333939953.db2.gz ISQCLTLHCMLHSA-OLZOCXBDSA-N 1 1 290.432 4.587 20 0 CJADMO Cc1ccccc1C([NH2+]Cc1ccco1)c1ccccc1C ZINC000544838633 333948796 /nfs/dbraw/zinc/94/87/96/333948796.db2.gz CAUHVJOHRHIHAB-UHFFFAOYSA-N 1 1 291.394 4.776 20 0 CJADMO Cc1cncc([C@@H](C)[NH2+]Cc2c(Cl)cccc2Cl)c1 ZINC000545232212 333971637 /nfs/dbraw/zinc/97/16/37/333971637.db2.gz LLHLADIKEVOMSC-LLVKDONJSA-N 1 1 295.213 4.548 20 0 CJADMO Cc1cccc(C)c1[C@H](C)[NH2+]Cc1csc(C(C)C)n1 ZINC000545517915 333985891 /nfs/dbraw/zinc/98/58/91/333985891.db2.gz GRXCWDWHXPOVKO-AWEZNQCLSA-N 1 1 288.460 4.734 20 0 CJADMO C[C@H](CCc1ccsc1)Nc1cccc2cc[nH+]cc21 ZINC000545906785 334005517 /nfs/dbraw/zinc/00/55/17/334005517.db2.gz INMQWJWKIURSNO-CYBMUJFWSA-N 1 1 282.412 4.730 20 0 CJADMO C[C@@H](CCc1ccsc1)Nc1cccc2cc[nH+]cc21 ZINC000545906786 334005458 /nfs/dbraw/zinc/00/54/58/334005458.db2.gz INMQWJWKIURSNO-ZDUSSCGKSA-N 1 1 282.412 4.730 20 0 CJADMO C[C@H]([NH2+]C1(c2ccc(Cl)c(Cl)c2)CC1)c1ccoc1 ZINC000545981133 334010284 /nfs/dbraw/zinc/01/02/84/334010284.db2.gz KVHDNXJDZMLVEK-JTQLQIEISA-N 1 1 296.197 4.926 20 0 CJADMO C[C@@H]([NH2+]C1(c2ccc(Cl)c(Cl)c2)CC1)c1ccoc1 ZINC000545981134 334010329 /nfs/dbraw/zinc/01/03/29/334010329.db2.gz KVHDNXJDZMLVEK-SNVBAGLBSA-N 1 1 296.197 4.926 20 0 CJADMO c1nc(C2CC2)sc1C[N@H+]1CCCC[C@H]1c1ccccc1 ZINC000545985113 334010474 /nfs/dbraw/zinc/01/04/74/334010474.db2.gz XVHMEIORKBNIPT-KRWDZBQOSA-N 1 1 298.455 4.748 20 0 CJADMO c1nc(C2CC2)sc1C[N@H+]1CCCC[C@@H]1c1ccccc1 ZINC000545985114 334010632 /nfs/dbraw/zinc/01/06/32/334010632.db2.gz XVHMEIORKBNIPT-QGZVFWFLSA-N 1 1 298.455 4.748 20 0 CJADMO Cc1ccoc1C[NH2+]C1(c2ccc(Cl)c(Cl)c2)CC1 ZINC000545985806 334010758 /nfs/dbraw/zinc/01/07/58/334010758.db2.gz YODPAZRVNRTKJE-UHFFFAOYSA-N 1 1 296.197 4.674 20 0 CJADMO C[C@H](C1CC1)[N@@H+](Cc1ncc(-c2ccccc2)s1)C1CC1 ZINC000545998516 334011431 /nfs/dbraw/zinc/01/14/31/334011431.db2.gz JWGQCORTVKRCDJ-CYBMUJFWSA-N 1 1 298.455 4.573 20 0 CJADMO C[C@@H](C1CC1)[N@@H+](Cc1ncc(-c2ccccc2)s1)C1CC1 ZINC000545998521 334011465 /nfs/dbraw/zinc/01/14/65/334011465.db2.gz JWGQCORTVKRCDJ-ZDUSSCGKSA-N 1 1 298.455 4.573 20 0 CJADMO Cc1cccc(C)c1[C@@H](C)[NH2+][C@@H](C)c1nc2ccccc2o1 ZINC000546223256 334020135 /nfs/dbraw/zinc/02/01/35/334020135.db2.gz DWXKDHFDSSXNSP-CABCVRRESA-N 1 1 294.398 4.856 20 0 CJADMO Cc1cccc(C)c1[C@H](C)[NH2+][C@@H](C)c1nc2ccccc2o1 ZINC000546223257 334020248 /nfs/dbraw/zinc/02/02/48/334020248.db2.gz DWXKDHFDSSXNSP-GJZGRUSLSA-N 1 1 294.398 4.856 20 0 CJADMO Cc1cccc(C)c1[C@@H](C)[NH2+][C@H](C)c1nc2ccccc2o1 ZINC000546223258 334020265 /nfs/dbraw/zinc/02/02/65/334020265.db2.gz DWXKDHFDSSXNSP-HUUCEWRRSA-N 1 1 294.398 4.856 20 0 CJADMO Cc1cccc(C)c1[C@H](C)[NH2+][C@H](C)c1nc2ccccc2o1 ZINC000546223259 334020139 /nfs/dbraw/zinc/02/01/39/334020139.db2.gz DWXKDHFDSSXNSP-LSDHHAIUSA-N 1 1 294.398 4.856 20 0 CJADMO C[C@@H]1c2ccsc2CC[N@@H+]1Cc1ccc(C(F)F)cc1 ZINC000546602073 334039710 /nfs/dbraw/zinc/03/97/10/334039710.db2.gz RYQMNBRGOVQNNG-LLVKDONJSA-N 1 1 293.382 4.805 20 0 CJADMO C[C@H]1c2ccsc2CC[N@@H+]1Cc1ccc(C(F)F)cc1 ZINC000546602074 334039788 /nfs/dbraw/zinc/03/97/88/334039788.db2.gz RYQMNBRGOVQNNG-NSHDSACASA-N 1 1 293.382 4.805 20 0 CJADMO Cc1cncc([C@@H](C)[NH2+]Cc2cccc(Cl)c2Cl)c1 ZINC000546645711 334043181 /nfs/dbraw/zinc/04/31/81/334043181.db2.gz LLGBRPNEZYNDCI-LLVKDONJSA-N 1 1 295.213 4.548 20 0 CJADMO Cc1cncc([C@H](C)[NH2+]Cc2cccc(Cl)c2Cl)c1 ZINC000546645712 334043058 /nfs/dbraw/zinc/04/30/58/334043058.db2.gz LLGBRPNEZYNDCI-NSHDSACASA-N 1 1 295.213 4.548 20 0 CJADMO C[C@H]([NH2+]C1(c2ccc(Cl)c(Cl)c2)CC1)c1ccco1 ZINC000546687876 334045772 /nfs/dbraw/zinc/04/57/72/334045772.db2.gz XWDHHSZDANIIFN-JTQLQIEISA-N 1 1 296.197 4.926 20 0 CJADMO C[C@@H]([NH2+]C1(c2ccc(Cl)c(Cl)c2)CC1)c1ccco1 ZINC000546687893 334045755 /nfs/dbraw/zinc/04/57/55/334045755.db2.gz XWDHHSZDANIIFN-SNVBAGLBSA-N 1 1 296.197 4.926 20 0 CJADMO CCSc1cccc(C[N@H+]2CCC[C@@H]2c2ccccn2)c1 ZINC000546741800 334049330 /nfs/dbraw/zinc/04/93/30/334049330.db2.gz YGEHXQDAPXWOJM-GOSISDBHSA-N 1 1 298.455 4.531 20 0 CJADMO CCSc1cccc(C[N@H+]2CCC[C@H]2c2ccccn2)c1 ZINC000546741801 334049409 /nfs/dbraw/zinc/04/94/09/334049409.db2.gz YGEHXQDAPXWOJM-SFHVURJKSA-N 1 1 298.455 4.531 20 0 CJADMO CC[N@@H+](CCC1CC1)[C@@H](C)c1ncc(-c2ccccc2)o1 ZINC000546932806 334056142 /nfs/dbraw/zinc/05/61/42/334056142.db2.gz JYOIISJQBHFJMI-AWEZNQCLSA-N 1 1 284.403 4.525 20 0 CJADMO CC[N@@H+](CCC1CC1)[C@H](C)c1ncc(-c2ccccc2)o1 ZINC000546932807 334056188 /nfs/dbraw/zinc/05/61/88/334056188.db2.gz JYOIISJQBHFJMI-CQSZACIVSA-N 1 1 284.403 4.525 20 0 CJADMO CCCc1nc(C[NH2+][C@@H](C)c2c(C)cccc2C)cs1 ZINC000546936442 334056530 /nfs/dbraw/zinc/05/65/30/334056530.db2.gz YVUWQIRWUOTMOS-AWEZNQCLSA-N 1 1 288.460 4.563 20 0 CJADMO CCCc1nc(C[NH2+][C@H](C)c2c(C)cccc2C)cs1 ZINC000546936443 334056609 /nfs/dbraw/zinc/05/66/09/334056609.db2.gz YVUWQIRWUOTMOS-CQSZACIVSA-N 1 1 288.460 4.563 20 0 CJADMO CC(C)c1nc([C@@H](C)Nc2cccc3cc[nH+]cc32)cs1 ZINC000547399659 334085748 /nfs/dbraw/zinc/08/57/48/334085748.db2.gz BICNQVDOMKMHMS-GFCCVEGCSA-N 1 1 297.427 4.988 20 0 CJADMO CC(C)c1nc([C@H](C)Nc2cccc3cc[nH+]cc32)cs1 ZINC000547399660 334085884 /nfs/dbraw/zinc/08/58/84/334085884.db2.gz BICNQVDOMKMHMS-LBPRGKRZSA-N 1 1 297.427 4.988 20 0 CJADMO CC(C)c1ccc(CC[N@H+]2CCC[C@H]2c2ccccn2)cc1 ZINC000547420451 334086758 /nfs/dbraw/zinc/08/67/58/334086758.db2.gz YQFKQHRYTWFLNF-FQEVSTJZSA-N 1 1 294.442 4.585 20 0 CJADMO CC(C)c1ccc(CC[N@H+]2CCC[C@@H]2c2ccccn2)cc1 ZINC000547420452 334086733 /nfs/dbraw/zinc/08/67/33/334086733.db2.gz YQFKQHRYTWFLNF-HXUWFJFHSA-N 1 1 294.442 4.585 20 0 CJADMO C[C@@H]1CCCCC[N@H+]1Cc1cnc(-c2ccsc2)s1 ZINC000547604709 334102311 /nfs/dbraw/zinc/10/23/11/334102311.db2.gz YRILYVVOYLIQLZ-GFCCVEGCSA-N 1 1 292.473 4.636 20 0 CJADMO C[C@H]1CCCCC[N@H+]1Cc1cnc(-c2ccsc2)s1 ZINC000547604710 334102443 /nfs/dbraw/zinc/10/24/43/334102443.db2.gz YRILYVVOYLIQLZ-LBPRGKRZSA-N 1 1 292.473 4.636 20 0 CJADMO CCC(C)(C)[N@@H+](C)Cc1ccc(Cl)c2cccnc12 ZINC000547771508 334116606 /nfs/dbraw/zinc/11/66/06/334116606.db2.gz XMQRXUMOYRVHOQ-UHFFFAOYSA-N 1 1 276.811 4.509 20 0 CJADMO Cc1cccc(N[C@H](C)c2ccccc2C(F)(F)F)[nH+]1 ZINC000547786471 334118317 /nfs/dbraw/zinc/11/83/17/334118317.db2.gz USGAUQVYLNBRSJ-LLVKDONJSA-N 1 1 280.293 4.582 20 0 CJADMO Cc1cccc(N[C@@H](C)c2ccccc2C(F)(F)F)[nH+]1 ZINC000547786472 334118294 /nfs/dbraw/zinc/11/82/94/334118294.db2.gz USGAUQVYLNBRSJ-NSHDSACASA-N 1 1 280.293 4.582 20 0 CJADMO Cc1cc(F)ccc1C[NH2+][C@H](C)c1c(F)cccc1Cl ZINC000547833823 334125042 /nfs/dbraw/zinc/12/50/42/334125042.db2.gz XGAHRTUBRPHVAL-LLVKDONJSA-N 1 1 295.760 4.777 20 0 CJADMO Cc1cc(F)ccc1C[NH2+][C@@H](C)c1c(F)cccc1Cl ZINC000547833824 334125050 /nfs/dbraw/zinc/12/50/50/334125050.db2.gz XGAHRTUBRPHVAL-NSHDSACASA-N 1 1 295.760 4.777 20 0 CJADMO CC[C@H](C[N@@H+](CC)[C@@H](C)c1cccnc1)c1ccccc1 ZINC000547841653 334126206 /nfs/dbraw/zinc/12/62/06/334126206.db2.gz BVNBROKURGJIOJ-DLBZAZTESA-N 1 1 282.431 4.658 20 0 CJADMO CC[C@H](C[N@@H+](CC)[C@H](C)c1cccnc1)c1ccccc1 ZINC000547841654 334126082 /nfs/dbraw/zinc/12/60/82/334126082.db2.gz BVNBROKURGJIOJ-IAGOWNOFSA-N 1 1 282.431 4.658 20 0 CJADMO CC[C@@H](C[N@@H+](CC)[C@@H](C)c1cccnc1)c1ccccc1 ZINC000547841655 334126119 /nfs/dbraw/zinc/12/61/19/334126119.db2.gz BVNBROKURGJIOJ-IRXDYDNUSA-N 1 1 282.431 4.658 20 0 CJADMO CC[C@@H](C[N@@H+](CC)[C@H](C)c1cccnc1)c1ccccc1 ZINC000547841656 334126190 /nfs/dbraw/zinc/12/61/90/334126190.db2.gz BVNBROKURGJIOJ-SJORKVTESA-N 1 1 282.431 4.658 20 0 CJADMO CCC(C)(C)[N@@H+](C)Cc1csc(-c2ccc(F)cc2)n1 ZINC000548098863 334139951 /nfs/dbraw/zinc/13/99/51/334139951.db2.gz UNIJURPPQAWWMV-UHFFFAOYSA-N 1 1 292.423 4.570 20 0 CJADMO CCC(C)(C)[N@@H+](C)Cc1ncc(-c2ccc(Cl)cc2)o1 ZINC000548099759 334139972 /nfs/dbraw/zinc/13/99/72/334139972.db2.gz KNCBWBSKHMMJLT-UHFFFAOYSA-N 1 1 292.810 4.615 20 0 CJADMO C[C@H](c1ncc(-c2ccc(Cl)cc2)o1)[N@@H+]1[C@H](C)C[C@@H]1C ZINC000548425099 334155594 /nfs/dbraw/zinc/15/55/94/334155594.db2.gz NTCBQNNTUHZMPJ-GRYCIOLGSA-N 1 1 290.794 4.539 20 0 CJADMO C[C@@H](c1ncc(-c2ccc(Cl)cc2)o1)[N@@H+]1[C@H](C)C[C@@H]1C ZINC000548425102 334155518 /nfs/dbraw/zinc/15/55/18/334155518.db2.gz NTCBQNNTUHZMPJ-TUAOUCFPSA-N 1 1 290.794 4.539 20 0 CJADMO C[C@H](c1ccc(Cl)cc1)[N@H+]1CC[C@H](C(F)(F)F)[C@H]1C ZINC000548755524 334170142 /nfs/dbraw/zinc/17/01/42/334170142.db2.gz IRWPTZRNIRSMFC-BREBYQMCSA-N 1 1 291.744 4.674 20 0 CJADMO C[C@H](c1ccc(Cl)cc1)[N@H+]1CC[C@@H](C(F)(F)F)[C@@H]1C ZINC000548755525 334170070 /nfs/dbraw/zinc/17/00/70/334170070.db2.gz IRWPTZRNIRSMFC-GBIKHYSHSA-N 1 1 291.744 4.674 20 0 CJADMO C[C@H](c1ccc(Cl)cc1)[N@H+]1CC[C@@H](C(F)(F)F)[C@H]1C ZINC000548755526 334169960 /nfs/dbraw/zinc/16/99/60/334169960.db2.gz IRWPTZRNIRSMFC-GIPNMCIBSA-N 1 1 291.744 4.674 20 0 CJADMO C[C@H](c1ccc(Cl)cc1)[N@H+]1CC[C@H](C(F)(F)F)[C@@H]1C ZINC000548755527 334169926 /nfs/dbraw/zinc/16/99/26/334169926.db2.gz IRWPTZRNIRSMFC-NRUUGDAUSA-N 1 1 291.744 4.674 20 0 CJADMO C[C@@H](c1ccccc1)[N@H+]1CC[C@@H](C(F)(F)F)C2(CCC2)C1 ZINC000548934263 334180763 /nfs/dbraw/zinc/18/07/63/334180763.db2.gz AFQJQLHMJUVCCA-DZGCQCFKSA-N 1 1 297.364 4.802 20 0 CJADMO C[C@H](c1ccccc1)[N@H+]1CC[C@H](C(F)(F)F)C2(CCC2)C1 ZINC000548934265 334180758 /nfs/dbraw/zinc/18/07/58/334180758.db2.gz AFQJQLHMJUVCCA-HIFRSBDPSA-N 1 1 297.364 4.802 20 0 CJADMO C[C@H](c1ccccc1)[N@H+]1CC[C@@H](C(F)(F)F)C2(CCC2)C1 ZINC000548934266 334180678 /nfs/dbraw/zinc/18/06/78/334180678.db2.gz AFQJQLHMJUVCCA-UKRRQHHQSA-N 1 1 297.364 4.802 20 0 CJADMO C[C@@H](c1ccccc1)[N@H+]1CC[C@H](C(F)(F)F)C2(CCC2)C1 ZINC000548934267 334180801 /nfs/dbraw/zinc/18/08/01/334180801.db2.gz AFQJQLHMJUVCCA-ZFWWWQNUSA-N 1 1 297.364 4.802 20 0 CJADMO C[C@H](c1ccccc1)[N@@H+](C)Cc1sccc1Cl ZINC000549038803 334183186 /nfs/dbraw/zinc/18/31/86/334183186.db2.gz AODWREIZYGCRFN-LLVKDONJSA-N 1 1 265.809 4.595 20 0 CJADMO C[C@H](c1ccccc1)[N@H+](C)Cc1sccc1Cl ZINC000549038803 334183185 /nfs/dbraw/zinc/18/31/85/334183185.db2.gz AODWREIZYGCRFN-LLVKDONJSA-N 1 1 265.809 4.595 20 0 CJADMO C[C@@H](c1ccccc1)[N@@H+](C)Cc1sccc1Cl ZINC000549038804 334183323 /nfs/dbraw/zinc/18/33/23/334183323.db2.gz AODWREIZYGCRFN-NSHDSACASA-N 1 1 265.809 4.595 20 0 CJADMO C[C@@H](c1ccccc1)[N@H+](C)Cc1sccc1Cl ZINC000549038804 334183322 /nfs/dbraw/zinc/18/33/22/334183322.db2.gz AODWREIZYGCRFN-NSHDSACASA-N 1 1 265.809 4.595 20 0 CJADMO Clc1ccsc1C[NH2+]C1(c2ccc(Cl)cc2)CC1 ZINC000549066476 334184514 /nfs/dbraw/zinc/18/45/14/334184514.db2.gz YWFRPNDXAZFCPU-UHFFFAOYSA-N 1 1 298.238 4.834 20 0 CJADMO C[C@H](C1CCCCC1)[N@@H+](C)CCCCC(F)(F)F ZINC000549159712 334186628 /nfs/dbraw/zinc/18/66/28/334186628.db2.gz QVZJTOBKKXFFIR-GFCCVEGCSA-N 1 1 265.363 4.620 20 0 CJADMO Cc1ccsc1C[N@H+](C)[C@H]1CCCc2ccccc21 ZINC000549193907 334187374 /nfs/dbraw/zinc/18/73/74/334187374.db2.gz DCXDWZUKJLSMQA-INIZCTEOSA-N 1 1 271.429 4.566 20 0 CJADMO Cc1ccsc1C[N@H+](C)[C@@H]1CCCc2ccccc21 ZINC000549193908 334187441 /nfs/dbraw/zinc/18/74/41/334187441.db2.gz DCXDWZUKJLSMQA-MRXNPFEDSA-N 1 1 271.429 4.566 20 0 CJADMO CC[N@@H+](Cc1cccs1)Cc1ccc(C(C)C)nc1C ZINC000549344507 334190480 /nfs/dbraw/zinc/19/04/80/334190480.db2.gz NQQWKGVERURFEC-UHFFFAOYSA-N 1 1 288.460 4.597 20 0 CJADMO Cc1nc(C(C)C)ccc1C[N@@H+](C)[C@@H](C)c1ccccc1 ZINC000549344950 334190552 /nfs/dbraw/zinc/19/05/52/334190552.db2.gz KHYMUPGLTHYUPH-INIZCTEOSA-N 1 1 282.431 4.706 20 0 CJADMO Cc1nc(C(C)C)ccc1C[N@@H+](C)[C@H](C)c1ccccc1 ZINC000549344966 334190573 /nfs/dbraw/zinc/19/05/73/334190573.db2.gz KHYMUPGLTHYUPH-MRXNPFEDSA-N 1 1 282.431 4.706 20 0 CJADMO CC1(C)[C@@H](C(F)(F)F)CC[N@H+]1Cc1sccc1Cl ZINC000549348770 334190714 /nfs/dbraw/zinc/19/07/14/334190714.db2.gz NJTODZXDKFURLA-JTQLQIEISA-N 1 1 297.773 4.564 20 0 CJADMO CC1(C)[C@H](C(F)(F)F)CC[N@H+]1Cc1sccc1Cl ZINC000549348771 334190830 /nfs/dbraw/zinc/19/08/30/334190830.db2.gz NJTODZXDKFURLA-SNVBAGLBSA-N 1 1 297.773 4.564 20 0 CJADMO Cc1ccc(C[N@H+](C)Cc2ccc(C(C)C)nc2C)s1 ZINC000549405368 334192748 /nfs/dbraw/zinc/19/27/48/334192748.db2.gz NCNHUWRGCFMNNL-UHFFFAOYSA-N 1 1 288.460 4.515 20 0 CJADMO CCCC(C)(C)[N@H+](Cc1cccs1)Cc1ncc(C)o1 ZINC000549408017 334193096 /nfs/dbraw/zinc/19/30/96/334193096.db2.gz JJZSJWVZJBMKJK-UHFFFAOYSA-N 1 1 292.448 4.625 20 0 CJADMO CCCC(C)(C)[N@@H+](Cc1cccs1)Cc1ncc(C)o1 ZINC000549408017 334193093 /nfs/dbraw/zinc/19/30/93/334193093.db2.gz JJZSJWVZJBMKJK-UHFFFAOYSA-N 1 1 292.448 4.625 20 0 CJADMO c1csc([C@H]([NH2+][C@H]2C=CCCCCC2)c2ccccc2)n1 ZINC000549517001 334195866 /nfs/dbraw/zinc/19/58/66/334195866.db2.gz MZIAFNXIWHCTJZ-DLBZAZTESA-N 1 1 298.455 4.711 20 0 CJADMO c1csc([C@H]([NH2+][C@@H]2C=CCCCCC2)c2ccccc2)n1 ZINC000549517002 334195958 /nfs/dbraw/zinc/19/59/58/334195958.db2.gz MZIAFNXIWHCTJZ-IAGOWNOFSA-N 1 1 298.455 4.711 20 0 CJADMO c1csc([C@@H]([NH2+][C@H]2C=CCCCCC2)c2ccccc2)n1 ZINC000549517003 334195853 /nfs/dbraw/zinc/19/58/53/334195853.db2.gz MZIAFNXIWHCTJZ-IRXDYDNUSA-N 1 1 298.455 4.711 20 0 CJADMO c1csc([C@@H]([NH2+][C@@H]2C=CCCCCC2)c2ccccc2)n1 ZINC000549517004 334195931 /nfs/dbraw/zinc/19/59/31/334195931.db2.gz MZIAFNXIWHCTJZ-SJORKVTESA-N 1 1 298.455 4.711 20 0 CJADMO Clc1ccccc1C[N@H+]1CCC[C@H]1c1ccsc1 ZINC000549614219 334199673 /nfs/dbraw/zinc/19/96/73/334199673.db2.gz CBBMOMIMSGYESV-HNNXBMFYSA-N 1 1 277.820 4.739 20 0 CJADMO Clc1ccccc1C[N@H+]1CCC[C@@H]1c1ccsc1 ZINC000549614227 334199689 /nfs/dbraw/zinc/19/96/89/334199689.db2.gz CBBMOMIMSGYESV-OAHLLOKOSA-N 1 1 277.820 4.739 20 0 CJADMO CC(C)([NH2+]Cc1cccc(F)c1Cl)c1ccccc1F ZINC000549717946 334202694 /nfs/dbraw/zinc/20/26/94/334202694.db2.gz LPBKVBSUGTZLBW-UHFFFAOYSA-N 1 1 295.760 4.643 20 0 CJADMO Cc1cc(Cl)cc(C[NH2+]Cc2nc(C(C)C)cs2)c1 ZINC000549780865 334205040 /nfs/dbraw/zinc/20/50/40/334205040.db2.gz VILJCGPYZGEEBL-UHFFFAOYSA-N 1 1 294.851 4.518 20 0 CJADMO Fc1cccc(Cl)c1C[NH2+]Cc1coc2ccccc12 ZINC000549822446 334205872 /nfs/dbraw/zinc/20/58/72/334205872.db2.gz AVOMIEHWZPGLQA-UHFFFAOYSA-N 1 1 289.737 4.515 20 0 CJADMO Cc1ccc2[nH]c(CNc3cccc(C4CC4)[nH+]3)cc2c1C ZINC000549843328 334206572 /nfs/dbraw/zinc/20/65/72/334206572.db2.gz JNZHTAMXEYNTSC-UHFFFAOYSA-N 1 1 291.398 4.669 20 0 CJADMO CC(C)=CC[N@H+]1CCC[C@H]1c1ccc(Br)cc1 ZINC000549919918 334208729 /nfs/dbraw/zinc/20/87/29/334208729.db2.gz VZLWUEZRRNBYPB-HNNXBMFYSA-N 1 1 294.236 4.552 20 0 CJADMO CC(C)=CC[N@H+]1CCC[C@@H]1c1ccc(Br)cc1 ZINC000549919920 334208761 /nfs/dbraw/zinc/20/87/61/334208761.db2.gz VZLWUEZRRNBYPB-OAHLLOKOSA-N 1 1 294.236 4.552 20 0 CJADMO CCCCC[N@@H+](CCc1c(C)noc1C)[C@@H](C)CCC ZINC000549930231 334209536 /nfs/dbraw/zinc/20/95/36/334209536.db2.gz AXODTWXHCUSZKQ-AWEZNQCLSA-N 1 1 280.456 4.515 20 0 CJADMO CCCCC[N@@H+](CCc1c(C)noc1C)[C@H](C)CCC ZINC000549930233 334209325 /nfs/dbraw/zinc/20/93/25/334209325.db2.gz AXODTWXHCUSZKQ-CQSZACIVSA-N 1 1 280.456 4.515 20 0 CJADMO CSc1ccc(CNc2ccc(C3CCC3)c[nH+]2)s1 ZINC000550308041 334219660 /nfs/dbraw/zinc/21/96/60/334219660.db2.gz MMVOEPXWRLFVRL-UHFFFAOYSA-N 1 1 290.457 4.745 20 0 CJADMO CCCC[C@H](C)[N@@H+](CCCC)CCc1c(C)noc1C ZINC000550369038 334221251 /nfs/dbraw/zinc/22/12/51/334221251.db2.gz DHRVCLAJFGOJIU-AWEZNQCLSA-N 1 1 280.456 4.515 20 0 CJADMO CCCC[C@@H](C)[N@@H+](CCCC)CCc1c(C)noc1C ZINC000550369044 334221296 /nfs/dbraw/zinc/22/12/96/334221296.db2.gz DHRVCLAJFGOJIU-CQSZACIVSA-N 1 1 280.456 4.515 20 0 CJADMO C[N@H+](Cc1csc2ccccc12)C[C@@H]1CCC(F)(F)C1 ZINC000550682270 334226868 /nfs/dbraw/zinc/22/68/68/334226868.db2.gz WWODZBWILQUENN-GFCCVEGCSA-N 1 1 295.398 4.769 20 0 CJADMO C[N@H+](Cc1csc2ccccc12)C[C@H]1CCC(F)(F)C1 ZINC000550682271 334226881 /nfs/dbraw/zinc/22/68/81/334226881.db2.gz WWODZBWILQUENN-LBPRGKRZSA-N 1 1 295.398 4.769 20 0 CJADMO CCCC[N@@H+](C)[C@@H](c1ccc(Cl)cc1)C1CCOCC1 ZINC000550704794 334227357 /nfs/dbraw/zinc/22/73/57/334227357.db2.gz MEHZHPKSZWXYSQ-KRWDZBQOSA-N 1 1 295.854 4.540 20 0 CJADMO CCCC[N@@H+](C)[C@H](c1ccc(Cl)cc1)C1CCOCC1 ZINC000550704795 334227515 /nfs/dbraw/zinc/22/75/15/334227515.db2.gz MEHZHPKSZWXYSQ-QGZVFWFLSA-N 1 1 295.854 4.540 20 0 CJADMO Cc1cc([C@H](C)[NH2+][C@@H]2CCCc3ccc(C(C)C)cc32)no1 ZINC000550938604 334234528 /nfs/dbraw/zinc/23/45/28/334234528.db2.gz ZJPSDJCNKHHSBR-KBXCAEBGSA-N 1 1 298.430 4.835 20 0 CJADMO Cc1cc([C@@H](C)[NH2+][C@@H]2CCCc3ccc(C(C)C)cc32)no1 ZINC000550938605 334234479 /nfs/dbraw/zinc/23/44/79/334234479.db2.gz ZJPSDJCNKHHSBR-RDTXWAMCSA-N 1 1 298.430 4.835 20 0 CJADMO Cc1cc([C@@H](C)[NH2+][C@@H](CC2CCCC2)c2ccccc2)no1 ZINC000550940763 334234708 /nfs/dbraw/zinc/23/47/08/334234708.db2.gz XSDWPQNSOYQVON-BEFAXECRSA-N 1 1 298.430 4.955 20 0 CJADMO Cc1cc([C@@H](C)[NH2+][C@H](CC2CCCC2)c2ccccc2)no1 ZINC000550940764 334234628 /nfs/dbraw/zinc/23/46/28/334234628.db2.gz XSDWPQNSOYQVON-DNVCBOLYSA-N 1 1 298.430 4.955 20 0 CJADMO Cc1cc([C@H](C)[NH2+][C@H](CC2CCCC2)c2ccccc2)no1 ZINC000550940765 334234728 /nfs/dbraw/zinc/23/47/28/334234728.db2.gz XSDWPQNSOYQVON-HNAYVOBHSA-N 1 1 298.430 4.955 20 0 CJADMO Cc1cc([C@H](C)[NH2+][C@@H](CC2CCCC2)c2ccccc2)no1 ZINC000550940766 334234599 /nfs/dbraw/zinc/23/45/99/334234599.db2.gz XSDWPQNSOYQVON-KXBFYZLASA-N 1 1 298.430 4.955 20 0 CJADMO CC1(C[N@H+]2CCC[C@H]2c2nc3ccccc3s2)CCC1 ZINC000551063035 334237796 /nfs/dbraw/zinc/23/77/96/334237796.db2.gz HRABQDPHZNIUTL-AWEZNQCLSA-N 1 1 286.444 4.623 20 0 CJADMO CC1(C[N@H+]2CCC[C@@H]2c2nc3ccccc3s2)CCC1 ZINC000551063036 334237631 /nfs/dbraw/zinc/23/76/31/334237631.db2.gz HRABQDPHZNIUTL-CQSZACIVSA-N 1 1 286.444 4.623 20 0 CJADMO Cc1ccc(C[N@H+](C[C@@H]2CCC(F)(F)C2)C(C)C)s1 ZINC000551064223 334237734 /nfs/dbraw/zinc/23/77/34/334237734.db2.gz RYFNYZUTBOLEFA-CYBMUJFWSA-N 1 1 287.419 4.702 20 0 CJADMO Cc1ccc(C[N@H+](C[C@H]2CCC(F)(F)C2)C(C)C)s1 ZINC000551064224 334237774 /nfs/dbraw/zinc/23/77/74/334237774.db2.gz RYFNYZUTBOLEFA-ZDUSSCGKSA-N 1 1 287.419 4.702 20 0 CJADMO Cc1cc([C@@H](C)[NH2+][C@H](C)c2ccc(F)c3ccccc32)no1 ZINC000551176033 334240021 /nfs/dbraw/zinc/24/00/21/334240021.db2.gz RRFAAFZSTBHTRJ-CHWSQXEVSA-N 1 1 298.361 4.687 20 0 CJADMO Cc1cc([C@H](C)[NH2+][C@H](C)c2ccc(F)c3ccccc32)no1 ZINC000551176034 334240043 /nfs/dbraw/zinc/24/00/43/334240043.db2.gz RRFAAFZSTBHTRJ-OLZOCXBDSA-N 1 1 298.361 4.687 20 0 CJADMO Cc1cc([C@@H](C)[NH2+][C@@H](C)c2ccc(F)c3ccccc32)no1 ZINC000551176035 334240030 /nfs/dbraw/zinc/24/00/30/334240030.db2.gz RRFAAFZSTBHTRJ-QWHCGFSZSA-N 1 1 298.361 4.687 20 0 CJADMO Cc1cc([C@H](C)[NH2+][C@@H](C)c2ccc(F)c3ccccc32)no1 ZINC000551176036 334239983 /nfs/dbraw/zinc/23/99/83/334239983.db2.gz RRFAAFZSTBHTRJ-STQMWFEESA-N 1 1 298.361 4.687 20 0 CJADMO CC(C)C[N@@H+](CCCCCF)[C@H]1CCCc2cccnc21 ZINC000551396667 334249152 /nfs/dbraw/zinc/24/91/52/334249152.db2.gz WFKQWZJBPOCSDQ-KRWDZBQOSA-N 1 1 292.442 4.557 20 0 CJADMO CC(C)C[N@@H+](CCCCCF)[C@@H]1CCCc2cccnc21 ZINC000551396668 334249063 /nfs/dbraw/zinc/24/90/63/334249063.db2.gz WFKQWZJBPOCSDQ-QGZVFWFLSA-N 1 1 292.442 4.557 20 0 CJADMO Cc1oncc1C[N@H+](CC(C)C)[C@@H](C)c1ccccc1C ZINC000551413189 334249818 /nfs/dbraw/zinc/24/98/18/334249818.db2.gz FPLISZKEYLZXHO-HNNXBMFYSA-N 1 1 286.419 4.511 20 0 CJADMO Cc1oncc1C[N@H+](CC(C)C)[C@H](C)c1ccccc1C ZINC000551413191 334249755 /nfs/dbraw/zinc/24/97/55/334249755.db2.gz FPLISZKEYLZXHO-OAHLLOKOSA-N 1 1 286.419 4.511 20 0 CJADMO Cc1ccccc1[C@H](C)[N@H+](Cc1cscn1)CC(C)C ZINC000551428715 334250082 /nfs/dbraw/zinc/25/00/82/334250082.db2.gz XDTCRMCFZZBZQQ-HNNXBMFYSA-N 1 1 288.460 4.671 20 0 CJADMO Cc1ccccc1[C@@H](C)[N@H+](Cc1cscn1)CC(C)C ZINC000551428720 334250059 /nfs/dbraw/zinc/25/00/59/334250059.db2.gz XDTCRMCFZZBZQQ-OAHLLOKOSA-N 1 1 288.460 4.671 20 0 CJADMO CC(C)([NH2+]Cc1c(F)cccc1F)c1ccc(Cl)cc1 ZINC000551428749 334250108 /nfs/dbraw/zinc/25/01/08/334250108.db2.gz XOGYPXZWMCRVAS-UHFFFAOYSA-N 1 1 295.760 4.643 20 0 CJADMO C[C@H](c1cc2ccccc2o1)[N@@H+](C)CCCCCF ZINC000551698331 334258133 /nfs/dbraw/zinc/25/81/33/334258133.db2.gz YYYMEJZXZGHMLP-CYBMUJFWSA-N 1 1 263.356 4.565 20 0 CJADMO C[C@@H](c1cc2ccccc2o1)[N@@H+](C)CCCCCF ZINC000551698332 334258094 /nfs/dbraw/zinc/25/80/94/334258094.db2.gz YYYMEJZXZGHMLP-ZDUSSCGKSA-N 1 1 263.356 4.565 20 0 CJADMO Cc1nc(C(C)C)sc1[C@@H](C)[N@@H+](C)CCCCCF ZINC000551702869 334258506 /nfs/dbraw/zinc/25/85/06/334258506.db2.gz XRRIPNJJPARRTL-CYBMUJFWSA-N 1 1 286.460 4.708 20 0 CJADMO Cc1nc(C(C)C)sc1[C@H](C)[N@@H+](C)CCCCCF ZINC000551702874 334258417 /nfs/dbraw/zinc/25/84/17/334258417.db2.gz XRRIPNJJPARRTL-ZDUSSCGKSA-N 1 1 286.460 4.708 20 0 CJADMO FC(F)(F)CCCC[N@H+]1CCC=C(c2ccccc2)C1 ZINC000551707455 334258798 /nfs/dbraw/zinc/25/87/98/334258798.db2.gz JGTMXGCZOOLFJE-UHFFFAOYSA-N 1 1 283.337 4.508 20 0 CJADMO CC[N@@H+](CC1CCC(C(F)(F)F)CC1)C1CCCC1 ZINC000551709679 334258907 /nfs/dbraw/zinc/25/89/07/334258907.db2.gz OYEIRRCJAHIYLA-UHFFFAOYSA-N 1 1 277.374 4.620 20 0 CJADMO Cc1cnc(C[N@H+](CC(C)C)[C@@H](C)c2ccccc2C)o1 ZINC000551722483 334258997 /nfs/dbraw/zinc/25/89/97/334258997.db2.gz IQQWIHIDDMPYIO-INIZCTEOSA-N 1 1 286.419 4.511 20 0 CJADMO Cc1cnc(C[N@H+](CC(C)C)[C@H](C)c2ccccc2C)o1 ZINC000551722484 334259113 /nfs/dbraw/zinc/25/91/13/334259113.db2.gz IQQWIHIDDMPYIO-MRXNPFEDSA-N 1 1 286.419 4.511 20 0 CJADMO Cc1ccccc1[C@H](C)[N@H+](Cc1cncs1)CC(C)C ZINC000551811803 334262774 /nfs/dbraw/zinc/26/27/74/334262774.db2.gz HAZMGLIIRFKLBI-HNNXBMFYSA-N 1 1 288.460 4.671 20 0 CJADMO Cc1ccccc1[C@@H](C)[N@H+](Cc1cncs1)CC(C)C ZINC000551811804 334262799 /nfs/dbraw/zinc/26/27/99/334262799.db2.gz HAZMGLIIRFKLBI-OAHLLOKOSA-N 1 1 288.460 4.671 20 0 CJADMO CC(C)c1ncc(C[N@H+]2CCC=C(c3ccccc3)C2)s1 ZINC000551826443 334263611 /nfs/dbraw/zinc/26/36/11/334263611.db2.gz MGQGDAFDVLQMLS-UHFFFAOYSA-N 1 1 298.455 4.556 20 0 CJADMO CC(C)c1cnc(C[N@H+]2CCC=C(c3ccccc3)C2)s1 ZINC000551827039 334263571 /nfs/dbraw/zinc/26/35/71/334263571.db2.gz PQWUIMHAPAPZDK-UHFFFAOYSA-N 1 1 298.455 4.556 20 0 CJADMO CC(C)c1cnc(C[N@@H+]2CCC=C(c3ccccc3)C2)s1 ZINC000551827039 334263570 /nfs/dbraw/zinc/26/35/70/334263570.db2.gz PQWUIMHAPAPZDK-UHFFFAOYSA-N 1 1 298.455 4.556 20 0 CJADMO CCC(CC)[N@@H+](Cc1cnc(C2CCC2)s1)C1CC1 ZINC000551930956 334266679 /nfs/dbraw/zinc/26/66/79/334266679.db2.gz NRKCCHVIORNJTR-UHFFFAOYSA-N 1 1 278.465 4.564 20 0 CJADMO C[N@@H+](Cc1ccc(Cl)cc1)Cc1ccnc2ccccc12 ZINC000551934709 334266795 /nfs/dbraw/zinc/26/67/95/334266795.db2.gz UGYPNESKNRIOBH-UHFFFAOYSA-N 1 1 296.801 4.520 20 0 CJADMO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1cc(C)cc(Cl)c1 ZINC000552043849 334280640 /nfs/dbraw/zinc/28/06/40/334280640.db2.gz DHYSINTXEQHZAD-KRWDZBQOSA-N 1 1 288.822 4.627 20 0 CJADMO CC[C@H](c1ccncc1)[N@@H+](C)Cc1cc(C)cc(Cl)c1 ZINC000552043851 334280663 /nfs/dbraw/zinc/28/06/63/334280663.db2.gz DHYSINTXEQHZAD-QGZVFWFLSA-N 1 1 288.822 4.627 20 0 CJADMO Cc1sccc1C[N@H+](C)[C@H]1CCCC[C@H]1C(F)(F)F ZINC000552051948 334282097 /nfs/dbraw/zinc/28/20/97/334282097.db2.gz OYHHKHNVZKLJAJ-OLZOCXBDSA-N 1 1 291.382 4.609 20 0 CJADMO Cc1nc(C)c([C@H](C)[N@@H+](C)Cc2ccc(C)c(C)c2)s1 ZINC000552059641 334283137 /nfs/dbraw/zinc/28/31/37/334283137.db2.gz QCUAEBSBNUPRGT-AWEZNQCLSA-N 1 1 288.460 4.570 20 0 CJADMO Cc1nc(C)c([C@@H](C)[N@@H+](C)Cc2ccc(C)c(C)c2)s1 ZINC000552059642 334283146 /nfs/dbraw/zinc/28/31/46/334283146.db2.gz QCUAEBSBNUPRGT-CQSZACIVSA-N 1 1 288.460 4.570 20 0 CJADMO CCc1ccc([C@@H](C)[NH2+]Cc2c(F)cccc2SC)o1 ZINC000552085904 334287395 /nfs/dbraw/zinc/28/73/95/334287395.db2.gz QQJLXWJUKSMQSQ-LLVKDONJSA-N 1 1 293.407 4.554 20 0 CJADMO CCc1ccc([C@H](C)[NH2+]Cc2c(F)cccc2SC)o1 ZINC000552085905 334287459 /nfs/dbraw/zinc/28/74/59/334287459.db2.gz QQJLXWJUKSMQSQ-NSHDSACASA-N 1 1 293.407 4.554 20 0 CJADMO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1csc2ccccc12 ZINC000552159325 334296761 /nfs/dbraw/zinc/29/67/61/334296761.db2.gz GDZNIYWQSWHOOF-KRWDZBQOSA-N 1 1 296.439 4.879 20 0 CJADMO CC[C@H](c1ccncc1)[N@@H+](C)Cc1csc2ccccc12 ZINC000552159326 334296767 /nfs/dbraw/zinc/29/67/67/334296767.db2.gz GDZNIYWQSWHOOF-QGZVFWFLSA-N 1 1 296.439 4.879 20 0 CJADMO c1cc2cc(CNc3cccc4cc[nH+]cc43)ccc2o1 ZINC000552161982 334297219 /nfs/dbraw/zinc/29/72/19/334297219.db2.gz NEXNDMJTZOOKPZ-UHFFFAOYSA-N 1 1 274.323 4.593 20 0 CJADMO CC[N@@H+](Cc1cc(C)cc(Cl)c1)[C@@H](C)c1cccnc1 ZINC000552246127 334308012 /nfs/dbraw/zinc/30/80/12/334308012.db2.gz JFRGPSLZVYKEDY-AWEZNQCLSA-N 1 1 288.822 4.627 20 0 CJADMO CC[N@@H+](Cc1cc(C)cc(Cl)c1)[C@H](C)c1cccnc1 ZINC000552246128 334307938 /nfs/dbraw/zinc/30/79/38/334307938.db2.gz JFRGPSLZVYKEDY-CQSZACIVSA-N 1 1 288.822 4.627 20 0 CJADMO C[C@H](CC[N@H+]1CC(C)(C)[C@@H]1c1ccncc1)c1ccccc1 ZINC000552281900 334312407 /nfs/dbraw/zinc/31/24/07/334312407.db2.gz OHELGQONYXCGOV-APWZRJJASA-N 1 1 294.442 4.658 20 0 CJADMO C[C@@H](CC[N@H+]1CC(C)(C)[C@@H]1c1ccncc1)c1ccccc1 ZINC000552281901 334312770 /nfs/dbraw/zinc/31/27/70/334312770.db2.gz OHELGQONYXCGOV-LPHOPBHVSA-N 1 1 294.442 4.658 20 0 CJADMO C[C@@H](CC[N@H+]1CC(C)(C)[C@H]1c1ccncc1)c1ccccc1 ZINC000552281902 334312764 /nfs/dbraw/zinc/31/27/64/334312764.db2.gz OHELGQONYXCGOV-QFBILLFUSA-N 1 1 294.442 4.658 20 0 CJADMO C[C@H](CC[N@H+]1CC(C)(C)[C@H]1c1ccncc1)c1ccccc1 ZINC000552281903 334312750 /nfs/dbraw/zinc/31/27/50/334312750.db2.gz OHELGQONYXCGOV-VQIMIIECSA-N 1 1 294.442 4.658 20 0 CJADMO CC(C)c1ccc([C@@H]2CCC[N@H+]2Cc2cncs2)cc1 ZINC000552306660 334315422 /nfs/dbraw/zinc/31/54/22/334315422.db2.gz GVIKEULJULGDBW-KRWDZBQOSA-N 1 1 286.444 4.604 20 0 CJADMO CC(C)c1ccc([C@H]2CCC[N@H+]2Cc2cncs2)cc1 ZINC000552306661 334315410 /nfs/dbraw/zinc/31/54/10/334315410.db2.gz GVIKEULJULGDBW-QGZVFWFLSA-N 1 1 286.444 4.604 20 0 CJADMO COCCc1cc[nH+]c(N[C@@H](C)c2ccc(C(C)C)cc2)c1 ZINC000552321298 334316839 /nfs/dbraw/zinc/31/68/39/334316839.db2.gz NHQBBLBXBMGPDO-HNNXBMFYSA-N 1 1 298.430 4.567 20 0 CJADMO COCCc1cc[nH+]c(N[C@H](C)c2ccc(C(C)C)cc2)c1 ZINC000552321299 334316769 /nfs/dbraw/zinc/31/67/69/334316769.db2.gz NHQBBLBXBMGPDO-OAHLLOKOSA-N 1 1 298.430 4.567 20 0 CJADMO C[C@H](CCCC(F)(F)F)Nc1ccc(C2CCC2)c[nH+]1 ZINC000552406583 334324352 /nfs/dbraw/zinc/32/43/52/334324352.db2.gz DZMVAMFKCYGWQE-LLVKDONJSA-N 1 1 286.341 4.882 20 0 CJADMO C[C@@H](CCCC(F)(F)F)Nc1ccc(C2CCC2)c[nH+]1 ZINC000552406584 326880770 /nfs/dbraw/zinc/88/07/70/326880770.db2.gz DZMVAMFKCYGWQE-NSHDSACASA-N 1 1 286.341 4.882 20 0 CJADMO FC(F)(F)CC[N@@H+](Cc1cccs1)Cc1ccccc1 ZINC000552615921 334339498 /nfs/dbraw/zinc/33/94/98/334339498.db2.gz DXMAEFKHNSCWPY-UHFFFAOYSA-N 1 1 299.361 4.703 20 0 CJADMO CCC[N@@H+](CC)C(c1ccccc1)c1ccccc1 ZINC000552737270 334343583 /nfs/dbraw/zinc/34/35/83/334343583.db2.gz HOWCDKJYFYRNME-UHFFFAOYSA-N 1 1 253.389 4.508 20 0 CJADMO CCC[N@@H+](Cc1ncc(C)s1)[C@@H](CC)c1ccccc1 ZINC000552813080 334345962 /nfs/dbraw/zinc/34/59/62/334345962.db2.gz YEUJCDKTYNBLJK-INIZCTEOSA-N 1 1 288.460 4.815 20 0 CJADMO CCC[N@@H+](Cc1ncc(C)s1)[C@H](CC)c1ccccc1 ZINC000552813081 334345929 /nfs/dbraw/zinc/34/59/29/334345929.db2.gz YEUJCDKTYNBLJK-MRXNPFEDSA-N 1 1 288.460 4.815 20 0 CJADMO Cc1ccc2oc(C[NH2+]Cc3ccccc3Cl)cc2c1 ZINC000553214693 334369561 /nfs/dbraw/zinc/36/95/61/334369561.db2.gz YKUNZZLJVYXDSN-UHFFFAOYSA-N 1 1 285.774 4.684 20 0 CJADMO Cc1cc2cc(CNc3cc[nH+]c4ccsc43)ccc2[nH]1 ZINC000553318951 334377338 /nfs/dbraw/zinc/37/73/38/334377338.db2.gz JOELGMVDVWEOOZ-UHFFFAOYSA-N 1 1 293.395 4.698 20 0 CJADMO Cc1[nH+]ccn1Cc1cccc(SCc2ccccc2)c1 ZINC000553432887 334384975 /nfs/dbraw/zinc/38/49/75/334384975.db2.gz ALJQAOOSOZHCCI-UHFFFAOYSA-N 1 1 294.423 4.532 20 0 CJADMO Cc1nc([C@@H](C)[NH2+]Cc2ccc(C(C)(C)C)cc2)cs1 ZINC000553444545 334385639 /nfs/dbraw/zinc/38/56/39/334385639.db2.gz LHRCXEAEVNSGEE-GFCCVEGCSA-N 1 1 288.460 4.600 20 0 CJADMO Cc1nc([C@H](C)[NH2+]Cc2ccc(C(C)(C)C)cc2)cs1 ZINC000553444546 334385534 /nfs/dbraw/zinc/38/55/34/334385534.db2.gz LHRCXEAEVNSGEE-LBPRGKRZSA-N 1 1 288.460 4.600 20 0 CJADMO CC[N@@H+](Cc1csc(-c2ccc(C)o2)n1)[C@@H](C)C(C)C ZINC000553639952 334394143 /nfs/dbraw/zinc/39/41/43/334394143.db2.gz KAUSERFIQHDXBU-ZDUSSCGKSA-N 1 1 292.448 4.578 20 0 CJADMO CCc1c2cc(C)ccc2oc1[C@@H](C)[NH2+]Cc1ccco1 ZINC000553737874 334397597 /nfs/dbraw/zinc/39/75/97/334397597.db2.gz XIUPYMYWKJIDHY-CYBMUJFWSA-N 1 1 283.371 4.747 20 0 CJADMO CCc1c2cc(C)ccc2oc1[C@H](C)[NH2+]Cc1ccco1 ZINC000553737875 334397579 /nfs/dbraw/zinc/39/75/79/334397579.db2.gz XIUPYMYWKJIDHY-ZDUSSCGKSA-N 1 1 283.371 4.747 20 0 CJADMO CC[C@@H]1CC[C@H]1Nc1cccc(Cn2cc[nH+]c2C(C)C)c1 ZINC000554109873 334412746 /nfs/dbraw/zinc/41/27/46/334412746.db2.gz BSBPYGPQMQVJLI-SJLPKXTDSA-N 1 1 297.446 4.655 20 0 CJADMO Cc1ccc([C@@H](C)[NH2+]C2(c3ccc(Cl)cc3)CC2)o1 ZINC000554210414 334416385 /nfs/dbraw/zinc/41/63/85/334416385.db2.gz FMYDCUDUVPAUHL-GFCCVEGCSA-N 1 1 275.779 4.581 20 0 CJADMO CCc1ccc([C@@H](C)[NH2+]C2(c3cccc(Cl)c3)CC2)o1 ZINC000554218994 334416914 /nfs/dbraw/zinc/41/69/14/334416914.db2.gz AHMNIWWISSVRKR-GFCCVEGCSA-N 1 1 289.806 4.835 20 0 CJADMO CCc1ccc([C@H](C)[NH2+]C2(c3cccc(Cl)c3)CC2)o1 ZINC000554218995 334417048 /nfs/dbraw/zinc/41/70/48/334417048.db2.gz AHMNIWWISSVRKR-LBPRGKRZSA-N 1 1 289.806 4.835 20 0 CJADMO C[C@@H]([NH2+][C@H](CC(F)(F)F)c1ccccc1)c1ccoc1 ZINC000555402852 334477228 /nfs/dbraw/zinc/47/72/28/334477228.db2.gz PWOPHFRUJHGKDY-BXUZGUMPSA-N 1 1 283.293 4.624 20 0 CJADMO C[C@@H]([NH2+][C@@H](CC(F)(F)F)c1ccccc1)c1ccoc1 ZINC000555402856 334477184 /nfs/dbraw/zinc/47/71/84/334477184.db2.gz PWOPHFRUJHGKDY-RISCZKNCSA-N 1 1 283.293 4.624 20 0 CJADMO C[C@H]([NH2+][C@H](CC(F)(F)F)c1ccccc1)c1ccoc1 ZINC000555402858 334477250 /nfs/dbraw/zinc/47/72/50/334477250.db2.gz PWOPHFRUJHGKDY-SMDDNHRTSA-N 1 1 283.293 4.624 20 0 CJADMO CCc1nc([C@@H](C)[NH2+]Cc2cc(C)cc(Cl)c2)cs1 ZINC000555547023 334481302 /nfs/dbraw/zinc/48/13/02/334481302.db2.gz DYDGOEKBMBRKKM-LLVKDONJSA-N 1 1 294.851 4.518 20 0 CJADMO CCc1nc([C@H](C)[NH2+]Cc2cc(C)cc(Cl)c2)cs1 ZINC000555547024 334481290 /nfs/dbraw/zinc/48/12/90/334481290.db2.gz DYDGOEKBMBRKKM-NSHDSACASA-N 1 1 294.851 4.518 20 0 CJADMO FC(F)(F)c1ccc(CNc2cccc(C3CC3)[nH+]2)s1 ZINC000555596154 334483752 /nfs/dbraw/zinc/48/37/52/334483752.db2.gz LOZFVLKKCUQSDQ-UHFFFAOYSA-N 1 1 298.333 4.651 20 0 CJADMO CCc1ccc([C@H]([NH2+][C@@H](C)c2cc(C)on2)C(C)C)cc1 ZINC000556234682 327251176 /nfs/dbraw/zinc/25/11/76/327251176.db2.gz XDWVLYCUSKDQBU-KBXCAEBGSA-N 1 1 286.419 4.593 20 0 CJADMO CCc1ccc([C@@H]([NH2+][C@H](C)c2cc(C)on2)C(C)C)cc1 ZINC000556234683 327251078 /nfs/dbraw/zinc/25/10/78/327251078.db2.gz XDWVLYCUSKDQBU-KDOFPFPSSA-N 1 1 286.419 4.593 20 0 CJADMO CCc1ccc([C@@H]([NH2+][C@@H](C)c2cc(C)on2)C(C)C)cc1 ZINC000556234684 327251133 /nfs/dbraw/zinc/25/11/33/327251133.db2.gz XDWVLYCUSKDQBU-KSSFIOAISA-N 1 1 286.419 4.593 20 0 CJADMO CCc1ccc([C@H]([NH2+][C@H](C)c2cc(C)on2)C(C)C)cc1 ZINC000556234685 327251066 /nfs/dbraw/zinc/25/10/66/327251066.db2.gz XDWVLYCUSKDQBU-RDTXWAMCSA-N 1 1 286.419 4.593 20 0 CJADMO FC(F)(F)CC1CC[NH+](Cc2ccsc2Cl)CC1 ZINC000556618991 326954991 /nfs/dbraw/zinc/95/49/91/326954991.db2.gz PWUBZGYFEHYOHV-UHFFFAOYSA-N 1 1 297.773 4.566 20 0 CJADMO Cc1cnc([C@H](C)[NH2+][C@H](c2ccc(Cl)cc2)C(C)C)o1 ZINC000557180474 326995857 /nfs/dbraw/zinc/99/58/57/326995857.db2.gz INLIHDWJFACAMH-WFASDCNBSA-N 1 1 292.810 4.684 20 0 CJADMO Cc1occc1C[NH2+][C@H](C)c1cccc(Cl)c1Cl ZINC000557256224 326998920 /nfs/dbraw/zinc/99/89/20/326998920.db2.gz WGCRRRUDNZYWFU-SECBINFHSA-N 1 1 284.186 4.746 20 0 CJADMO Cc1occc1C[NH2+][C@@H](C)c1cccc(Cl)c1Cl ZINC000557256237 326998881 /nfs/dbraw/zinc/99/88/81/326998881.db2.gz WGCRRRUDNZYWFU-VIFPVBQESA-N 1 1 284.186 4.746 20 0 CJADMO Cc1cccc(C[N@H+](C)[C@@H](C)c2cccc3ccccc32)n1 ZINC000557710308 327021859 /nfs/dbraw/zinc/02/18/59/327021859.db2.gz UMTOADIJFHSGTB-INIZCTEOSA-N 1 1 290.410 4.736 20 0 CJADMO Cc1cccc(C[N@H+](C)[C@H](C)c2cccc3ccccc32)n1 ZINC000557710327 327021870 /nfs/dbraw/zinc/02/18/70/327021870.db2.gz UMTOADIJFHSGTB-MRXNPFEDSA-N 1 1 290.410 4.736 20 0 CJADMO Cc1ccoc1C[NH2+][C@H](C)c1cc2cc(Cl)ccc2o1 ZINC000557808792 327028462 /nfs/dbraw/zinc/02/84/62/327028462.db2.gz XRUKVHUDIGNZIB-LLVKDONJSA-N 1 1 289.762 4.838 20 0 CJADMO Cc1ccoc1C[NH2+][C@@H](C)c1cc2cc(Cl)ccc2o1 ZINC000557808793 327028332 /nfs/dbraw/zinc/02/83/32/327028332.db2.gz XRUKVHUDIGNZIB-NSHDSACASA-N 1 1 289.762 4.838 20 0 CJADMO CC[C@H]1CCCC[N@H+]1Cc1ccccc1Oc1cccnc1 ZINC000557916168 327034921 /nfs/dbraw/zinc/03/49/21/327034921.db2.gz KHVOOFGLJMPTOM-KRWDZBQOSA-N 1 1 296.414 4.638 20 0 CJADMO CC[C@@H]1CCCC[N@H+]1Cc1ccccc1Oc1cccnc1 ZINC000557916173 327034836 /nfs/dbraw/zinc/03/48/36/327034836.db2.gz KHVOOFGLJMPTOM-QGZVFWFLSA-N 1 1 296.414 4.638 20 0 CJADMO C[C@@H](c1ccccc1)[N@@H+](Cc1cccc(F)c1)C1CC1 ZINC000558029890 327046640 /nfs/dbraw/zinc/04/66/40/327046640.db2.gz JWWAEZWXJVVCRX-AWEZNQCLSA-N 1 1 269.363 4.551 20 0 CJADMO C[C@H](c1ccccc1)[N@@H+](Cc1cccc(F)c1)C1CC1 ZINC000558029894 327046662 /nfs/dbraw/zinc/04/66/62/327046662.db2.gz JWWAEZWXJVVCRX-CQSZACIVSA-N 1 1 269.363 4.551 20 0 CJADMO CCc1ccc([C@@H](C)[NH2+]C2(c3ccc(Cl)cc3)CC2)o1 ZINC000558080775 327061598 /nfs/dbraw/zinc/06/15/98/327061598.db2.gz YXGUUNHSJXYZPP-GFCCVEGCSA-N 1 1 289.806 4.835 20 0 CJADMO CCc1ccc([C@H](C)[NH2+]C2(c3ccc(Cl)cc3)CC2)o1 ZINC000558080796 327061676 /nfs/dbraw/zinc/06/16/76/327061676.db2.gz YXGUUNHSJXYZPP-LBPRGKRZSA-N 1 1 289.806 4.835 20 0 CJADMO C[N@@H+](CCCCc1ccccc1)C1CCC(F)(F)CC1 ZINC000558178896 327078210 /nfs/dbraw/zinc/07/82/10/327078210.db2.gz BUNGAOKIVHQWJP-UHFFFAOYSA-N 1 1 281.390 4.519 20 0 CJADMO CC1(C)C[N@@H+](CCCCC(F)(F)F)[C@@H]1c1cccs1 ZINC000558179130 327078202 /nfs/dbraw/zinc/07/82/02/327078202.db2.gz HRMLGHXOPZSSGM-GFCCVEGCSA-N 1 1 291.382 4.864 20 0 CJADMO CC1(C)C[N@@H+](CCCCC(F)(F)F)[C@H]1c1cccs1 ZINC000558179131 327078139 /nfs/dbraw/zinc/07/81/39/327078139.db2.gz HRMLGHXOPZSSGM-LBPRGKRZSA-N 1 1 291.382 4.864 20 0 CJADMO C[N@@H+](CC1CCCCC1)[C@H]1CC[C@@H](C(F)(F)F)CC1 ZINC000558183944 327077680 /nfs/dbraw/zinc/07/76/80/327077680.db2.gz 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CC[C@@H](c1ccncc1)[N@@H+](C)C/C(C)=C/c1ccccc1 ZINC000558425124 327093260 /nfs/dbraw/zinc/09/32/60/327093260.db2.gz QQDMRGHKWXJSDK-IDCODDLRSA-N 1 1 280.415 4.568 20 0 CJADMO CC[C@H](c1ccncc1)[N@@H+](C)C/C(C)=C/c1ccccc1 ZINC000558425125 327093371 /nfs/dbraw/zinc/09/33/71/327093371.db2.gz QQDMRGHKWXJSDK-JRJUITNWSA-N 1 1 280.415 4.568 20 0 CJADMO CC[C@@H](c1ccncc1)[N@@H+](C)C/C(C)=C\c1ccccc1 ZINC000558425126 327093416 /nfs/dbraw/zinc/09/34/16/327093416.db2.gz QQDMRGHKWXJSDK-VDUFWMCCSA-N 1 1 280.415 4.568 20 0 CJADMO CC[C@H](c1ccncc1)[N@@H+](C)C/C(C)=C\c1ccccc1 ZINC000558425127 327093235 /nfs/dbraw/zinc/09/32/35/327093235.db2.gz QQDMRGHKWXJSDK-WLGQOEQESA-N 1 1 280.415 4.568 20 0 CJADMO Cc1cccc(C[N@H+](CC2CCC2)[C@@H](C)c2ccccc2)n1 ZINC000558542750 327103470 /nfs/dbraw/zinc/10/34/70/327103470.db2.gz VURQTVMTKKUHBJ-KRWDZBQOSA-N 1 1 294.442 4.753 20 0 CJADMO Cc1cccc(C[N@H+](CC2CCC2)[C@H](C)c2ccccc2)n1 ZINC000558542804 327103467 /nfs/dbraw/zinc/10/34/67/327103467.db2.gz 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C[C@@H]1[C@H](C(F)(F)F)CCC[N@H+]1Cc1sccc1Cl ZINC000558852594 327127167 /nfs/dbraw/zinc/12/71/67/327127167.db2.gz BGEWOHJVXVCBKF-RKDXNWHRSA-N 1 1 297.773 4.564 20 0 CJADMO C[C@@H]1[C@H](C(F)(F)F)CCC[N@@H+]1Cc1sccc1Cl ZINC000558852594 327127166 /nfs/dbraw/zinc/12/71/66/327127166.db2.gz BGEWOHJVXVCBKF-RKDXNWHRSA-N 1 1 297.773 4.564 20 0 CJADMO Clc1ccsc1C[NH2+]C1(c2cccc(Cl)c2)CC1 ZINC000558853813 327127249 /nfs/dbraw/zinc/12/72/49/327127249.db2.gz KOQYTPYXFRASIW-UHFFFAOYSA-N 1 1 298.238 4.834 20 0 CJADMO CCCC(C)(C)[N@H+](Cc1cccs1)CC1CCOCC1 ZINC000558863599 327127841 /nfs/dbraw/zinc/12/78/41/327127841.db2.gz ABDVORVXAMGUFR-UHFFFAOYSA-N 1 1 295.492 4.555 20 0 CJADMO CCCC(C)(C)[N@@H+](CCCCOC)Cc1cccs1 ZINC000558867625 327128055 /nfs/dbraw/zinc/12/80/55/327128055.db2.gz YTZQFWGQZWRKEQ-UHFFFAOYSA-N 1 1 283.481 4.555 20 0 CJADMO C[C@@H]([NH2+]Cc1cccc(F)c1Cl)c1cccc(F)c1F ZINC000559147148 327143319 /nfs/dbraw/zinc/14/33/19/327143319.db2.gz MNPXILFKAJGXEC-SECBINFHSA-N 1 1 299.723 4.608 20 0 CJADMO C[C@H]([NH2+]Cc1cccc(F)c1Cl)c1cccc(F)c1F ZINC000559147149 327143213 /nfs/dbraw/zinc/14/32/13/327143213.db2.gz MNPXILFKAJGXEC-VIFPVBQESA-N 1 1 299.723 4.608 20 0 CJADMO CC[N@@H+](Cc1cnc(-c2ccccc2)s1)C1CCCC1 ZINC000559151282 327143570 /nfs/dbraw/zinc/14/35/70/327143570.db2.gz GBNGKAZUQULFTB-UHFFFAOYSA-N 1 1 286.444 4.575 20 0 CJADMO CC[C@H]([NH2+]Cc1cc(C)cc(Cl)c1)c1nc(C)cs1 ZINC000559268608 327152411 /nfs/dbraw/zinc/15/24/11/327152411.db2.gz CNNIAWVQXLEDLJ-AWEZNQCLSA-N 1 1 294.851 4.654 20 0 CJADMO CC[C@@H]([NH2+]Cc1cc(C)cc(Cl)c1)c1nc(C)cs1 ZINC000559268609 327152319 /nfs/dbraw/zinc/15/23/19/327152319.db2.gz CNNIAWVQXLEDLJ-CQSZACIVSA-N 1 1 294.851 4.654 20 0 CJADMO Cc1sccc1C[NH2+][C@@H](C)c1nc(C(C)(C)C)cs1 ZINC000559269828 327152621 /nfs/dbraw/zinc/15/26/21/327152621.db2.gz SZEZXQHUHCWBIL-JTQLQIEISA-N 1 1 294.489 4.661 20 0 CJADMO Cc1sccc1C[NH2+][C@H](C)c1nc(C(C)(C)C)cs1 ZINC000559269829 327152675 /nfs/dbraw/zinc/15/26/75/327152675.db2.gz SZEZXQHUHCWBIL-SNVBAGLBSA-N 1 1 294.489 4.661 20 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327147394 /nfs/dbraw/zinc/14/73/94/327147394.db2.gz JEEMHTSTQJWFPB-OXJNMPFZSA-N 1 1 294.442 4.756 20 0 CJADMO CC(C)c1ccc([C@@H](C)[N@H+]2CC[C@@H](c3ccncc3)C2)cc1 ZINC000564402257 327147360 /nfs/dbraw/zinc/14/73/60/327147360.db2.gz JEEMHTSTQJWFPB-OXQOHEQNSA-N 1 1 294.442 4.756 20 0 CJADMO CC(C)c1ccc([C@@H](C)[N@H+]2CC[C@H](c3ccncc3)C2)cc1 ZINC000564402258 327147512 /nfs/dbraw/zinc/14/75/12/327147512.db2.gz JEEMHTSTQJWFPB-UZLBHIALSA-N 1 1 294.442 4.756 20 0 CJADMO CCCC[C@@H](C)[N@@H+](C)Cc1nc(-c2ccsc2)oc1C ZINC000564404767 327251607 /nfs/dbraw/zinc/25/16/07/327251607.db2.gz YSELSVPGULHNQA-GFCCVEGCSA-N 1 1 292.448 4.722 20 0 CJADMO CCCC[C@H](C)[N@@H+](C)Cc1nc(-c2ccsc2)oc1C ZINC000564404768 327251560 /nfs/dbraw/zinc/25/15/60/327251560.db2.gz YSELSVPGULHNQA-LBPRGKRZSA-N 1 1 292.448 4.722 20 0 CJADMO c1sc(C[N@H+]2CCC[C@H]2C2CCCCC2)nc1C1CC1 ZINC000564435642 327006290 /nfs/dbraw/zinc/00/62/90/327006290.db2.gz KMXFNGZZSYWVCS-INIZCTEOSA-N 1 1 290.476 4.565 20 0 CJADMO c1sc(C[N@H+]2CCC[C@@H]2C2CCCCC2)nc1C1CC1 ZINC000564435649 327006384 /nfs/dbraw/zinc/00/63/84/327006384.db2.gz KMXFNGZZSYWVCS-MRXNPFEDSA-N 1 1 290.476 4.565 20 0 CJADMO C/C(=C/c1ccc(Cl)cc1)C[NH2+][C@H](C)c1cscn1 ZINC000565247390 334547920 /nfs/dbraw/zinc/54/79/20/334547920.db2.gz SHJNARKTNVKVAV-SEVUFMINSA-N 1 1 292.835 4.551 20 0 CJADMO C/C(=C\c1ccc(Cl)cc1)C[NH2+][C@@H](C)c1cscn1 ZINC000565247392 327570238 /nfs/dbraw/zinc/57/02/38/327570238.db2.gz SHJNARKTNVKVAV-VNKGSWCUSA-N 1 1 292.835 4.551 20 0 CJADMO CCc1ccc([C@H](CC)[NH2+][C@H](C)c2cscn2)cc1 ZINC000565247964 334548182 /nfs/dbraw/zinc/54/81/82/334548182.db2.gz ZZRQSNDIEOMNSH-DOMZBBRYSA-N 1 1 274.433 4.507 20 0 CJADMO CCc1ccc([C@@H](CC)[NH2+][C@H](C)c2cscn2)cc1 ZINC000565247965 334548035 /nfs/dbraw/zinc/54/80/35/334548035.db2.gz ZZRQSNDIEOMNSH-IUODEOHRSA-N 1 1 274.433 4.507 20 0 CJADMO C[C@@H](Nc1cccc2cc[nH+]cc21)c1nccc2ccccc21 ZINC000565688747 334587524 /nfs/dbraw/zinc/58/75/24/334587524.db2.gz CANMCVJBHQTDRU-CQSZACIVSA-N 1 1 299.377 4.956 20 0 CJADMO Cc1ccccc1-c1cnc(C[N@H+](C)[C@H]2CCC(C)(C)C2)o1 ZINC000565926802 327088778 /nfs/dbraw/zinc/08/87/78/327088778.db2.gz AFZWRXVJLDHEFB-HNNXBMFYSA-N 1 1 298.430 4.661 20 0 CJADMO Cc1ccccc1-c1cnc(C[N@H+](C)[C@@H]2CCC(C)(C)C2)o1 ZINC000565926814 327088794 /nfs/dbraw/zinc/08/87/94/327088794.db2.gz AFZWRXVJLDHEFB-OAHLLOKOSA-N 1 1 298.430 4.661 20 0 CJADMO COc1c(C)cc([C@@H](C)Nc2cc(C)cc[nH+]2)cc1Cl ZINC000567481969 334724388 /nfs/dbraw/zinc/72/43/88/334724388.db2.gz OMGDGPHGUQIZEI-GFCCVEGCSA-N 1 1 290.794 4.534 20 0 CJADMO COc1c(C)cc([C@H](C)Nc2cc(C)cc[nH+]2)cc1Cl ZINC000567481970 334724225 /nfs/dbraw/zinc/72/42/25/334724225.db2.gz OMGDGPHGUQIZEI-LBPRGKRZSA-N 1 1 290.794 4.534 20 0 CJADMO CCCCc1ccc([C@H](C)[NH2+][C@@H](C)c2cscn2)cc1 ZINC000568276826 326989251 /nfs/dbraw/zinc/98/92/51/326989251.db2.gz PYEGVCKEFJCNIM-KBPBESRZSA-N 1 1 288.460 4.898 20 0 CJADMO CCCCc1ccc([C@H](C)[NH2+][C@H](C)c2cscn2)cc1 ZINC000568276830 326989196 /nfs/dbraw/zinc/98/91/96/326989196.db2.gz PYEGVCKEFJCNIM-UONOGXRCSA-N 1 1 288.460 4.898 20 0 CJADMO CCCCc1ccc([C@@H](C)[NH2+][C@H](C)c2cscn2)cc1 ZINC000568276831 326989299 /nfs/dbraw/zinc/98/92/99/326989299.db2.gz PYEGVCKEFJCNIM-ZIAGYGMSSA-N 1 1 288.460 4.898 20 0 CJADMO Cc1cc([C@H](C)[NH2+][C@@H]2CC(C)(C)CCc3ccccc32)no1 ZINC000568540180 334829730 /nfs/dbraw/zinc/82/97/30/334829730.db2.gz NIMWZTYVBJEVFA-KBXCAEBGSA-N 1 1 298.430 4.737 20 0 CJADMO Cc1cc([C@@H](C)[NH2+][C@H]2CC(C)(C)CCc3ccccc32)no1 ZINC000568540182 334829795 /nfs/dbraw/zinc/82/97/95/334829795.db2.gz NIMWZTYVBJEVFA-KDOFPFPSSA-N 1 1 298.430 4.737 20 0 CJADMO CC[C@H]([NH2+][C@H](C)c1ccccc1F)c1nc2ccccc2[nH]1 ZINC000568780445 334840803 /nfs/dbraw/zinc/84/08/03/334840803.db2.gz YJROHKCSDRTTDL-DOMZBBRYSA-N 1 1 297.377 4.504 20 0 CJADMO CC[C@@H]([NH2+][C@@H](C)c1ccccc1F)c1nc2ccccc2[nH]1 ZINC000568780447 334840814 /nfs/dbraw/zinc/84/08/14/334840814.db2.gz YJROHKCSDRTTDL-SWLSCSKDSA-N 1 1 297.377 4.504 20 0 CJADMO CC[C@H]([NH2+][C@@H](C)c1ccccc1F)c1nc2ccccc2[nH]1 ZINC000568780448 334840737 /nfs/dbraw/zinc/84/07/37/334840737.db2.gz YJROHKCSDRTTDL-WFASDCNBSA-N 1 1 297.377 4.504 20 0 CJADMO c1ccc([C@@H](Nc2cc(C3CC3)cc[nH+]2)C2CC2)cc1 ZINC000569396656 327172407 /nfs/dbraw/zinc/17/24/07/327172407.db2.gz IDABLBGJYDMSMU-GOSISDBHSA-N 1 1 264.372 4.522 20 0 CJADMO c1ccc([C@H](Nc2cc(C3CC3)cc[nH+]2)C2CC2)cc1 ZINC000569396657 327172378 /nfs/dbraw/zinc/17/23/78/327172378.db2.gz IDABLBGJYDMSMU-SFHVURJKSA-N 1 1 264.372 4.522 20 0 CJADMO COc1c2ccccc2oc1C[NH2+][C@H](C)c1cc(C)oc1C ZINC000569433026 327176232 /nfs/dbraw/zinc/17/62/32/327176232.db2.gz SUQQXTPAOCDOHG-GFCCVEGCSA-N 1 1 299.370 4.502 20 0 CJADMO COc1c2ccccc2oc1C[NH2+][C@@H](C)c1cc(C)oc1C ZINC000569433030 327176267 /nfs/dbraw/zinc/17/62/67/327176267.db2.gz SUQQXTPAOCDOHG-LBPRGKRZSA-N 1 1 299.370 4.502 20 0 CJADMO CCc1cnc(C[N@@H+](Cc2ccccc2)[C@@H](C)CC)s1 ZINC000569527938 327193226 /nfs/dbraw/zinc/19/32/26/327193226.db2.gz UDOHQQCVOZFJIW-AWEZNQCLSA-N 1 1 288.460 4.506 20 0 CJADMO CCc1cnc(C[N@@H+](Cc2ccccc2)[C@H](C)CC)s1 ZINC000569527941 327193204 /nfs/dbraw/zinc/19/32/04/327193204.db2.gz UDOHQQCVOZFJIW-CQSZACIVSA-N 1 1 288.460 4.506 20 0 CJADMO C[C@H](Nc1cc(C2CC2)cc[nH+]1)c1cc2ccccc2o1 ZINC000570219560 327576989 /nfs/dbraw/zinc/57/69/89/327576989.db2.gz MCTMOXFIEGAFER-LBPRGKRZSA-N 1 1 278.355 4.878 20 0 CJADMO C[C@H]1C[C@@H]([NH2+]Cc2c(F)cccc2Cl)c2ccccc21 ZINC000570622175 327604897 /nfs/dbraw/zinc/60/48/97/327604897.db2.gz YWBWJPQAEKETML-APPDUMDISA-N 1 1 289.781 4.817 20 0 CJADMO C[C@@H]1C[C@H]([NH2+]Cc2c(F)cccc2Cl)c2ccccc21 ZINC000570622176 327604901 /nfs/dbraw/zinc/60/49/01/327604901.db2.gz YWBWJPQAEKETML-DIFFPNOSSA-N 1 1 289.781 4.817 20 0 CJADMO C[C@H]1C[C@H]([NH2+]Cc2c(F)cccc2Cl)c2ccccc21 ZINC000570622177 327604795 /nfs/dbraw/zinc/60/47/95/327604795.db2.gz YWBWJPQAEKETML-GTNSWQLSSA-N 1 1 289.781 4.817 20 0 CJADMO Cc1cc([C@H]([NH2+]CCF)c2cccc(Cl)c2)c(C)s1 ZINC000571010045 327974434 /nfs/dbraw/zinc/97/44/34/327974434.db2.gz SWJFEERVKMLTCQ-OAHLLOKOSA-N 1 1 297.826 4.667 20 0 CJADMO Cc1ccccc1[C@H]([NH2+]Cc1cocn1)[C@@H]1CCC[C@@H](C)C1 ZINC000571079219 328084815 /nfs/dbraw/zinc/08/48/15/328084815.db2.gz JYKKBGBKEWLSLH-IDHHARJASA-N 1 1 298.430 4.640 20 0 CJADMO Cc1ccccc1[C@H]([NH2+]Cc1cocn1)[C@H]1CCC[C@@H](C)C1 ZINC000571079220 328084669 /nfs/dbraw/zinc/08/46/69/328084669.db2.gz JYKKBGBKEWLSLH-SIXWZSSISA-N 1 1 298.430 4.640 20 0 CJADMO Cc1ccccc1[C@H]([NH2+]Cc1cocn1)[C@H]1CCC[C@H](C)C1 ZINC000571079221 328084766 /nfs/dbraw/zinc/08/47/66/328084766.db2.gz JYKKBGBKEWLSLH-URLQWDBASA-N 1 1 298.430 4.640 20 0 CJADMO Cc1ccccc1[C@H]([NH2+]Cc1cocn1)[C@@H]1CCC[C@H](C)C1 ZINC000571079222 328084662 /nfs/dbraw/zinc/08/46/62/328084662.db2.gz JYKKBGBKEWLSLH-ZSZQSSIHSA-N 1 1 298.430 4.640 20 0 CJADMO CCC(=O)CCC[N@H+](CC)[C@@H](C)c1cc2ccccc2o1 ZINC000571245299 328095146 /nfs/dbraw/zinc/09/51/46/328095146.db2.gz RXWWPHDMYODSRG-AWEZNQCLSA-N 1 1 287.403 4.575 20 0 CJADMO CCC(=O)CCC[N@H+](CC)[C@H](C)c1cc2ccccc2o1 ZINC000571245300 328095282 /nfs/dbraw/zinc/09/52/82/328095282.db2.gz RXWWPHDMYODSRG-CQSZACIVSA-N 1 1 287.403 4.575 20 0 CJADMO CC[C@H](C[N@@H+](C)[C@@H](CC)c1ccncc1)c1ccccc1 ZINC000571309502 328102845 /nfs/dbraw/zinc/10/28/45/328102845.db2.gz AKBPTQUQCLNCHY-APWZRJJASA-N 1 1 282.431 4.658 20 0 CJADMO CC[C@@H](C[N@@H+](C)[C@@H](CC)c1ccncc1)c1ccccc1 ZINC000571309503 328103028 /nfs/dbraw/zinc/10/30/28/328103028.db2.gz AKBPTQUQCLNCHY-LPHOPBHVSA-N 1 1 282.431 4.658 20 0 CJADMO CC[C@@H](C[N@@H+](C)[C@H](CC)c1ccncc1)c1ccccc1 ZINC000571309504 328102847 /nfs/dbraw/zinc/10/28/47/328102847.db2.gz AKBPTQUQCLNCHY-QFBILLFUSA-N 1 1 282.431 4.658 20 0 CJADMO CC[C@H](c1ccncc1)[N@H+](C)C[C@@H](CC)c1ccccc1 ZINC000571309505 328103016 /nfs/dbraw/zinc/10/30/16/328103016.db2.gz AKBPTQUQCLNCHY-VQIMIIECSA-N 1 1 282.431 4.658 20 0 CJADMO C[C@@H]1C[C@H](c2ccccc2)[N@@H+](Cc2cnc(C3CC3)s2)C1 ZINC000571447714 328122670 /nfs/dbraw/zinc/12/26/70/328122670.db2.gz GQJUESUCLLNIFH-CXAGYDPISA-N 1 1 298.455 4.604 20 0 CJADMO C[C@@H]1C[C@@H](c2ccccc2)[N@@H+](Cc2cnc(C3CC3)s2)C1 ZINC000571447715 328122738 /nfs/dbraw/zinc/12/27/38/328122738.db2.gz GQJUESUCLLNIFH-DYVFJYSZSA-N 1 1 298.455 4.604 20 0 CJADMO C[C@H]1C[C@@H](c2ccccc2)[N@@H+](Cc2cnc(C3CC3)s2)C1 ZINC000571447716 328122713 /nfs/dbraw/zinc/12/27/13/328122713.db2.gz GQJUESUCLLNIFH-GUYCJALGSA-N 1 1 298.455 4.604 20 0 CJADMO C[C@H]1C[C@H](c2ccccc2)[N@@H+](Cc2cnc(C3CC3)s2)C1 ZINC000571447717 328122507 /nfs/dbraw/zinc/12/25/07/328122507.db2.gz GQJUESUCLLNIFH-SUMWQHHRSA-N 1 1 298.455 4.604 20 0 CJADMO CC(C)COc1ccccc1C[N@@H+](C)[C@@H](C)c1ccco1 ZINC000571541310 328133309 /nfs/dbraw/zinc/13/33/09/328133309.db2.gz ISAXPEGZVOHDFO-HNNXBMFYSA-N 1 1 287.403 4.507 20 0 CJADMO CC(C)COc1ccccc1C[N@H+](C)[C@@H](C)c1ccco1 ZINC000571541310 328133308 /nfs/dbraw/zinc/13/33/08/328133308.db2.gz ISAXPEGZVOHDFO-HNNXBMFYSA-N 1 1 287.403 4.507 20 0 CJADMO CC(C)COc1ccccc1C[N@@H+](C)[C@H](C)c1ccco1 ZINC000571541321 328133400 /nfs/dbraw/zinc/13/34/00/328133400.db2.gz ISAXPEGZVOHDFO-OAHLLOKOSA-N 1 1 287.403 4.507 20 0 CJADMO CC(C)COc1ccccc1C[N@H+](C)[C@H](C)c1ccco1 ZINC000571541321 328133399 /nfs/dbraw/zinc/13/33/99/328133399.db2.gz ISAXPEGZVOHDFO-OAHLLOKOSA-N 1 1 287.403 4.507 20 0 CJADMO C[N@@H+](CCCc1ccccc1)[C@H]1CC[C@@H](C(F)(F)F)CC1 ZINC000571598548 328136371 /nfs/dbraw/zinc/13/63/71/328136371.db2.gz RALVJIYVIFJGPE-IYBDPMFKSA-N 1 1 299.380 4.672 20 0 CJADMO Cc1ccccc1[C@@H](CC(F)(F)F)[NH2+][C@@H](C)c1ccoc1 ZINC000572208136 329955232 /nfs/dbraw/zinc/95/52/32/329955232.db2.gz SDBBTMFDWNKBEW-SWLSCSKDSA-N 1 1 297.320 4.932 20 0 CJADMO C[C@@H](c1ccccc1)[N@@H+](Cc1nccs1)C1CCCC1 ZINC000572526152 333185552 /nfs/dbraw/zinc/18/55/52/333185552.db2.gz XCQKGEWIRXSFRO-AWEZNQCLSA-N 1 1 286.444 4.649 20 0 CJADMO C[C@H](c1ccccc1)[N@@H+](Cc1nccs1)C1CCCC1 ZINC000572526153 333185433 /nfs/dbraw/zinc/18/54/33/333185433.db2.gz XCQKGEWIRXSFRO-CQSZACIVSA-N 1 1 286.444 4.649 20 0 CJADMO CC=Cc1ccc(N[C@H](c2ncc[nH]2)c2ccccc2)cc1 ZINC000572708677 327392328 /nfs/dbraw/zinc/39/23/28/327392328.db2.gz YERSXIVZIJBDON-VBAWXRRRSA-N 1 1 289.382 4.644 20 0 CJADMO CC=Cc1ccc(N[C@@H](c2ncc[nH]2)c2ccccc2)cc1 ZINC000572708678 327392476 /nfs/dbraw/zinc/39/24/76/327392476.db2.gz YERSXIVZIJBDON-VGLFAYCPSA-N 1 1 289.382 4.644 20 0 CJADMO Cc1ccnc([C@H](C)[NH2+]Cc2ccc(-c3ccccc3)o2)c1 ZINC000573153041 334913410 /nfs/dbraw/zinc/91/34/10/334913410.db2.gz NXQRPUVMTPDPKI-HNNXBMFYSA-N 1 1 292.382 4.501 20 0 CJADMO FC(F)(F)c1cccc(CNc2cccc(C3CC3)[nH+]2)c1 ZINC000573582568 334949574 /nfs/dbraw/zinc/94/95/74/334949574.db2.gz VTMKLGHFILTLKW-UHFFFAOYSA-N 1 1 292.304 4.590 20 0 CJADMO CC[C@@H]([NH2+]Cc1cc2cc(C)ccc2o1)c1ccc(F)cn1 ZINC000573699363 334959284 /nfs/dbraw/zinc/95/92/84/334959284.db2.gz JUAIAVKPXVXWML-MRXNPFEDSA-N 1 1 298.361 4.516 20 0 CJADMO CC[N@@H+](C/C(C)=C/c1ccccc1)[C@H](C)c1cccnc1 ZINC000574239334 335003257 /nfs/dbraw/zinc/00/32/57/335003257.db2.gz BIPSXZFMKZOAEZ-HJUDDPQBSA-N 1 1 280.415 4.568 20 0 CJADMO CC[N@@H+](C/C(C)=C/c1ccccc1)[C@@H](C)c1cccnc1 ZINC000574239336 335003334 /nfs/dbraw/zinc/00/33/34/335003334.db2.gz BIPSXZFMKZOAEZ-MAUBAPBLSA-N 1 1 280.415 4.568 20 0 CJADMO CC[N@@H+](C/C(C)=C\c1ccccc1)[C@@H](C)c1cccnc1 ZINC000574239337 335003473 /nfs/dbraw/zinc/00/34/73/335003473.db2.gz BIPSXZFMKZOAEZ-NOCRFKNCSA-N 1 1 280.415 4.568 20 0 CJADMO CC[N@@H+](C/C(C)=C\c1ccccc1)[C@H](C)c1cccnc1 ZINC000574239338 335003532 /nfs/dbraw/zinc/00/35/32/335003532.db2.gz BIPSXZFMKZOAEZ-VZVUQDNOSA-N 1 1 280.415 4.568 20 0 CJADMO CC[C@H](Nc1cc(C2CC2)cc[nH+]1)c1ccccc1 ZINC000574305474 335008829 /nfs/dbraw/zinc/00/88/29/335008829.db2.gz OCGYIWGPUXENBW-INIZCTEOSA-N 1 1 252.361 4.522 20 0 CJADMO CC[C@@H](Nc1cc(C2CC2)cc[nH+]1)c1ccccc1 ZINC000574305475 335008802 /nfs/dbraw/zinc/00/88/02/335008802.db2.gz OCGYIWGPUXENBW-MRXNPFEDSA-N 1 1 252.361 4.522 20 0 CJADMO CCCCC[N@@H+](Cc1cccc(C)n1)[C@@H](C)CCC ZINC000574316767 335009525 /nfs/dbraw/zinc/00/95/25/335009525.db2.gz GNAWBXNURDWRAD-INIZCTEOSA-N 1 1 262.441 4.571 20 0 CJADMO CCCCC[N@@H+](Cc1cccc(C)n1)[C@H](C)CCC ZINC000574316768 335009503 /nfs/dbraw/zinc/00/95/03/335009503.db2.gz GNAWBXNURDWRAD-MRXNPFEDSA-N 1 1 262.441 4.571 20 0 CJADMO CC[C@H]([NH2+]Cc1cc(C(C)(C)C)on1)c1ccc(C)cc1 ZINC000574321293 335010395 /nfs/dbraw/zinc/01/03/95/335010395.db2.gz BCFRELCOZSRKOF-INIZCTEOSA-N 1 1 286.419 4.521 20 0 CJADMO CC[C@@H]([NH2+]Cc1cc(C(C)(C)C)on1)c1ccc(C)cc1 ZINC000574321300 335010407 /nfs/dbraw/zinc/01/04/07/335010407.db2.gz BCFRELCOZSRKOF-MRXNPFEDSA-N 1 1 286.419 4.521 20 0 CJADMO Cc1nsc(C)c1C[N@H+](C)[C@H](C)c1ccc(Cl)cc1 ZINC000574771690 335046669 /nfs/dbraw/zinc/04/66/69/335046669.db2.gz UFXFGAZSCUQDCH-LLVKDONJSA-N 1 1 294.851 4.606 20 0 CJADMO Cc1cc([C@@H](C)[NH2+][C@H]2CCCc3ccc(C(C)C)cc32)no1 ZINC000574848308 335052102 /nfs/dbraw/zinc/05/21/02/335052102.db2.gz ZJPSDJCNKHHSBR-KDOFPFPSSA-N 1 1 298.430 4.835 20 0 CJADMO Cc1cc([C@H](C)[NH2+][C@H]2CCCc3ccc(C(C)C)cc32)no1 ZINC000574848309 335052038 /nfs/dbraw/zinc/05/20/38/335052038.db2.gz ZJPSDJCNKHHSBR-KSSFIOAISA-N 1 1 298.430 4.835 20 0 CJADMO CC1(C)C[N@@H+](Cc2cccc3cc[nH]c32)[C@H]1c1cccs1 ZINC000575027715 335056874 /nfs/dbraw/zinc/05/68/74/335056874.db2.gz IKPDTJKUSFBTIL-KRWDZBQOSA-N 1 1 296.439 4.813 20 0 CJADMO CC1(C)C[N@@H+](Cc2cccc3cc[nH]c32)[C@@H]1c1cccs1 ZINC000575027716 335056918 /nfs/dbraw/zinc/05/69/18/335056918.db2.gz IKPDTJKUSFBTIL-QGZVFWFLSA-N 1 1 296.439 4.813 20 0 CJADMO C[C@H](c1ccco1)[N@@H+](Cc1ccc2occc2c1)C1CC1 ZINC000575218089 335082995 /nfs/dbraw/zinc/08/29/95/335082995.db2.gz RGQHVBLFVNRRLX-CYBMUJFWSA-N 1 1 281.355 4.751 20 0 CJADMO C[C@@H](c1ccco1)[N@@H+](Cc1ccc2occc2c1)C1CC1 ZINC000575218090 335083007 /nfs/dbraw/zinc/08/30/07/335083007.db2.gz RGQHVBLFVNRRLX-ZDUSSCGKSA-N 1 1 281.355 4.751 20 0 CJADMO CC(C)c1ccc[nH+]c1NCc1ccc(C(F)F)cc1 ZINC000575326559 335094373 /nfs/dbraw/zinc/09/43/73/335094373.db2.gz KQJBMCQGRSPTOQ-UHFFFAOYSA-N 1 1 276.330 4.755 20 0 CJADMO CCC(CC)[N@@H+](CC)Cc1nc(-c2ccccc2)oc1C ZINC000575359740 335097707 /nfs/dbraw/zinc/09/77/07/335097707.db2.gz QUVFYRXPYUJAOV-UHFFFAOYSA-N 1 1 286.419 4.661 20 0 CJADMO C[C@@H]([NH2+]Cc1cccc(F)c1Cl)c1ccc(F)cc1F ZINC000575753044 335112313 /nfs/dbraw/zinc/11/23/13/335112313.db2.gz MTXAAGANQBRATB-SECBINFHSA-N 1 1 299.723 4.608 20 0 CJADMO CCCC(C)(C)[N@@H+](Cc1cccs1)Cc1ccccn1 ZINC000575817997 335119026 /nfs/dbraw/zinc/11/90/26/335119026.db2.gz VARPXEURGCYRRF-UHFFFAOYSA-N 1 1 288.460 4.724 20 0 CJADMO CC[C@H]([NH2+]Cc1ccc(C2CCC2)cc1)c1nccs1 ZINC000576056014 335147106 /nfs/dbraw/zinc/14/71/06/335147106.db2.gz OMSLVHBYPNRKEP-INIZCTEOSA-N 1 1 286.444 4.652 20 0 CJADMO CC[C@@H]([NH2+]Cc1ccc(C2CCC2)cc1)c1nccs1 ZINC000576056015 335147109 /nfs/dbraw/zinc/14/71/09/335147109.db2.gz OMSLVHBYPNRKEP-MRXNPFEDSA-N 1 1 286.444 4.652 20 0 CJADMO CCCC(C)(C)[N@H+](Cc1cccs1)C[C@@H]1CCCOC1 ZINC000576243714 335177236 /nfs/dbraw/zinc/17/72/36/335177236.db2.gz UBAPKTIYWXYUNF-HNNXBMFYSA-N 1 1 295.492 4.555 20 0 CJADMO CCCC(C)(C)[N@H+](Cc1cccs1)C[C@H]1CCCOC1 ZINC000576243715 335177359 /nfs/dbraw/zinc/17/73/59/335177359.db2.gz UBAPKTIYWXYUNF-OAHLLOKOSA-N 1 1 295.492 4.555 20 0 CJADMO CC[N@@H+](Cc1cccc(-c2ccncc2)c1)C1CCCC1 ZINC000576297611 335186308 /nfs/dbraw/zinc/18/63/08/335186308.db2.gz JSPGJSZNWFCAJM-UHFFFAOYSA-N 1 1 280.415 4.513 20 0 CJADMO CC(C)(C)c1cnc(CNc2cccc3cc[nH+]cc32)s1 ZINC000576544486 335217319 /nfs/dbraw/zinc/21/73/19/335217319.db2.gz WTJQUPMPDIWJII-UHFFFAOYSA-N 1 1 297.427 4.601 20 0 CJADMO C[C@H](c1ccccc1)[N@@H+](Cc1scnc1C1CC1)C1CC1 ZINC000576552141 335218158 /nfs/dbraw/zinc/21/81/58/335218158.db2.gz XJJNHHFPYZFZPN-CYBMUJFWSA-N 1 1 298.455 4.746 20 0 CJADMO C[C@@H](c1ccccc1)[N@@H+](Cc1scnc1C1CC1)C1CC1 ZINC000576552143 335218234 /nfs/dbraw/zinc/21/82/34/335218234.db2.gz XJJNHHFPYZFZPN-ZDUSSCGKSA-N 1 1 298.455 4.746 20 0 CJADMO CC[N@@H+](Cc1ccc2ccccc2c1)[C@H]1CCOC(C)(C)C1 ZINC000576553349 335218209 /nfs/dbraw/zinc/21/82/09/335218209.db2.gz QZTJCNVQYOWPOR-IBGZPJMESA-N 1 1 297.442 4.619 20 0 CJADMO CC[N@@H+](Cc1ccc2ccccc2c1)[C@@H]1CCOC(C)(C)C1 ZINC000576553352 335218213 /nfs/dbraw/zinc/21/82/13/335218213.db2.gz QZTJCNVQYOWPOR-LJQANCHMSA-N 1 1 297.442 4.619 20 0 CJADMO CSc1ccc(C[N@@H+](C)[C@H](C)c2ccccc2)s1 ZINC000576628943 335227669 /nfs/dbraw/zinc/22/76/69/335227669.db2.gz JDPVHIIIBYYVMZ-GFCCVEGCSA-N 1 1 277.458 4.663 20 0 CJADMO CSc1ccc(C[N@@H+](C)[C@@H](C)c2ccccc2)s1 ZINC000576628945 335227641 /nfs/dbraw/zinc/22/76/41/335227641.db2.gz JDPVHIIIBYYVMZ-LBPRGKRZSA-N 1 1 277.458 4.663 20 0 CJADMO Cc1ccncc1CCC[N@H+]([C@@H](C)c1ccccc1)C1CC1 ZINC000576671236 335232964 /nfs/dbraw/zinc/23/29/64/335232964.db2.gz FIGKMFRGXRBPPB-KRWDZBQOSA-N 1 1 294.442 4.548 20 0 CJADMO Cc1ccncc1CCC[N@H+]([C@H](C)c1ccccc1)C1CC1 ZINC000576671237 335232844 /nfs/dbraw/zinc/23/28/44/335232844.db2.gz FIGKMFRGXRBPPB-QGZVFWFLSA-N 1 1 294.442 4.548 20 0 CJADMO C[C@@H](Nc1cc(C2CC2)cc[nH+]1)c1cc2c(s1)CCC2 ZINC000576673959 335233091 /nfs/dbraw/zinc/23/30/91/335233091.db2.gz SNBZPJTWGOPJCR-LLVKDONJSA-N 1 1 284.428 4.682 20 0 CJADMO C[C@H](Nc1cc(C2CC2)cc[nH+]1)c1cc2c(s1)CCC2 ZINC000576673963 335233178 /nfs/dbraw/zinc/23/31/78/335233178.db2.gz SNBZPJTWGOPJCR-NSHDSACASA-N 1 1 284.428 4.682 20 0 CJADMO CC[N@@H+](C[C@H]1CCC(F)(F)C1)[C@@H](C)c1cccc(OC)c1 ZINC000576722233 335240123 /nfs/dbraw/zinc/24/01/23/335240123.db2.gz JPJPYGYXMNJSPG-KBPBESRZSA-N 1 1 297.389 4.514 20 0 CJADMO CC[N@@H+](C[C@H]1CCC(F)(F)C1)[C@H](C)c1cccc(OC)c1 ZINC000576722234 335240165 /nfs/dbraw/zinc/24/01/65/335240165.db2.gz JPJPYGYXMNJSPG-KGLIPLIRSA-N 1 1 297.389 4.514 20 0 CJADMO CC[N@@H+](C[C@@H]1CCC(F)(F)C1)[C@@H](C)c1cccc(OC)c1 ZINC000576722235 335240230 /nfs/dbraw/zinc/24/02/30/335240230.db2.gz JPJPYGYXMNJSPG-UONOGXRCSA-N 1 1 297.389 4.514 20 0 CJADMO CC[N@@H+](C[C@@H]1CCC(F)(F)C1)[C@H](C)c1cccc(OC)c1 ZINC000576722236 335240186 /nfs/dbraw/zinc/24/01/86/335240186.db2.gz JPJPYGYXMNJSPG-ZIAGYGMSSA-N 1 1 297.389 4.514 20 0 CJADMO CC(C)c1nc(C[N@H+]2CCC=C(c3ccccc3)C2)cs1 ZINC000576733250 335241397 /nfs/dbraw/zinc/24/13/97/335241397.db2.gz KBYVCUFGJJEVER-UHFFFAOYSA-N 1 1 298.455 4.556 20 0 CJADMO CC(C)c1nc(C[N@@H+]2CCC=C(c3ccccc3)C2)cs1 ZINC000576733250 335241396 /nfs/dbraw/zinc/24/13/96/335241396.db2.gz KBYVCUFGJJEVER-UHFFFAOYSA-N 1 1 298.455 4.556 20 0 CJADMO CC[N@@H+](Cc1ccc(Cl)c(C)c1)[C@@H](C)c1cccnc1 ZINC000576932825 335265475 /nfs/dbraw/zinc/26/54/75/335265475.db2.gz YWFJTVRSLJGRDZ-AWEZNQCLSA-N 1 1 288.822 4.627 20 0 CJADMO CC[N@@H+](Cc1ccc(Cl)c(C)c1)[C@H](C)c1cccnc1 ZINC000576932826 335265379 /nfs/dbraw/zinc/26/53/79/335265379.db2.gz YWFJTVRSLJGRDZ-CQSZACIVSA-N 1 1 288.822 4.627 20 0 CJADMO CC[N@@H+](Cc1csc2ccccc12)[C@@H](C)c1cccnc1 ZINC000576984026 335273260 /nfs/dbraw/zinc/27/32/60/335273260.db2.gz JBXJOMYLZAPAFO-AWEZNQCLSA-N 1 1 296.439 4.879 20 0 CJADMO CC[N@@H+](Cc1csc2ccccc12)[C@H](C)c1cccnc1 ZINC000576984028 335273308 /nfs/dbraw/zinc/27/33/08/335273308.db2.gz JBXJOMYLZAPAFO-CQSZACIVSA-N 1 1 296.439 4.879 20 0 CJADMO Cc1ccc([C@@H]2[C@@H](C)CCC[N@H+]2Cc2cccc(C)n2)cc1 ZINC000577024755 335283417 /nfs/dbraw/zinc/28/34/17/335283417.db2.gz JKTJKWCOATXWGE-JXFKEZNVSA-N 1 1 294.442 4.672 20 0 CJADMO Cc1ccc([C@H]2[C@@H](C)CCC[N@H+]2Cc2cccc(C)n2)cc1 ZINC000577024756 335283754 /nfs/dbraw/zinc/28/37/54/335283754.db2.gz JKTJKWCOATXWGE-OXJNMPFZSA-N 1 1 294.442 4.672 20 0 CJADMO Cc1ccc([C@H]2[C@H](C)CCC[N@H+]2Cc2cccc(C)n2)cc1 ZINC000577024757 335283759 /nfs/dbraw/zinc/28/37/59/335283759.db2.gz JKTJKWCOATXWGE-OXQOHEQNSA-N 1 1 294.442 4.672 20 0 CJADMO Cc1ccc([C@@H]2[C@H](C)CCC[N@H+]2Cc2cccc(C)n2)cc1 ZINC000577024758 335283656 /nfs/dbraw/zinc/28/36/56/335283656.db2.gz JKTJKWCOATXWGE-UZLBHIALSA-N 1 1 294.442 4.672 20 0 CJADMO CCC[N@@H+](Cc1cncc(F)c1)[C@H](CC)c1ccccc1 ZINC000577210588 335323134 /nfs/dbraw/zinc/32/31/34/335323134.db2.gz QBYYAAAFVGKYGL-GOSISDBHSA-N 1 1 286.394 4.584 20 0 CJADMO CCC[N@@H+](Cc1cncc(F)c1)[C@@H](CC)c1ccccc1 ZINC000577210589 335323293 /nfs/dbraw/zinc/32/32/93/335323293.db2.gz QBYYAAAFVGKYGL-SFHVURJKSA-N 1 1 286.394 4.584 20 0 CJADMO CC[N@@H+](Cc1ccc2occc2c1)[C@@H](C)c1cccc(O)c1 ZINC000577305355 335337410 /nfs/dbraw/zinc/33/74/10/335337410.db2.gz SNCRBZBXEBHVQZ-AWEZNQCLSA-N 1 1 295.382 4.722 20 0 CJADMO CC[N@@H+](Cc1ccc2occc2c1)[C@H](C)c1cccc(O)c1 ZINC000577305359 335337320 /nfs/dbraw/zinc/33/73/20/335337320.db2.gz SNCRBZBXEBHVQZ-CQSZACIVSA-N 1 1 295.382 4.722 20 0 CJADMO CC(C)[N@@H+](Cc1ccc2nc[nH]c2c1)[C@@H](C)c1ccccc1 ZINC000577340226 335340484 /nfs/dbraw/zinc/34/04/84/335340484.db2.gz HKBFEGOOLKGXJV-HNNXBMFYSA-N 1 1 293.414 4.535 20 0 CJADMO CC(C)[N@H+](Cc1ccc2nc[nH]c2c1)[C@@H](C)c1ccccc1 ZINC000577340226 335340482 /nfs/dbraw/zinc/34/04/82/335340482.db2.gz HKBFEGOOLKGXJV-HNNXBMFYSA-N 1 1 293.414 4.535 20 0 CJADMO CC(C)[N@@H+](Cc1ccc2[nH]cnc2c1)[C@@H](C)c1ccccc1 ZINC000577340226 335340481 /nfs/dbraw/zinc/34/04/81/335340481.db2.gz HKBFEGOOLKGXJV-HNNXBMFYSA-N 1 1 293.414 4.535 20 0 CJADMO CC(C)[N@@H+](Cc1ccc2nc[nH]c2c1)[C@H](C)c1ccccc1 ZINC000577340228 335340500 /nfs/dbraw/zinc/34/05/00/335340500.db2.gz HKBFEGOOLKGXJV-OAHLLOKOSA-N 1 1 293.414 4.535 20 0 CJADMO CC(C)[N@H+](Cc1ccc2nc[nH]c2c1)[C@H](C)c1ccccc1 ZINC000577340228 335340498 /nfs/dbraw/zinc/34/04/98/335340498.db2.gz HKBFEGOOLKGXJV-OAHLLOKOSA-N 1 1 293.414 4.535 20 0 CJADMO CC(C)[N@@H+](Cc1ccc2[nH]cnc2c1)[C@H](C)c1ccccc1 ZINC000577340228 335340496 /nfs/dbraw/zinc/34/04/96/335340496.db2.gz HKBFEGOOLKGXJV-OAHLLOKOSA-N 1 1 293.414 4.535 20 0 CJADMO CC[C@H](C)[N@@H+](Cc1ccccc1)Cc1ccc(Cl)cn1 ZINC000577405626 335349192 /nfs/dbraw/zinc/34/91/92/335349192.db2.gz FPHXNPPPFJDKQB-AWEZNQCLSA-N 1 1 288.822 4.536 20 0 CJADMO CC[C@@H](C)[N@@H+](Cc1ccccc1)Cc1ccc(Cl)cn1 ZINC000577405635 335349234 /nfs/dbraw/zinc/34/92/34/335349234.db2.gz FPHXNPPPFJDKQB-CQSZACIVSA-N 1 1 288.822 4.536 20 0 CJADMO CSc1ccc(C[N@@H+](Cc2cccs2)C(C)C)s1 ZINC000577431841 335351694 /nfs/dbraw/zinc/35/16/94/335351694.db2.gz DIDGLZUMAYYRNM-UHFFFAOYSA-N 1 1 297.514 4.942 20 0 CJADMO C[C@@H]([NH2+][C@@H]1CCCc2c(Cl)cccc21)c1cscn1 ZINC000577964302 335441165 /nfs/dbraw/zinc/44/11/65/335441165.db2.gz GHZPXGJFBONVJE-QMTHXVAHSA-N 1 1 292.835 4.525 20 0 CJADMO CC[C@@](C)([NH2+]Cc1ccc(C)cc1Cl)c1nccs1 ZINC000578446720 335635720 /nfs/dbraw/zinc/63/57/20/335635720.db2.gz BMNVEHKGPOKHDA-OAHLLOKOSA-N 1 1 294.851 4.520 20 0 CJADMO Cc1cc([C@H](C)[NH2+][C@@H](c2ccc(Cl)cc2)C(C)C)no1 ZINC000578805623 335676862 /nfs/dbraw/zinc/67/68/62/335676862.db2.gz XQFJHPUZOAOVSC-BLLLJJGKSA-N 1 1 292.810 4.684 20 0 CJADMO Cc1cc([C@@H](C)[NH2+][C@@H](c2ccc(Cl)cc2)C(C)C)no1 ZINC000578805625 335676848 /nfs/dbraw/zinc/67/68/48/335676848.db2.gz XQFJHPUZOAOVSC-MLGOLLRUSA-N 1 1 292.810 4.684 20 0 CJADMO C[C@H](Nc1cc(C2CC2)cc[nH+]1)c1cc(F)c(F)c(F)c1 ZINC000578822142 335677663 /nfs/dbraw/zinc/67/76/63/335677663.db2.gz WPXQOBXSFZYFIS-VIFPVBQESA-N 1 1 292.304 4.549 20 0 CJADMO CSc1ccc(C[NH2+][C@H](C)c2c(F)cccc2F)s1 ZINC000579412429 335745588 /nfs/dbraw/zinc/74/55/88/335745588.db2.gz RPXVCNBAWHXTKD-SECBINFHSA-N 1 1 299.411 4.599 20 0 CJADMO CSc1ccc(C[NH2+][C@@H](C)c2c(F)cccc2F)s1 ZINC000579412430 335745518 /nfs/dbraw/zinc/74/55/18/335745518.db2.gz RPXVCNBAWHXTKD-VIFPVBQESA-N 1 1 299.411 4.599 20 0 CJADMO CCOc1ccc([C@H](C)Nc2cc(C3CC3)cc[nH+]2)cc1 ZINC000579413347 335745635 /nfs/dbraw/zinc/74/56/35/335745635.db2.gz NRPLOUBHFBUWLC-ZDUSSCGKSA-N 1 1 282.387 4.531 20 0 CJADMO CCc1ccc([C@@H](C)Nc2cc(C3CC3)cc[nH+]2)s1 ZINC000579532704 335784521 /nfs/dbraw/zinc/78/45/21/335784521.db2.gz NGLSENRIPVHNCX-LLVKDONJSA-N 1 1 272.417 4.756 20 0 CJADMO CC[C@@H](c1ccc(F)cc1)[N@@H+](C)Cc1sccc1C ZINC000580564021 335286985 /nfs/dbraw/zinc/28/69/85/335286985.db2.gz SRKTXGJWACAKMH-HNNXBMFYSA-N 1 1 277.408 4.779 20 0 CJADMO CC[C@H](c1ccc(F)cc1)[N@@H+](C)Cc1sccc1C ZINC000580564023 335286860 /nfs/dbraw/zinc/28/68/60/335286860.db2.gz SRKTXGJWACAKMH-OAHLLOKOSA-N 1 1 277.408 4.779 20 0 CJADMO C[C@H]1C[C@@H](c2ccccc2)[N@@H+](Cc2scnc2C2CC2)C1 ZINC000580602542 335297456 /nfs/dbraw/zinc/29/74/56/335297456.db2.gz JRIFSMUAGSUFII-BBRMVZONSA-N 1 1 298.455 4.604 20 0 CJADMO C[C@@H]1C[C@@H](c2ccccc2)[N@@H+](Cc2scnc2C2CC2)C1 ZINC000580602543 335297538 /nfs/dbraw/zinc/29/75/38/335297538.db2.gz JRIFSMUAGSUFII-CJNGLKHVSA-N 1 1 298.455 4.604 20 0 CJADMO C[C@@H]1C[C@H](c2ccccc2)[N@@H+](Cc2scnc2C2CC2)C1 ZINC000580602544 335297420 /nfs/dbraw/zinc/29/74/20/335297420.db2.gz JRIFSMUAGSUFII-CZUORRHYSA-N 1 1 298.455 4.604 20 0 CJADMO C[C@H]1C[C@H](c2ccccc2)[N@@H+](Cc2scnc2C2CC2)C1 ZINC000580602545 335297385 /nfs/dbraw/zinc/29/73/85/335297385.db2.gz JRIFSMUAGSUFII-XJKSGUPXSA-N 1 1 298.455 4.604 20 0 CJADMO CC(C)Cc1cccc([C@H](C)[NH2+]Cc2ccn(C(C)C)n2)c1 ZINC000581326181 336049893 /nfs/dbraw/zinc/04/98/93/336049893.db2.gz AJTPREPIPSRIIF-INIZCTEOSA-N 1 1 299.462 4.513 20 0 CJADMO CC(C)Cc1cccc([C@@H](C)[NH2+]Cc2ccn(C(C)C)n2)c1 ZINC000581326182 336049884 /nfs/dbraw/zinc/04/98/84/336049884.db2.gz AJTPREPIPSRIIF-MRXNPFEDSA-N 1 1 299.462 4.513 20 0 CJADMO CC[C@H](Nc1cc(C2CC2)cc[nH+]1)c1cccc(OC)c1 ZINC000581339757 336052643 /nfs/dbraw/zinc/05/26/43/336052643.db2.gz MPSVRGWLIHNWMU-KRWDZBQOSA-N 1 1 282.387 4.531 20 0 CJADMO CC[C@@H](Nc1cc(C2CC2)cc[nH+]1)c1cccc(OC)c1 ZINC000581339758 336052722 /nfs/dbraw/zinc/05/27/22/336052722.db2.gz MPSVRGWLIHNWMU-QGZVFWFLSA-N 1 1 282.387 4.531 20 0 CJADMO C[C@H](C1CC1)[N@@H+](Cc1cscc1C(F)(F)F)C1CC1 ZINC000581341931 336053246 /nfs/dbraw/zinc/05/32/46/336053246.db2.gz PPGKLAJINLCHBK-SECBINFHSA-N 1 1 289.366 4.530 20 0 CJADMO C[C@@H](C1CC1)[N@@H+](Cc1cscc1C(F)(F)F)C1CC1 ZINC000581341932 327134990 /nfs/dbraw/zinc/13/49/90/327134990.db2.gz PPGKLAJINLCHBK-VIFPVBQESA-N 1 1 289.366 4.530 20 0 CJADMO Cc1ccc2c(c1)[C@@H](Nc1cc(C3CC3)cc[nH+]1)CCCO2 ZINC000581458526 336080358 /nfs/dbraw/zinc/08/03/58/336080358.db2.gz XCWSUBKUVAVATK-KRWDZBQOSA-N 1 1 294.398 4.593 20 0 CJADMO Cc1ccc2c(c1)[C@H](Nc1cc(C3CC3)cc[nH+]1)CCCO2 ZINC000581458527 336080428 /nfs/dbraw/zinc/08/04/28/336080428.db2.gz XCWSUBKUVAVATK-QGZVFWFLSA-N 1 1 294.398 4.593 20 0 CJADMO C/C(=C/c1ccccc1)C[N@H+](C)C1CCC(F)(F)CC1 ZINC000581516104 336092653 /nfs/dbraw/zinc/09/26/53/336092653.db2.gz WTKLIKYOQCRLDT-OWBHPGMISA-N 1 1 279.374 4.600 20 0 CJADMO C/C(=C\c1ccccc1)C[N@H+](C)C1CCC(F)(F)CC1 ZINC000581516105 336092799 /nfs/dbraw/zinc/09/27/99/336092799.db2.gz WTKLIKYOQCRLDT-WYMLVPIESA-N 1 1 279.374 4.600 20 0 CJADMO CC[C@H](Nc1cc(C2CC2)cc[nH+]1)c1ccc(OC)cc1 ZINC000581637092 336115622 /nfs/dbraw/zinc/11/56/22/336115622.db2.gz FIJYYKZXAAKAIB-KRWDZBQOSA-N 1 1 282.387 4.531 20 0 CJADMO CC[C@@H](Nc1cc(C2CC2)cc[nH+]1)c1ccc(OC)cc1 ZINC000581637093 336115677 /nfs/dbraw/zinc/11/56/77/336115677.db2.gz FIJYYKZXAAKAIB-QGZVFWFLSA-N 1 1 282.387 4.531 20 0 CJADMO FC(F)(F)CCCC[N@H+]1CCCC[C@H]1c1ccccc1 ZINC000581976374 336181885 /nfs/dbraw/zinc/18/18/85/336181885.db2.gz GQBMFXFSDCOLMN-HNNXBMFYSA-N 1 1 285.353 4.946 20 0 CJADMO FC(F)(F)CCCC[N@H+]1CCCC[C@@H]1c1ccccc1 ZINC000581976375 336181980 /nfs/dbraw/zinc/18/19/80/336181980.db2.gz GQBMFXFSDCOLMN-OAHLLOKOSA-N 1 1 285.353 4.946 20 0 CJADMO CC(C)[C@H]1C[C@H]([NH2+][C@@H](C)c2cscn2)c2ccccc21 ZINC000582014454 336192231 /nfs/dbraw/zinc/19/22/31/336192231.db2.gz SCCIFGRDIGKIOW-MAZHCROVSA-N 1 1 286.444 4.678 20 0 CJADMO CC(C)[C@@H]1C[C@H]([NH2+][C@@H](C)c2cscn2)c2ccccc21 ZINC000582014455 336192205 /nfs/dbraw/zinc/19/22/05/336192205.db2.gz SCCIFGRDIGKIOW-RCBQFDQVSA-N 1 1 286.444 4.678 20 0 CJADMO CC(C)[C@@H]1C[C@@H]([NH2+][C@@H](C)c2cscn2)c2ccccc21 ZINC000582014456 336192322 /nfs/dbraw/zinc/19/23/22/336192322.db2.gz SCCIFGRDIGKIOW-VBNZEHGJSA-N 1 1 286.444 4.678 20 0 CJADMO Cc1ccc[nH+]c1NCc1cnc(C2CCCCC2)s1 ZINC000582390009 328977491 /nfs/dbraw/zinc/97/74/91/328977491.db2.gz NQNVSAOJAQJJSU-UHFFFAOYSA-N 1 1 287.432 4.506 20 0 CJADMO CCC(=O)CCC[N@@H+](C)Cc1ccccc1-c1ccccc1 ZINC000582447419 329005417 /nfs/dbraw/zinc/00/54/17/329005417.db2.gz LJARUSALBRZJHK-UHFFFAOYSA-N 1 1 295.426 4.545 20 0 CJADMO Cc1ccc(CC[N@H+](C)[C@H]2CC[C@@H](C(F)(F)F)CC2)cc1 ZINC000582569715 329109515 /nfs/dbraw/zinc/10/95/15/329109515.db2.gz NTLWUFPEVFOSKK-IYBDPMFKSA-N 1 1 299.380 4.590 20 0 CJADMO Cc1ccc(C[N@H+](C)[C@H]2CC[C@@H](C(F)(F)F)CC2)cc1 ZINC000582629070 329119461 /nfs/dbraw/zinc/11/94/61/329119461.db2.gz ICEHWGPTMJVAPX-GASCZTMLSA-N 1 1 285.353 4.548 20 0 CJADMO CC(C)Cc1cccc([C@H](C)[NH2+][C@@H](C)c2cscn2)c1 ZINC000582677292 329126942 /nfs/dbraw/zinc/12/69/42/329126942.db2.gz NCUINRBNTBLSHX-KBPBESRZSA-N 1 1 288.460 4.753 20 0 CJADMO CC(C)Cc1cccc([C@@H](C)[NH2+][C@@H](C)c2cscn2)c1 ZINC000582677296 329127021 /nfs/dbraw/zinc/12/70/21/329127021.db2.gz NCUINRBNTBLSHX-KGLIPLIRSA-N 1 1 288.460 4.753 20 0 CJADMO CC(C)Cc1cccc([C@H](C)[NH2+][C@H](C)c2cscn2)c1 ZINC000582677297 329127175 /nfs/dbraw/zinc/12/71/75/329127175.db2.gz NCUINRBNTBLSHX-UONOGXRCSA-N 1 1 288.460 4.753 20 0 CJADMO CC(C)Cc1cccc([C@@H](C)[NH2+][C@H](C)c2cscn2)c1 ZINC000582677299 329127033 /nfs/dbraw/zinc/12/70/33/329127033.db2.gz NCUINRBNTBLSHX-ZIAGYGMSSA-N 1 1 288.460 4.753 20 0 CJADMO CC[C@@H](c1ccc(F)cc1F)[N@@H+](C)Cc1sccc1C ZINC000582692554 329128526 /nfs/dbraw/zinc/12/85/26/329128526.db2.gz BYIYWSXFHNVDHB-HNNXBMFYSA-N 1 1 295.398 4.918 20 0 CJADMO CC[C@H](c1ccc(F)cc1F)[N@@H+](C)Cc1sccc1C ZINC000582692555 329128535 /nfs/dbraw/zinc/12/85/35/329128535.db2.gz BYIYWSXFHNVDHB-OAHLLOKOSA-N 1 1 295.398 4.918 20 0 CJADMO CCC[C@@H]([NH2+][C@H](C)c1cscn1)c1ccc(Cl)cc1 ZINC000582862448 329278006 /nfs/dbraw/zinc/27/80/06/329278006.db2.gz SLDPULOGPUWGPR-BXUZGUMPSA-N 1 1 294.851 4.989 20 0 CJADMO CCC[C@H]([NH2+][C@@H](C)c1cscn1)c1ccc(Cl)cc1 ZINC000582862450 329278010 /nfs/dbraw/zinc/27/80/10/329278010.db2.gz SLDPULOGPUWGPR-FZMZJTMJSA-N 1 1 294.851 4.989 20 0 CJADMO CCC[C@H]([NH2+][C@H](C)c1cscn1)c1ccc(Cl)cc1 ZINC000582862451 329278056 /nfs/dbraw/zinc/27/80/56/329278056.db2.gz SLDPULOGPUWGPR-RISCZKNCSA-N 1 1 294.851 4.989 20 0 CJADMO CCC[C@@H]([NH2+][C@@H](C)c1cscn1)c1ccc(Cl)cc1 ZINC000582862452 329278096 /nfs/dbraw/zinc/27/80/96/329278096.db2.gz SLDPULOGPUWGPR-SMDDNHRTSA-N 1 1 294.851 4.989 20 0 CJADMO CC(C)c1ccc(C[N@@H+](CC2CCC(=O)CC2)C2CC2)cc1 ZINC000582871503 329278831 /nfs/dbraw/zinc/27/88/31/329278831.db2.gz CENKFWAHQRVMID-UHFFFAOYSA-N 1 1 299.458 4.534 20 0 CJADMO CCC(C)(C)[N@@H+](C)Cc1ccc(-c2ccncc2)cc1F ZINC000582920752 329288945 /nfs/dbraw/zinc/28/89/45/329288945.db2.gz VVHXHVSWBQNFJM-UHFFFAOYSA-N 1 1 286.394 4.508 20 0 CJADMO Cc1cccc(C[N@H+](C)[C@@H](C)c2ccc(C(C)C)cc2)n1 ZINC000582929129 329286264 /nfs/dbraw/zinc/28/62/64/329286264.db2.gz YQBFUZJAIASKAV-INIZCTEOSA-N 1 1 282.431 4.706 20 0 CJADMO Cc1cccc(C[N@H+](C)[C@H](C)c2ccc(C(C)C)cc2)n1 ZINC000582929134 329286257 /nfs/dbraw/zinc/28/62/57/329286257.db2.gz YQBFUZJAIASKAV-MRXNPFEDSA-N 1 1 282.431 4.706 20 0 CJADMO CO[C@@]1(C)CCC[N@H+]([C@@H](C)c2cccc3ccccc32)CC1 ZINC000583179019 329341493 /nfs/dbraw/zinc/34/14/93/329341493.db2.gz KNVLPWYROCXPHW-JXFKEZNVSA-N 1 1 297.442 4.792 20 0 CJADMO CO[C@]1(C)CCC[N@H+]([C@@H](C)c2cccc3ccccc32)CC1 ZINC000583179020 329341572 /nfs/dbraw/zinc/34/15/72/329341572.db2.gz KNVLPWYROCXPHW-OXJNMPFZSA-N 1 1 297.442 4.792 20 0 CJADMO CO[C@]1(C)CCC[N@H+]([C@H](C)c2cccc3ccccc32)CC1 ZINC000583179021 329341681 /nfs/dbraw/zinc/34/16/81/329341681.db2.gz KNVLPWYROCXPHW-OXQOHEQNSA-N 1 1 297.442 4.792 20 0 CJADMO CO[C@@]1(C)CCC[N@H+]([C@H](C)c2cccc3ccccc32)CC1 ZINC000583179022 329341550 /nfs/dbraw/zinc/34/15/50/329341550.db2.gz KNVLPWYROCXPHW-UZLBHIALSA-N 1 1 297.442 4.792 20 0 CJADMO CC[N@@H+](CCc1cccs1)Cc1ccc(SC)s1 ZINC000583235686 329387512 /nfs/dbraw/zinc/38/75/12/329387512.db2.gz LGYJZLPSRRGJDS-UHFFFAOYSA-N 1 1 297.514 4.596 20 0 CJADMO Cc1ccc[nH+]c1NCc1cc(-c2ccccc2)cs1 ZINC000583429574 327360524 /nfs/dbraw/zinc/36/05/24/327360524.db2.gz YYVIBGYLYINPMI-UHFFFAOYSA-N 1 1 280.396 4.731 20 0 CJADMO CC[C@@H](c1ccncc1)[N@@H+](C)CC[C@@H](C)c1ccccc1 ZINC000584259656 327203387 /nfs/dbraw/zinc/20/33/87/327203387.db2.gz XAOJNHOCCNBJMM-APWZRJJASA-N 1 1 282.431 4.658 20 0 CJADMO CC[C@@H](c1ccncc1)[N@@H+](C)CC[C@H](C)c1ccccc1 ZINC000584259657 327203397 /nfs/dbraw/zinc/20/33/97/327203397.db2.gz XAOJNHOCCNBJMM-LPHOPBHVSA-N 1 1 282.431 4.658 20 0 CJADMO CC[C@H](c1ccncc1)[N@@H+](C)CC[C@H](C)c1ccccc1 ZINC000584259658 327203378 /nfs/dbraw/zinc/20/33/78/327203378.db2.gz XAOJNHOCCNBJMM-QFBILLFUSA-N 1 1 282.431 4.658 20 0 CJADMO CC[C@H](c1ccncc1)[N@@H+](C)CC[C@@H](C)c1ccccc1 ZINC000584259659 327203380 /nfs/dbraw/zinc/20/33/80/327203380.db2.gz XAOJNHOCCNBJMM-VQIMIIECSA-N 1 1 282.431 4.658 20 0 CJADMO FC(F)(F)c1ccc(CNc2cc(C3CC3)cc[nH+]2)s1 ZINC000584380577 329307362 /nfs/dbraw/zinc/30/73/62/329307362.db2.gz KFRKMIZQFZXEPK-UHFFFAOYSA-N 1 1 298.333 4.651 20 0 CJADMO Cc1cccc(C[N@H+](C)C2CCCCC2)c1Br ZINC000725262850 567923063 /nfs/dbraw/zinc/92/30/63/567923063.db2.gz ZQPIGMDZOQSTDI-UHFFFAOYSA-N 1 1 296.252 4.522 20 0 CJADMO