smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Nc1ccc([NH2+]CCC2CCCCC2)cc1 ZINC000037742120 712753657 /nfs/dbraw/zinc/75/36/57/712753657.db2.gz JOOOOBGKVGQGEG-UHFFFAOYSA-N 1 1 218.344 3.651 20 10 BHCDMO C[C@@H]1CCCC[C@@H]1C[NH2+]c1ccc(N)cc1 ZINC000042859951 637389054 /nfs/dbraw/zinc/38/90/54/637389054.db2.gz SIKQBWMYPWNNQR-VXGBXAGGSA-N 1 1 218.344 3.507 20 10 BHCDMO C[C@H]1CCCC[C@@H]1C[NH2+]c1ccc(N)cc1 ZINC000042859952 637389206 /nfs/dbraw/zinc/38/92/06/637389206.db2.gz SIKQBWMYPWNNQR-NWDGAFQWSA-N 1 1 218.344 3.507 20 10 BHCDMO C[C@@H]1CCCC[C@H]1C[NH2+]c1ccc(N)cc1 ZINC000042859954 637388923 /nfs/dbraw/zinc/38/89/23/637388923.db2.gz SIKQBWMYPWNNQR-NEPJUHHUSA-N 1 1 218.344 3.507 20 10 BHCDMO C[C@H]1CCCC[C@H]1C[NH2+]c1ccc(N)cc1 ZINC000042859956 637390164 /nfs/dbraw/zinc/39/01/64/637390164.db2.gz SIKQBWMYPWNNQR-RYUDHWBXSA-N 1 1 218.344 3.507 20 10 BHCDMO C[C@H]([NH2+]c1ccc(N)cc1)C1CCCCC1 ZINC000052334564 643646488 /nfs/dbraw/zinc/64/64/88/643646488.db2.gz SOJGVOAGLDONJB-NSHDSACASA-N 1 1 218.344 3.650 20 10 BHCDMO C[C@@H]([NH2+]c1ccc(N)cc1)C1CCCCC1 ZINC000052334567 632128321 /nfs/dbraw/zinc/12/83/21/632128321.db2.gz SOJGVOAGLDONJB-LLVKDONJSA-N 1 1 218.344 3.650 20 10 BHCDMO C[C@@H](CC[NH2+]c1ccc(N)cc1)c1ccccc1 ZINC000061910184 641005167 /nfs/dbraw/zinc/00/51/67/641005167.db2.gz SGXAOACGIXAWLO-ZDUSSCGKSA-N 1 1 240.350 3.875 20 10 BHCDMO C[C@H](CC[NH2+]c1ccc(N)cc1)c1ccccc1 ZINC000061910185 641004775 /nfs/dbraw/zinc/00/47/75/641004775.db2.gz SGXAOACGIXAWLO-CYBMUJFWSA-N 1 1 240.350 3.875 20 10 BHCDMO C[C@H]([NH2+]C1CCCCC1)c1ccc(F)cc1O ZINC000062744690 641085513 /nfs/dbraw/zinc/08/55/13/641085513.db2.gz XXIIIJMTSFGMAX-JTQLQIEISA-N 1 1 237.318 3.515 20 10 BHCDMO C[C@@H]([NH2+]C1CCCCC1)c1ccc(F)cc1O ZINC000062744691 641084429 /nfs/dbraw/zinc/08/44/29/641084429.db2.gz XXIIIJMTSFGMAX-SNVBAGLBSA-N 1 1 237.318 3.515 20 10 BHCDMO CCCCCC[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000062745112 641086251 /nfs/dbraw/zinc/08/62/51/641086251.db2.gz NBPBLEAITFSPGP-NSHDSACASA-N 1 1 239.334 3.762 20 10 BHCDMO CCCCCC[NH2+][C@H](C)c1ccc(F)cc1O ZINC000062745113 641087476 /nfs/dbraw/zinc/08/74/76/641087476.db2.gz NBPBLEAITFSPGP-LLVKDONJSA-N 1 1 239.334 3.762 20 10 BHCDMO CC(C)C[C@@H](C)[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000062745782 188303525 /nfs/dbraw/zinc/30/35/25/188303525.db2.gz OTSXRZLIRKSPFF-MNOVXSKESA-N 1 1 239.334 3.617 20 10 BHCDMO CC(C)C[C@H](C)[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000062745783 641085361 /nfs/dbraw/zinc/08/53/61/641085361.db2.gz OTSXRZLIRKSPFF-QWRGUYRKSA-N 1 1 239.334 3.617 20 10 BHCDMO CC(C)C[C@@H](C)[NH2+][C@H](C)c1ccc(F)cc1O ZINC000062745784 188302862 /nfs/dbraw/zinc/30/28/62/188302862.db2.gz OTSXRZLIRKSPFF-GHMZBOCLSA-N 1 1 239.334 3.617 20 10 BHCDMO CC(C)C[C@H](C)[NH2+][C@H](C)c1ccc(F)cc1O ZINC000062745785 641084504 /nfs/dbraw/zinc/08/45/04/641084504.db2.gz OTSXRZLIRKSPFF-WDEREUQCSA-N 1 1 239.334 3.617 20 10 BHCDMO CC(C)CCC[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000062747906 641200680 /nfs/dbraw/zinc/20/06/80/641200680.db2.gz IFWGKNVMTLNMKH-NSHDSACASA-N 1 1 239.334 3.618 20 10 BHCDMO CC(C)CCC[NH2+][C@H](C)c1ccc(F)cc1O ZINC000062747907 641090653 /nfs/dbraw/zinc/09/06/53/641090653.db2.gz IFWGKNVMTLNMKH-LLVKDONJSA-N 1 1 239.334 3.618 20 10 BHCDMO CC[C@H](C)[C@@H](C)[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000062748165 641091085 /nfs/dbraw/zinc/09/10/85/641091085.db2.gz ASRMAMHLNZURTG-AXFHLTTASA-N 1 1 239.334 3.617 20 10 BHCDMO CC[C@H](C)[C@H](C)[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000062748167 641091785 /nfs/dbraw/zinc/09/17/85/641091785.db2.gz ASRMAMHLNZURTG-DCAQKATOSA-N 1 1 239.334 3.617 20 10 BHCDMO C[C@H]([NH2+]C[C@H]1CC=CCC1)c1ccc(F)cc1O ZINC000062748383 641092063 /nfs/dbraw/zinc/09/20/63/641092063.db2.gz OHGTXNGRUOWMFA-RYUDHWBXSA-N 1 1 249.329 3.538 20 10 BHCDMO C[C@@H]([NH2+]C[C@H]1CC=CCC1)c1ccc(F)cc1O ZINC000062748384 641092202 /nfs/dbraw/zinc/09/22/02/641092202.db2.gz OHGTXNGRUOWMFA-NEPJUHHUSA-N 1 1 249.329 3.538 20 10 BHCDMO C[C@H]([NH2+]C[C@@H]1CC=CCC1)c1ccc(F)cc1O ZINC000062748385 641091099 /nfs/dbraw/zinc/09/10/99/641091099.db2.gz OHGTXNGRUOWMFA-NWDGAFQWSA-N 1 1 249.329 3.538 20 10 BHCDMO C[C@@H]([NH2+]C[C@@H]1CC=CCC1)c1ccc(F)cc1O ZINC000062748386 641090521 /nfs/dbraw/zinc/09/05/21/641090521.db2.gz OHGTXNGRUOWMFA-VXGBXAGGSA-N 1 1 249.329 3.538 20 10 BHCDMO CCC[C@@H](CC)[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000062748415 169379529 /nfs/dbraw/zinc/37/95/29/169379529.db2.gz JXUQTJPXEIZUMA-CMPLNLGQSA-N 1 1 239.334 3.761 20 10 BHCDMO CCC[C@H](CC)[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000062748416 641092249 /nfs/dbraw/zinc/09/22/49/641092249.db2.gz JXUQTJPXEIZUMA-JQWIXIFHSA-N 1 1 239.334 3.761 20 10 BHCDMO CCC[C@@H](CC)[NH2+][C@H](C)c1ccc(F)cc1O ZINC000062748417 169380395 /nfs/dbraw/zinc/38/03/95/169380395.db2.gz JXUQTJPXEIZUMA-ZYHUDNBSSA-N 1 1 239.334 3.761 20 10 BHCDMO CCC[C@H](CC)[NH2+][C@H](C)c1ccc(F)cc1O ZINC000062748418 641091737 /nfs/dbraw/zinc/09/17/37/641091737.db2.gz JXUQTJPXEIZUMA-PWSUYJOCSA-N 1 1 239.334 3.761 20 10 BHCDMO CC[N@@H+](Cc1ccccc1O)C1CCCCC1 ZINC000070976870 643087995 /nfs/dbraw/zinc/08/79/95/643087995.db2.gz WGYPFUIIGCOOCK-UHFFFAOYSA-N 1 1 233.355 3.547 20 10 BHCDMO CC(C)[N@@H+](Cc1ccc(N(C)C)cc1)C1CCC1 ZINC000093608230 635752289 /nfs/dbraw/zinc/75/22/89/635752289.db2.gz HEGOPUHVVJPEKN-UHFFFAOYSA-N 1 1 246.398 3.516 20 10 BHCDMO Cc1cc(O)c(C[N@H+](C(C)C)C2CCC2)cc1C ZINC000093608310 634569024 /nfs/dbraw/zinc/56/90/24/634569024.db2.gz IPDPXTFZKNOJNR-UHFFFAOYSA-N 1 1 247.382 3.772 20 10 BHCDMO C[C@@H]1CCC[N@H+]1Cc1c(O)ccc2ccccc21 ZINC000097987281 642652375 /nfs/dbraw/zinc/65/23/75/642652375.db2.gz VQCQYOOHLFJSNS-GFCCVEGCSA-N 1 1 241.334 3.530 20 10 BHCDMO C[C@H]1CCC[N@H+]1Cc1c(O)ccc2ccccc21 ZINC000097987282 642652131 /nfs/dbraw/zinc/65/21/31/642652131.db2.gz VQCQYOOHLFJSNS-LBPRGKRZSA-N 1 1 241.334 3.530 20 10 BHCDMO CCC[N@@H+](CC)Cc1c(O)ccc2ccccc21 ZINC000112465869 588799092 /nfs/dbraw/zinc/79/90/92/588799092.db2.gz BPESKRVXLGKOGS-UHFFFAOYSA-N 1 1 243.350 3.777 20 10 BHCDMO CC(C)C[N@@H+](Cc1ccccc1O)C1CCCC1 ZINC000113750622 588852911 /nfs/dbraw/zinc/85/29/11/588852911.db2.gz UGHVDHYOKXAZSA-UHFFFAOYSA-N 1 1 247.382 3.793 20 10 BHCDMO CC[N@@H+](Cc1cc(C(C)C)c(C)cc1O)C1CC1 ZINC000121880767 631985069 /nfs/dbraw/zinc/98/50/69/631985069.db2.gz MDKRYNZBQHRPFS-UHFFFAOYSA-N 1 1 247.382 3.808 20 10 BHCDMO Cc1cccc(C[N@H+](C)C2CCC(C)CC2)c1O ZINC000124518667 590038530 /nfs/dbraw/zinc/03/85/30/590038530.db2.gz SVVMNNKNZRFIDN-UHFFFAOYSA-N 1 1 247.382 3.711 20 10 BHCDMO Cc1cccc(C[N@H+](C)C2CCCCCC2)c1O ZINC000124521406 590046595 /nfs/dbraw/zinc/04/65/95/590046595.db2.gz ZERCNGLCPYNGHA-UHFFFAOYSA-N 1 1 247.382 3.855 20 10 BHCDMO Cc1cccc(C[N@@H+](C)CC2CCCCC2)c1O ZINC000124526265 590046778 /nfs/dbraw/zinc/04/67/78/590046778.db2.gz JBBIMCYPCOBGGY-UHFFFAOYSA-N 1 1 247.382 3.713 20 10 BHCDMO Cc1cccc(C[N@H+](C)[C@@H]2CCC[C@H](C)C2)c1O ZINC000124531332 590047471 /nfs/dbraw/zinc/04/74/71/590047471.db2.gz FANSOBHNFLVFSZ-SWLSCSKDSA-N 1 1 247.382 3.711 20 10 BHCDMO Cc1cccc(C[N@H+](C)[C@H]2CCC[C@H](C)C2)c1O ZINC000124531529 590047366 /nfs/dbraw/zinc/04/73/66/590047366.db2.gz FANSOBHNFLVFSZ-WFASDCNBSA-N 1 1 247.382 3.711 20 10 BHCDMO Cc1cccc(C[N@H+](CC(C)C)C(C)C)c1O ZINC000124547971 590049824 /nfs/dbraw/zinc/04/98/24/590049824.db2.gz OCZSVWHHJDEEKU-UHFFFAOYSA-N 1 1 235.371 3.567 20 10 BHCDMO CCC1(CC)CC[N@@H+](Cc2cccc(C)c2O)C1 ZINC000124600274 590061296 /nfs/dbraw/zinc/06/12/96/590061296.db2.gz CLESHCLRLOPILN-UHFFFAOYSA-N 1 1 247.382 3.713 20 10 BHCDMO Cc1cccc(C[N@H+]2CCCC(C)(C)CC2)c1O ZINC000124609162 590067306 /nfs/dbraw/zinc/06/73/06/590067306.db2.gz DPZMJVISWJLYII-UHFFFAOYSA-N 1 1 247.382 3.713 20 10 BHCDMO CC[C@@H](C)C[N@@H+](CC)Cc1cccc(C)c1O ZINC000124610216 590067517 /nfs/dbraw/zinc/06/75/17/590067517.db2.gz HPFGULBQOXNZLY-GFCCVEGCSA-N 1 1 235.371 3.569 20 10 BHCDMO CC[C@H](C)C[N@@H+](CC)Cc1cccc(C)c1O ZINC000124610413 590067326 /nfs/dbraw/zinc/06/73/26/590067326.db2.gz HPFGULBQOXNZLY-LBPRGKRZSA-N 1 1 235.371 3.569 20 10 BHCDMO Cc1ccc(O)c(C[N@@H+](C2CC2)C2CCCC2)c1 ZINC000130224571 591448329 /nfs/dbraw/zinc/44/83/29/591448329.db2.gz UZYNHKLWYGIABD-UHFFFAOYSA-N 1 1 245.366 3.608 20 10 BHCDMO CC[N@@H+](Cc1cc(C)ccc1O)C1CCCCC1 ZINC000131764032 591652427 /nfs/dbraw/zinc/65/24/27/591652427.db2.gz XLDOROAGGCJMGK-UHFFFAOYSA-N 1 1 247.382 3.855 20 10 BHCDMO CC[N@H+](Cc1cc(Cl)ccc1O)CC(C)C ZINC000132532347 591717315 /nfs/dbraw/zinc/71/73/15/591717315.db2.gz IVGJIFNWLPJKFR-UHFFFAOYSA-N 1 1 241.762 3.524 20 10 BHCDMO CC[N@H+](Cc1c(O)cccc1Cl)CC(C)C ZINC000132534168 591717288 /nfs/dbraw/zinc/71/72/88/591717288.db2.gz NEMLVPHTPOOZER-UHFFFAOYSA-N 1 1 241.762 3.524 20 10 BHCDMO Cc1ccc(O)c(C[N@H+](C)[C@@H](C)C(C)(C)C)c1 ZINC000132557802 591719365 /nfs/dbraw/zinc/71/93/65/591719365.db2.gz YBYLBKHOIYNWPX-LBPRGKRZSA-N 1 1 235.371 3.567 20 10 BHCDMO Cc1ccc(O)c(C[N@H+](C)[C@H](C)C(C)(C)C)c1 ZINC000132558038 591719511 /nfs/dbraw/zinc/71/95/11/591719511.db2.gz YBYLBKHOIYNWPX-GFCCVEGCSA-N 1 1 235.371 3.567 20 10 BHCDMO CC[C@@H](C)C[N@@H+](C)Cc1cc(Cl)ccc1O ZINC000132584998 591720859 /nfs/dbraw/zinc/72/08/59/591720859.db2.gz JVRVREAIYTVMHR-SNVBAGLBSA-N 1 1 241.762 3.524 20 10 BHCDMO CC[C@H](C)C[N@@H+](C)Cc1cc(Cl)ccc1O ZINC000132585208 591720799 /nfs/dbraw/zinc/72/07/99/591720799.db2.gz JVRVREAIYTVMHR-JTQLQIEISA-N 1 1 241.762 3.524 20 10 BHCDMO CC[C@@H](C)C[N@@H+](C)Cc1c(O)cccc1Cl ZINC000132587175 583842488 /nfs/dbraw/zinc/84/24/88/583842488.db2.gz PVVKLXVOPKPLHF-SNVBAGLBSA-N 1 1 241.762 3.524 20 10 BHCDMO CC[C@H](C)C[N@@H+](C)Cc1c(O)cccc1Cl ZINC000132587368 591722308 /nfs/dbraw/zinc/72/23/08/591722308.db2.gz PVVKLXVOPKPLHF-JTQLQIEISA-N 1 1 241.762 3.524 20 10 BHCDMO CC(C)[C@@H](C)[N@@H+](C)Cc1cc(Cl)ccc1O ZINC000132616663 591724273 /nfs/dbraw/zinc/72/42/73/591724273.db2.gz NJUXTQRCKNMEEJ-SNVBAGLBSA-N 1 1 241.762 3.522 20 10 BHCDMO CC(C)[C@H](C)[N@@H+](C)Cc1cc(Cl)ccc1O ZINC000132616890 591725118 /nfs/dbraw/zinc/72/51/18/591725118.db2.gz NJUXTQRCKNMEEJ-JTQLQIEISA-N 1 1 241.762 3.522 20 10 BHCDMO CC(C)[C@@H](C)[N@@H+](C)Cc1c(O)cccc1Cl ZINC000132619772 591724236 /nfs/dbraw/zinc/72/42/36/591724236.db2.gz XTSZSIZIECXPBT-SNVBAGLBSA-N 1 1 241.762 3.522 20 10 BHCDMO CC(C)[C@H](C)[N@@H+](C)Cc1c(O)cccc1Cl ZINC000132619977 591723889 /nfs/dbraw/zinc/72/38/89/591723889.db2.gz XTSZSIZIECXPBT-JTQLQIEISA-N 1 1 241.762 3.522 20 10 BHCDMO CCC[C@@H](C)[N@@H+](C)Cc1cc(Cl)ccc1O ZINC000132625233 591724307 /nfs/dbraw/zinc/72/43/07/591724307.db2.gz VNJUXCKFUWGHGC-SNVBAGLBSA-N 1 1 241.762 3.666 20 10 BHCDMO CCC[C@H](C)[N@@H+](C)Cc1cc(Cl)ccc1O ZINC000132625433 591725067 /nfs/dbraw/zinc/72/50/67/591725067.db2.gz VNJUXCKFUWGHGC-JTQLQIEISA-N 1 1 241.762 3.666 20 10 BHCDMO CCC[C@@H](C)[N@@H+](C)Cc1c(O)cccc1Cl ZINC000132628377 591724229 /nfs/dbraw/zinc/72/42/29/591724229.db2.gz QQCKTZGNXASIRK-SNVBAGLBSA-N 1 1 241.762 3.666 20 10 BHCDMO CCC[C@H](C)[N@@H+](C)Cc1c(O)cccc1Cl ZINC000132628555 591726315 /nfs/dbraw/zinc/72/63/15/591726315.db2.gz QQCKTZGNXASIRK-JTQLQIEISA-N 1 1 241.762 3.666 20 10 BHCDMO C[N@@H+](Cc1cc(Cl)ccc1O)CC(C)(C)C ZINC000132697864 591731071 /nfs/dbraw/zinc/73/10/71/591731071.db2.gz CRNXYXVAIRVJSE-UHFFFAOYSA-N 1 1 241.762 3.524 20 10 BHCDMO C[N@@H+](Cc1c(O)cccc1Cl)CC(C)(C)C ZINC000132699646 591730798 /nfs/dbraw/zinc/73/07/98/591730798.db2.gz DRADOXXOYPIOIM-UHFFFAOYSA-N 1 1 241.762 3.524 20 10 BHCDMO Cc1ccc(O)c(C[N@H+](C)[C@@H]2CCC[C@H](C)C2)c1 ZINC000132726843 591733710 /nfs/dbraw/zinc/73/37/10/591733710.db2.gz AGJHCZUNWYBKDG-SWLSCSKDSA-N 1 1 247.382 3.711 20 10 BHCDMO Cc1ccc(O)c(C[N@H+](C)[C@H]2CCC[C@H](C)C2)c1 ZINC000132727062 591733813 /nfs/dbraw/zinc/73/38/13/591733813.db2.gz AGJHCZUNWYBKDG-WFASDCNBSA-N 1 1 247.382 3.711 20 10 BHCDMO CCC(C)(C)[N@@H+](C)Cc1cc(Cl)ccc1O ZINC000132738244 591734434 /nfs/dbraw/zinc/73/44/34/591734434.db2.gz AXQFNSJISMLINH-UHFFFAOYSA-N 1 1 241.762 3.666 20 10 BHCDMO Oc1ccccc1C[N@H+]1CCC[C@@H]1C1CCCC1 ZINC000132819207 591739742 /nfs/dbraw/zinc/73/97/42/591739742.db2.gz IEGFCOGNBZQURG-OAHLLOKOSA-N 1 1 245.366 3.547 20 10 BHCDMO Oc1ccccc1C[N@H+]1CCC[C@H]1C1CCCC1 ZINC000132819399 591740008 /nfs/dbraw/zinc/74/00/08/591740008.db2.gz IEGFCOGNBZQURG-HNNXBMFYSA-N 1 1 245.366 3.547 20 10 BHCDMO CCC(CC)C[N@@H+](CC)Cc1ccccc1O ZINC000132924394 712639289 /nfs/dbraw/zinc/63/92/89/712639289.db2.gz KKHMCNFIXKSLEB-UHFFFAOYSA-N 1 1 235.371 3.650 20 10 BHCDMO CCCCC[N@@H+](Cc1ccccc1O)C(C)C ZINC000133248722 712642322 /nfs/dbraw/zinc/64/23/22/712642322.db2.gz POBHQTCTLVQAOP-UHFFFAOYSA-N 1 1 235.371 3.793 20 10 BHCDMO Cc1ccc(O)c(C[N@H+](C)C2CCC(C)CC2)c1 ZINC000133497519 591805180 /nfs/dbraw/zinc/80/51/80/591805180.db2.gz USIYFHPPSRVKSB-UHFFFAOYSA-N 1 1 247.382 3.711 20 10 BHCDMO Cc1ccc(O)c(C[N@H+](CC(C)C)C(C)C)c1 ZINC000133511695 591809899 /nfs/dbraw/zinc/80/98/99/591809899.db2.gz XCRGOASHLJTBJN-UHFFFAOYSA-N 1 1 235.371 3.567 20 10 BHCDMO CCC1CCC([N@@H+](C)Cc2ccccc2O)CC1 ZINC000133528520 591819974 /nfs/dbraw/zinc/81/99/74/591819974.db2.gz NDXRLDAVXCRZMW-UHFFFAOYSA-N 1 1 247.382 3.793 20 10 BHCDMO Cc1ccc(O)c(C[N@@H+](C)CC2CCCCC2)c1 ZINC000133565911 591828504 /nfs/dbraw/zinc/82/85/04/591828504.db2.gz SQJGENVPUAWTNS-UHFFFAOYSA-N 1 1 247.382 3.713 20 10 BHCDMO CC[C@@H]1CCCCC[N@H+]1Cc1ccccc1O ZINC000135652680 592030334 /nfs/dbraw/zinc/03/03/34/592030334.db2.gz KBOQWYLGYYVORY-CQSZACIVSA-N 1 1 233.355 3.547 20 10 BHCDMO CC[C@H]1CCCCC[N@H+]1Cc1ccccc1O ZINC000135652701 592029980 /nfs/dbraw/zinc/02/99/80/592029980.db2.gz KBOQWYLGYYVORY-AWEZNQCLSA-N 1 1 233.355 3.547 20 10 BHCDMO CC(C)C[N@@H+](Cc1ccc(N(C)C)cc1)C(C)C ZINC000147694497 711018788 /nfs/dbraw/zinc/01/87/88/711018788.db2.gz CFPPCUFUFFDJCY-UHFFFAOYSA-N 1 1 248.414 3.619 20 10 BHCDMO Oc1ccccc1C[N@@H+](CC1CC1)C1CCCC1 ZINC000156382680 640443277 /nfs/dbraw/zinc/44/32/77/640443277.db2.gz WAAQCAOQCAHKQR-UHFFFAOYSA-N 1 1 245.366 3.547 20 10 BHCDMO CC[C@H](Nc1cc(C)cc[nH+]1)c1ccccc1O ZINC000157088377 385486531 /nfs/dbraw/zinc/48/65/31/385486531.db2.gz GZEBSNSMPMTIOJ-ZDUSSCGKSA-N 1 1 242.322 3.659 20 10 BHCDMO CC[C@@H](Nc1cc(C)cc[nH+]1)c1ccccc1O ZINC000157088523 170915272 /nfs/dbraw/zinc/91/52/72/170915272.db2.gz GZEBSNSMPMTIOJ-CYBMUJFWSA-N 1 1 242.322 3.659 20 10 BHCDMO CCC[C@@H]1CCCC[N@H+]1Cc1cccc(C)c1O ZINC000160254955 711806135 /nfs/dbraw/zinc/80/61/35/711806135.db2.gz KAYRSTPRAPTLFD-OAHLLOKOSA-N 1 1 247.382 3.855 20 10 BHCDMO CCC[C@H]1CCCC[N@H+]1Cc1cccc(C)c1O ZINC000160255079 711459177 /nfs/dbraw/zinc/45/91/77/711459177.db2.gz KAYRSTPRAPTLFD-HNNXBMFYSA-N 1 1 247.382 3.855 20 10 BHCDMO Cc1ccc(O)c(C[N@H+]2CC[C@H](C(C)(C)C)C2)c1 ZINC000163858080 640424016 /nfs/dbraw/zinc/42/40/16/640424016.db2.gz JYTJUHULASVMBW-AWEZNQCLSA-N 1 1 247.382 3.569 20 10 BHCDMO Cc1ccc(O)c(C[N@H+]2CC[C@@H](C(C)(C)C)C2)c1 ZINC000163858217 633064513 /nfs/dbraw/zinc/06/45/13/633064513.db2.gz JYTJUHULASVMBW-CQSZACIVSA-N 1 1 247.382 3.569 20 10 BHCDMO Cc1cccc(C[N@H+]2CC[C@H](C(C)(C)C)C2)c1O ZINC000163864501 633064463 /nfs/dbraw/zinc/06/44/63/633064463.db2.gz JKSIEDZZZULCJM-AWEZNQCLSA-N 1 1 247.382 3.569 20 10 BHCDMO Cc1cccc(C[N@H+]2CC[C@@H](C(C)(C)C)C2)c1O ZINC000163864608 640425336 /nfs/dbraw/zinc/42/53/36/640425336.db2.gz JKSIEDZZZULCJM-CQSZACIVSA-N 1 1 247.382 3.569 20 10 BHCDMO Cc1cccc(C[N@H+]2C[C@H](C)C[C@H](C)[C@@H]2C)c1O ZINC000168237409 711831748 /nfs/dbraw/zinc/83/17/48/711831748.db2.gz HDJBVJKRBALACM-XBFCOCLRSA-N 1 1 247.382 3.567 20 10 BHCDMO C[C@H]([NH2+]CCC(C)(C)C)c1ccc(F)cc1O ZINC000168738820 633147678 /nfs/dbraw/zinc/14/76/78/633147678.db2.gz NSCBEJYEBLVSMV-JTQLQIEISA-N 1 1 239.334 3.618 20 10 BHCDMO C[C@@H]([NH2+]CCC(C)(C)C)c1ccc(F)cc1O ZINC000168738912 633147529 /nfs/dbraw/zinc/14/75/29/633147529.db2.gz NSCBEJYEBLVSMV-SNVBAGLBSA-N 1 1 239.334 3.618 20 10 BHCDMO CCC(CC)C[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000168761231 640824003 /nfs/dbraw/zinc/82/40/03/640824003.db2.gz XMHJLUCCCYJJLB-JTQLQIEISA-N 1 1 239.334 3.618 20 10 BHCDMO CCC(CC)C[NH2+][C@H](C)c1ccc(F)cc1O ZINC000168761312 640823572 /nfs/dbraw/zinc/82/35/72/640823572.db2.gz XMHJLUCCCYJJLB-SNVBAGLBSA-N 1 1 239.334 3.618 20 10 BHCDMO C[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1O)C(C)(C)C ZINC000168767554 633146393 /nfs/dbraw/zinc/14/63/93/633146393.db2.gz ICZJAFAUVRMEJE-VHSXEESVSA-N 1 1 239.334 3.617 20 10 BHCDMO C[C@@H]([NH2+][C@H](C)C(C)(C)C)c1ccc(F)cc1O ZINC000168767651 633148015 /nfs/dbraw/zinc/14/80/15/633148015.db2.gz ICZJAFAUVRMEJE-NXEZZACHSA-N 1 1 239.334 3.617 20 10 BHCDMO C[N@@H+](Cc1c(O)ccc2ccccc21)C1CCC1 ZINC000172963943 384642133 /nfs/dbraw/zinc/64/21/33/384642133.db2.gz LZTHWYQOFDCPIV-UHFFFAOYSA-N 1 1 241.334 3.530 20 10 BHCDMO C[C@@H]1C[C@@H]2CCCC[C@@H]2[N@H+]1Cc1ccccc1O ZINC000179574743 642725734 /nfs/dbraw/zinc/72/57/34/642725734.db2.gz XUEVHEJGLUIQDD-IPYPFGDCSA-N 1 1 245.366 3.545 20 10 BHCDMO C[C@@H]1C[C@H]2CCCC[C@@H]2[N@H+]1Cc1ccccc1O ZINC000179574766 632745626 /nfs/dbraw/zinc/74/56/26/632745626.db2.gz XUEVHEJGLUIQDD-NFAWXSAZSA-N 1 1 245.366 3.545 20 10 BHCDMO Oc1ccccc1C[N@H+]1CCC2(C1)CCCCC2 ZINC000179580037 642728888 /nfs/dbraw/zinc/72/88/88/642728888.db2.gz YJSOXPQTSQNPLC-UHFFFAOYSA-N 1 1 245.366 3.548 20 10 BHCDMO Cc1cccc(C[N@@H+](C2CC2)C2CCCC2)c1O ZINC000179679533 642738143 /nfs/dbraw/zinc/73/81/43/642738143.db2.gz JUQUQHASCSLISB-UHFFFAOYSA-N 1 1 245.366 3.608 20 10 BHCDMO Cc1cc[nH+]c(N[C@H](C)c2cc(C)ccc2O)c1 ZINC000186242701 384828919 /nfs/dbraw/zinc/82/89/19/384828919.db2.gz HWILREAWAAZYDJ-GFCCVEGCSA-N 1 1 242.322 3.577 20 10 BHCDMO Cc1cc[nH+]c(N[C@@H](C)c2cc(C)ccc2O)c1 ZINC000186242714 384827782 /nfs/dbraw/zinc/82/77/82/384827782.db2.gz HWILREAWAAZYDJ-LBPRGKRZSA-N 1 1 242.322 3.577 20 10 BHCDMO Cc1ccc([C@@H](C)Nc2cc(C)cc[nH+]2)c(O)c1 ZINC000186242900 384829373 /nfs/dbraw/zinc/82/93/73/384829373.db2.gz BHNWHUMDBXEKFK-GFCCVEGCSA-N 1 1 242.322 3.577 20 10 BHCDMO Cc1ccc([C@H](C)Nc2cc(C)cc[nH+]2)c(O)c1 ZINC000186242916 384827456 /nfs/dbraw/zinc/82/74/56/384827456.db2.gz BHNWHUMDBXEKFK-LBPRGKRZSA-N 1 1 242.322 3.577 20 10 BHCDMO CCC(C)(C)C[NH2+][C@@H](C)c1ccc(F)cc1O ZINC000189992331 641829561 /nfs/dbraw/zinc/82/95/61/641829561.db2.gz WVCIEHWAHBJBDD-JTQLQIEISA-N 1 1 239.334 3.618 20 10 BHCDMO CCC(C)(C)C[NH2+][C@H](C)c1ccc(F)cc1O ZINC000189992347 641828804 /nfs/dbraw/zinc/82/88/04/641828804.db2.gz WVCIEHWAHBJBDD-SNVBAGLBSA-N 1 1 239.334 3.618 20 10 BHCDMO CCC[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1O ZINC000192588969 644166553 /nfs/dbraw/zinc/16/65/53/644166553.db2.gz YIAQGUOBKOXZRI-ZETCQYMHSA-N 1 1 248.153 3.760 20 10 BHCDMO CCC[NH2+][C@H](C)c1cc(Cl)c(Cl)cc1O ZINC000192588987 644166542 /nfs/dbraw/zinc/16/65/42/644166542.db2.gz YIAQGUOBKOXZRI-SSDOTTSWSA-N 1 1 248.153 3.760 20 10 BHCDMO C[C@H]([NH2+]C1CC1)c1cc(Cl)c(Cl)cc1O ZINC000192589980 386972083 /nfs/dbraw/zinc/97/20/83/386972083.db2.gz BGFDCWLNUBXMBH-LURJTMIESA-N 1 1 246.137 3.512 20 10 BHCDMO C[C@@H]([NH2+]C1CC1)c1cc(Cl)c(Cl)cc1O ZINC000192589995 386970655 /nfs/dbraw/zinc/97/06/55/386970655.db2.gz BGFDCWLNUBXMBH-ZCFIWIBFSA-N 1 1 246.137 3.512 20 10 BHCDMO CC[N@@H+](Cc1c(O)ccc2ccccc21)C1CC1 ZINC000192992474 644204568 /nfs/dbraw/zinc/20/45/68/644204568.db2.gz VISIBFNMGPAXBC-UHFFFAOYSA-N 1 1 241.334 3.530 20 10 BHCDMO CC(C)[C@@H]1CCC[N@@H+](Cc2ccccc2O)CC1 ZINC000211434454 645837734 /nfs/dbraw/zinc/83/77/34/645837734.db2.gz RARYUPKMGYVPIY-CQSZACIVSA-N 1 1 247.382 3.650 20 10 BHCDMO CC(C)[C@H]1CCC[N@@H+](Cc2ccccc2O)CC1 ZINC000211434515 645837819 /nfs/dbraw/zinc/83/78/19/645837819.db2.gz RARYUPKMGYVPIY-AWEZNQCLSA-N 1 1 247.382 3.650 20 10 BHCDMO CCC1(CC)CC[N@@H+](Cc2cc(C)ccc2O)C1 ZINC000211597470 591203044 /nfs/dbraw/zinc/20/30/44/591203044.db2.gz BSXPUVYBQVDNBV-UHFFFAOYSA-N 1 1 247.382 3.713 20 10 BHCDMO C[N@@H+](Cc1ccccc1O)C1CCC(C)(C)CC1 ZINC000211702229 591248935 /nfs/dbraw/zinc/24/89/35/591248935.db2.gz DCOJGBZHWVDCMS-UHFFFAOYSA-N 1 1 247.382 3.793 20 10 BHCDMO CCC[C@@H]1CCCC[N@H+]1Cc1ccccc1O ZINC000213699613 591490289 /nfs/dbraw/zinc/49/02/89/591490289.db2.gz SAQIMLAYKMDHKG-CQSZACIVSA-N 1 1 233.355 3.547 20 10 BHCDMO CCC[C@H]1CCCC[N@H+]1Cc1ccccc1O ZINC000213699675 591489975 /nfs/dbraw/zinc/48/99/75/591489975.db2.gz SAQIMLAYKMDHKG-AWEZNQCLSA-N 1 1 233.355 3.547 20 10 BHCDMO Cc1ccc(O)c(C[N@H+](C)[C@@H]2CCC[C@@H](C)C2)c1 ZINC000217800453 592149034 /nfs/dbraw/zinc/14/90/34/592149034.db2.gz AGJHCZUNWYBKDG-IUODEOHRSA-N 1 1 247.382 3.711 20 10 BHCDMO Cc1ccc(O)c(C[N@H+](C)[C@H]2CCC[C@@H](C)C2)c1 ZINC000217800528 592148939 /nfs/dbraw/zinc/14/89/39/592148939.db2.gz AGJHCZUNWYBKDG-DOMZBBRYSA-N 1 1 247.382 3.711 20 10 BHCDMO Cc1cccc(C[N@H+]2C[C@H](C)C[C@@H](C)[C@H]2C)c1O ZINC000229553748 640966870 /nfs/dbraw/zinc/96/68/70/640966870.db2.gz HDJBVJKRBALACM-MRVWCRGKSA-N 1 1 247.382 3.567 20 10 BHCDMO Cc1cccc(C[N@H+]2C[C@H](C)C[C@H](C)[C@H]2C)c1O ZINC000229553768 640966556 /nfs/dbraw/zinc/96/65/56/640966556.db2.gz HDJBVJKRBALACM-KWCYVHTRSA-N 1 1 247.382 3.567 20 10 BHCDMO Cc1cccc(C[N@H+]2C[C@H](C)C[C@@H](C)[C@@H]2C)c1O ZINC000230328427 641047526 /nfs/dbraw/zinc/04/75/26/641047526.db2.gz HDJBVJKRBALACM-BNOWGMLFSA-N 1 1 247.382 3.567 20 10 BHCDMO C[C@@H]1CCC[C@@H](C[NH2+]c2ccc(N)cc2)C1 ZINC000235338395 635573725 /nfs/dbraw/zinc/57/37/25/635573725.db2.gz SREWSRWPVGSSQP-VXGBXAGGSA-N 1 1 218.344 3.507 20 10 BHCDMO C[C@H]1CCC[C@H](C[NH2+]c2ccc(N)cc2)C1 ZINC000235653361 632808156 /nfs/dbraw/zinc/80/81/56/632808156.db2.gz SREWSRWPVGSSQP-RYUDHWBXSA-N 1 1 218.344 3.507 20 10 BHCDMO C[C@@H]1C[C@H]2CCCC[C@H]2[N@H+]1Cc1ccccc1O ZINC000245638559 644534674 /nfs/dbraw/zinc/53/46/74/644534674.db2.gz XUEVHEJGLUIQDD-UMVBOHGHSA-N 1 1 245.366 3.545 20 10 BHCDMO C[C@@H]1C[C@@H]2CCCC[C@H]2[N@H+]1Cc1ccccc1O ZINC000245638569 644533698 /nfs/dbraw/zinc/53/36/98/644533698.db2.gz XUEVHEJGLUIQDD-VNHYZAJKSA-N 1 1 245.366 3.545 20 10 BHCDMO CC[C@H](C)[C@H](C)[NH2+][C@H](C)c1ccc(F)cc1O ZINC000246163068 644568649 /nfs/dbraw/zinc/56/86/49/644568649.db2.gz ASRMAMHLNZURTG-GARJFASQSA-N 1 1 239.334 3.617 20 10 BHCDMO CC[C@H](C)[C@@H](C)[NH2+][C@H](C)c1ccc(F)cc1O ZINC000246163078 644568389 /nfs/dbraw/zinc/56/83/89/644568389.db2.gz ASRMAMHLNZURTG-HBNTYKKESA-N 1 1 239.334 3.617 20 10 BHCDMO C[C@H](c1ccccc1)[N@@H+](C)Cc1ccccc1O ZINC000268287903 177039221 /nfs/dbraw/zinc/03/92/21/177039221.db2.gz MKSXVHOYEWSFQR-CYBMUJFWSA-N 1 1 241.334 3.585 20 10 BHCDMO C[C@@H](c1ccccc1)[N@@H+](C)Cc1ccccc1O ZINC000268287905 176020409 /nfs/dbraw/zinc/02/04/09/176020409.db2.gz MKSXVHOYEWSFQR-ZDUSSCGKSA-N 1 1 241.334 3.585 20 10 BHCDMO CC[C@@H]([NH2+]C1(CC)CC1)c1ccc(F)cc1O ZINC000296466152 386177105 /nfs/dbraw/zinc/17/71/05/386177105.db2.gz NNSSEUJBUZAWNH-GFCCVEGCSA-N 1 1 237.318 3.515 20 10 BHCDMO CC[C@H]([NH2+]C1(CC)CC1)c1ccc(F)cc1O ZINC000296466159 386176283 /nfs/dbraw/zinc/17/62/83/386176283.db2.gz NNSSEUJBUZAWNH-LBPRGKRZSA-N 1 1 237.318 3.515 20 10 BHCDMO C[C@@H]1CCC[C@H](C[NH2+]c2ccc(N)cc2)C1 ZINC000300363171 592508574 /nfs/dbraw/zinc/50/85/74/592508574.db2.gz SREWSRWPVGSSQP-NEPJUHHUSA-N 1 1 218.344 3.507 20 10 BHCDMO C[N@@H+](CCCC(C)(C)C)c1ccc(N)cc1 ZINC000300823403 592521028 /nfs/dbraw/zinc/52/10/28/592521028.db2.gz HJUQWRHZNPNJTN-UHFFFAOYSA-N 1 1 220.360 3.531 20 10 BHCDMO C[N@H+](CCCC(C)(C)C)c1ccc(N)cc1 ZINC000300823403 592521024 /nfs/dbraw/zinc/52/10/24/592521024.db2.gz HJUQWRHZNPNJTN-UHFFFAOYSA-N 1 1 220.360 3.531 20 10 BHCDMO Cc1ccc(O)c(C[N@@H+]2CC[C@@H](CC(C)C)C2)c1 ZINC000307769551 643647410 /nfs/dbraw/zinc/64/74/10/643647410.db2.gz DQRFAGCWJYVJHR-AWEZNQCLSA-N 1 1 247.382 3.569 20 10 BHCDMO Cc1ccc(O)c(C[N@@H+]2CC[C@H](CC(C)C)C2)c1 ZINC000307769554 643646101 /nfs/dbraw/zinc/64/61/01/643646101.db2.gz DQRFAGCWJYVJHR-CQSZACIVSA-N 1 1 247.382 3.569 20 10 BHCDMO CCC[N@H+](Cc1cc(C)ccc1O)CC(C)C ZINC000310137816 635194614 /nfs/dbraw/zinc/19/46/14/635194614.db2.gz ZXYFHSMIAIGMKB-UHFFFAOYSA-N 1 1 235.371 3.569 20 10 BHCDMO CCCC[C@@H](C)[N@@H+](C)Cc1cccc(C)c1O ZINC000310340044 632723178 /nfs/dbraw/zinc/72/31/78/632723178.db2.gz DRFAOXHSWYDETC-CYBMUJFWSA-N 1 1 235.371 3.711 20 10 BHCDMO CCCC[C@H](C)[N@@H+](C)Cc1cccc(C)c1O ZINC000310340046 632722785 /nfs/dbraw/zinc/72/27/85/632722785.db2.gz DRFAOXHSWYDETC-ZDUSSCGKSA-N 1 1 235.371 3.711 20 10 BHCDMO CC[N@@H+](Cc1cc(C)ccc1O)CC(C)(C)C ZINC000310350369 632725526 /nfs/dbraw/zinc/72/55/26/632725526.db2.gz GZQQYDPQUGEKDH-UHFFFAOYSA-N 1 1 235.371 3.569 20 10 BHCDMO C[C@@H]([NH2+]CC1=CCCCC1)c1ccc(F)cc1O ZINC000379585830 712389384 /nfs/dbraw/zinc/38/93/84/712389384.db2.gz ZQCDIWWNOJJHJK-LLVKDONJSA-N 1 1 249.329 3.682 20 10 BHCDMO C[C@H]([NH2+]CC1=CCCCC1)c1ccc(F)cc1O ZINC000379585831 712389266 /nfs/dbraw/zinc/38/92/66/712389266.db2.gz ZQCDIWWNOJJHJK-NSHDSACASA-N 1 1 249.329 3.682 20 10 BHCDMO CCCC[C@@H](C)[N@@H+](C)Cc1cc(F)ccc1O ZINC000380174632 712705824 /nfs/dbraw/zinc/70/58/24/712705824.db2.gz XMXUSZCPPYRNNK-LLVKDONJSA-N 1 1 239.334 3.542 20 10 BHCDMO CCCC[C@H](C)[N@@H+](C)Cc1cc(F)ccc1O ZINC000380174641 712705851 /nfs/dbraw/zinc/70/58/51/712705851.db2.gz XMXUSZCPPYRNNK-NSHDSACASA-N 1 1 239.334 3.542 20 10 BHCDMO CCCC[C@@H](C)[N@@H+](C)Cc1cc(C)ccc1O ZINC000383569610 710983100 /nfs/dbraw/zinc/98/31/00/710983100.db2.gz BZTQRUNTJRQLNG-CYBMUJFWSA-N 1 1 235.371 3.711 20 10 BHCDMO CCCC[C@H](C)[N@@H+](C)Cc1cc(C)ccc1O ZINC000383569611 710982909 /nfs/dbraw/zinc/98/29/09/710982909.db2.gz BZTQRUNTJRQLNG-ZDUSSCGKSA-N 1 1 235.371 3.711 20 10 BHCDMO CC[N@@H+](Cc1cccc(C)c1O)CC(C)(C)C ZINC000383841536 710951958 /nfs/dbraw/zinc/95/19/58/710951958.db2.gz ZLMBHNUQHVYAQX-UHFFFAOYSA-N 1 1 235.371 3.569 20 10 BHCDMO Nc1ccc([NH2+]CC2CCCCCC2)cc1 ZINC000389515112 711080089 /nfs/dbraw/zinc/08/00/89/711080089.db2.gz ARSOLCOGLJPVEE-UHFFFAOYSA-N 1 1 218.344 3.651 20 10 BHCDMO CCC(CC)(CC)C[NH2+]c1ccc(N)cc1 ZINC000391200748 711137305 /nfs/dbraw/zinc/13/73/05/711137305.db2.gz XEAXRKQHFXWHPH-UHFFFAOYSA-N 1 1 220.360 3.897 20 10 BHCDMO C[C@H]([NH2+][C@H]1CC12CCCC2)c1ccc(F)cc1O ZINC000395656979 711214393 /nfs/dbraw/zinc/21/43/93/711214393.db2.gz WAMCUYWICACBNY-HZMBPMFUSA-N 1 1 249.329 3.515 20 10 BHCDMO C[C@H]([NH2+][C@@H]1CC12CCCC2)c1ccc(F)cc1O ZINC000395656981 711214061 /nfs/dbraw/zinc/21/40/61/711214061.db2.gz WAMCUYWICACBNY-IINYFYTJSA-N 1 1 249.329 3.515 20 10 BHCDMO C[C@@H]([NH2+][C@@H]1CC12CCCC2)c1ccc(F)cc1O ZINC000395656983 711214764 /nfs/dbraw/zinc/21/47/64/711214764.db2.gz WAMCUYWICACBNY-QMTHXVAHSA-N 1 1 249.329 3.515 20 10 BHCDMO C[C@@H]([NH2+][C@H]1CC12CCCC2)c1ccc(F)cc1O ZINC000395656990 711214713 /nfs/dbraw/zinc/21/47/13/711214713.db2.gz WAMCUYWICACBNY-YGRLFVJLSA-N 1 1 249.329 3.515 20 10 BHCDMO Cc1cccc(C[N@@H+]2CCCC[C@H]2C(C)C)c1O ZINC000395765150 711215797 /nfs/dbraw/zinc/21/57/97/711215797.db2.gz OSRPWTWNVDHJIB-HNNXBMFYSA-N 1 1 247.382 3.711 20 10 BHCDMO Cc1cccc(C[N@@H+]2CCCC[C@@H]2C(C)C)c1O ZINC000395765151 711216152 /nfs/dbraw/zinc/21/61/52/711216152.db2.gz OSRPWTWNVDHJIB-OAHLLOKOSA-N 1 1 247.382 3.711 20 10 BHCDMO Cc1ccc(O)c(C[N@@H+]2CCCC[C@H]2C(C)C)c1 ZINC000395768059 711216285 /nfs/dbraw/zinc/21/62/85/711216285.db2.gz RAFJKPYYYIFABX-HNNXBMFYSA-N 1 1 247.382 3.711 20 10 BHCDMO Cc1ccc(O)c(C[N@@H+]2CCCC[C@@H]2C(C)C)c1 ZINC000395768060 711215918 /nfs/dbraw/zinc/21/59/18/711215918.db2.gz RAFJKPYYYIFABX-OAHLLOKOSA-N 1 1 247.382 3.711 20 10 BHCDMO Cc1ccc(O)c(C[N@@H+]2CCC[C@H]2CC(C)C)c1 ZINC000396917649 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ZINC000706956872 712163615 /nfs/dbraw/zinc/16/36/15/712163615.db2.gz NVMYILSDMRHFJT-HZMBPMFUSA-N 1 1 249.329 3.515 20 10 BHCDMO C[C@H]([NH2+][C@@H]1CCCC12CC2)c1ccc(F)cc1O ZINC000706956877 712163541 /nfs/dbraw/zinc/16/35/41/712163541.db2.gz NVMYILSDMRHFJT-IINYFYTJSA-N 1 1 249.329 3.515 20 10 BHCDMO C[C@@H]([NH2+][C@@H]1CCCC12CC2)c1ccc(F)cc1O ZINC000706956881 712163530 /nfs/dbraw/zinc/16/35/30/712163530.db2.gz NVMYILSDMRHFJT-QMTHXVAHSA-N 1 1 249.329 3.515 20 10 BHCDMO C[C@@H]([NH2+][C@H]1CCCC12CC2)c1ccc(F)cc1O ZINC000706956886 712163668 /nfs/dbraw/zinc/16/36/68/712163668.db2.gz NVMYILSDMRHFJT-YGRLFVJLSA-N 1 1 249.329 3.515 20 10 BHCDMO CC(C)(C)[C@H]1CCC[N@@H+](Cc2ccccc2O)C1 ZINC000708450747 712195074 /nfs/dbraw/zinc/19/50/74/712195074.db2.gz ZXBRFMVWXKKTNH-AWEZNQCLSA-N 1 1 247.382 3.650 20 10 BHCDMO CC(C)(C)[C@@H]1CCC[N@@H+](Cc2ccccc2O)C1 ZINC000708450748 712194807 /nfs/dbraw/zinc/19/48/07/712194807.db2.gz ZXBRFMVWXKKTNH-CQSZACIVSA-N 1 1 247.382 3.650 20 10 BHCDMO CCC[C@H]1CCC[N@@H+](Cc2cccc(C)c2O)C1 ZINC000708466250 712194860 /nfs/dbraw/zinc/19/48/60/712194860.db2.gz GPFQDLHIYREKKX-AWEZNQCLSA-N 1 1 247.382 3.713 20 10 BHCDMO CCC[C@@H]1CCC[N@@H+](Cc2cccc(C)c2O)C1 ZINC000708466251 712194834 /nfs/dbraw/zinc/19/48/34/712194834.db2.gz GPFQDLHIYREKKX-CQSZACIVSA-N 1 1 247.382 3.713 20 10 BHCDMO CCC(C)(C)CC[N@@H+](C)c1ccc(N)cc1 ZINC000711273053 712292515 /nfs/dbraw/zinc/29/25/15/712292515.db2.gz BKWPXHFYZMUKDZ-UHFFFAOYSA-N 1 1 220.360 3.531 20 10 BHCDMO CCC(C)(C)CC[N@H+](C)c1ccc(N)cc1 ZINC000711273053 712292514 /nfs/dbraw/zinc/29/25/14/712292514.db2.gz BKWPXHFYZMUKDZ-UHFFFAOYSA-N 1 1 220.360 3.531 20 10 BHCDMO Cc1cc(O)c(C[N@H+]2CC[C@@H](C)C2)cc1C(C)C ZINC000725780267 582849386 /nfs/dbraw/zinc/84/93/86/582849386.db2.gz XGQSZICNVXHHKT-GFCCVEGCSA-N 1 1 247.382 3.666 20 10 BHCDMO Cc1cc(O)c(C[N@H+]2CC[C@H](C)C2)cc1C(C)C ZINC000725780268 582849376 /nfs/dbraw/zinc/84/93/76/582849376.db2.gz XGQSZICNVXHHKT-LBPRGKRZSA-N 1 1 247.382 3.666 20 10 BHCDMO CCC[N@@H+](CCC(C)C)Cc1ccccc1O ZINC000727830805 583781774 /nfs/dbraw/zinc/78/17/74/583781774.db2.gz PDXVGHZHWODEQC-UHFFFAOYSA-N 1 1 235.371 3.650 20 10 BHCDMO CCC[N@H+](Cc1ccccc1O)CC1CCCC1 ZINC000727830819 583781785 /nfs/dbraw/zinc/78/17/85/583781785.db2.gz PSYDKDSGGGJXQZ-UHFFFAOYSA-N 1 1 247.382 3.794 20 10 BHCDMO CCC[N@@H+](CC=C(C)C)Cc1ccccc1O ZINC000727831121 583781841 /nfs/dbraw/zinc/78/18/41/583781841.db2.gz JEEKYDLGMBEKQH-UHFFFAOYSA-N 1 1 233.355 3.570 20 10 BHCDMO CCCC[N@@H+](Cc1ccccc1O)C1CCCC1 ZINC000731848102 584929502 /nfs/dbraw/zinc/92/95/02/584929502.db2.gz RUENKMKNSILNHW-UHFFFAOYSA-N 1 1 247.382 3.937 20 10 BHCDMO Cc1cc(O)c(C[N@H+]2CCCC(C)(C)C2)cc1C ZINC000732981766 584942242 /nfs/dbraw/zinc/94/22/42/584942242.db2.gz VZJMGWAMHNNKCM-UHFFFAOYSA-N 1 1 247.382 3.631 20 10 BHCDMO Cc1cc(O)c(C[N@@H+]2CCCCC[C@@H]2C)cc1C ZINC000738222627 639290620 /nfs/dbraw/zinc/29/06/20/639290620.db2.gz FQWXNXAQDAGARE-AWEZNQCLSA-N 1 1 247.382 3.774 20 10 BHCDMO Cc1cc(O)c(C[N@@H+]2CCCCC[C@H]2C)cc1C ZINC000738222628 639289914 /nfs/dbraw/zinc/28/99/14/639289914.db2.gz FQWXNXAQDAGARE-CQSZACIVSA-N 1 1 247.382 3.774 20 10 BHCDMO CCN(C)c1ccc(C[N@H+]2CCCC[C@@H]2C)cc1 ZINC000741752958 585117662 /nfs/dbraw/zinc/11/76/62/585117662.db2.gz KPAVAUMSVJNIQC-AWEZNQCLSA-N 1 1 246.398 3.517 20 10 BHCDMO CCN(C)c1ccc(C[N@H+]2CCCC[C@H]2C)cc1 ZINC000741752959 585117529 /nfs/dbraw/zinc/11/75/29/585117529.db2.gz KPAVAUMSVJNIQC-CQSZACIVSA-N 1 1 246.398 3.517 20 10 BHCDMO Cc1cc(O)c(C[N@@H+](C)C2CCC2)cc1C(C)C ZINC000742169177 585122447 /nfs/dbraw/zinc/12/24/47/585122447.db2.gz BQESVHJEYDRQIA-UHFFFAOYSA-N 1 1 247.382 3.808 20 10 BHCDMO CC[N@@H+](Cc1cc(C)c(C)cc1O)[C@H](C)C(C)C ZINC000742556550 585128022 /nfs/dbraw/zinc/12/80/22/585128022.db2.gz JXTZPMZHTYBNLZ-CQSZACIVSA-N 1 1 249.398 3.875 20 10 BHCDMO Cc1cc(O)c(C[N@H+](C)CC(C)C)cc1C(C)C ZINC000744151516 585144578 /nfs/dbraw/zinc/14/45/78/585144578.db2.gz JDVRARNSWWHQNS-UHFFFAOYSA-N 1 1 249.398 3.912 20 10 BHCDMO C[N@@H+](CCC1CCCCC1)Cc1ccccc1O ZINC000744402059 585149860 /nfs/dbraw/zinc/14/98/60/585149860.db2.gz HUWBDFVQSIXTRJ-UHFFFAOYSA-N 1 1 247.382 3.794 20 10 BHCDMO CC[C@H]1C[C@@H](C)C[N@H+]1Cc1cc(C)c(C)cc1O ZINC000744442676 585150526 /nfs/dbraw/zinc/15/05/26/585150526.db2.gz DUMQZYMAPIBZRG-ABAIWWIYSA-N 1 1 247.382 3.629 20 10 BHCDMO CC[C@@H]1C[C@@H](C)C[N@H+]1Cc1cc(C)c(C)cc1O ZINC000744442678 585150259 /nfs/dbraw/zinc/15/02/59/585150259.db2.gz DUMQZYMAPIBZRG-IAQYHMDHSA-N 1 1 247.382 3.629 20 10 BHCDMO CC[C@H]1C[C@H](C)C[N@H+]1Cc1cc(C)c(C)cc1O ZINC000744442679 585150235 /nfs/dbraw/zinc/15/02/35/585150235.db2.gz DUMQZYMAPIBZRG-NHYWBVRUSA-N 1 1 247.382 3.629 20 10 BHCDMO CC[C@@H]1C[C@H](C)C[N@H+]1Cc1cc(C)c(C)cc1O ZINC000744442680 585150431 /nfs/dbraw/zinc/15/04/31/585150431.db2.gz DUMQZYMAPIBZRG-XHDPSFHLSA-N 1 1 247.382 3.629 20 10 BHCDMO CCC[N@@H+](C)Cc1cc(C)cc(C(C)(C)C)c1O ZINC000746074756 585162961 /nfs/dbraw/zinc/16/29/61/585162961.db2.gz QHDIEAJMODZERQ-UHFFFAOYSA-N 1 1 249.398 3.840 20 10 BHCDMO CCC[N@@H+](C)Cc1cc(C(C)C)c(C)cc1O ZINC000746074967 585162789 /nfs/dbraw/zinc/16/27/89/585162789.db2.gz VJCKRXQVONBGDD-UHFFFAOYSA-N 1 1 235.371 3.666 20 10 BHCDMO CCC[N@H+](Cc1ccc(N(C)C)cc1)CC(C)C ZINC000746138046 585163776 /nfs/dbraw/zinc/16/37/76/585163776.db2.gz VBAPUBUCZSXJQN-UHFFFAOYSA-N 1 1 248.414 3.621 20 10 BHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)C1CCCC1 ZINC000746153943 585163988 /nfs/dbraw/zinc/16/39/88/585163988.db2.gz YKCUBINCQVSQEX-UHFFFAOYSA-N 1 1 246.398 3.517 20 10 BHCDMO CCC[N@@H+](CC(C)C)c1ccc(OC)cc1 ZINC000746169913 585164385 /nfs/dbraw/zinc/16/43/85/585164385.db2.gz FYUJKOADNHAFHV-UHFFFAOYSA-N 1 1 221.344 3.568 20 10 BHCDMO CCC[N@H+](CC(C)C)c1ccc(OC)cc1 ZINC000746169913 585164384 /nfs/dbraw/zinc/16/43/84/585164384.db2.gz FYUJKOADNHAFHV-UHFFFAOYSA-N 1 1 221.344 3.568 20 10 BHCDMO Cc1cc(O)c(C[N@@H+]2CCC[C@@H](C)CC2)cc1C ZINC000748081592 644588712 /nfs/dbraw/zinc/58/87/12/644588712.db2.gz AZPPCQLOZGFVHI-GFCCVEGCSA-N 1 1 247.382 3.631 20 10 BHCDMO Cc1cc(O)c(C[N@@H+]2CCC[C@H](C)CC2)cc1C ZINC000748081602 644588690 /nfs/dbraw/zinc/58/86/90/644588690.db2.gz AZPPCQLOZGFVHI-LBPRGKRZSA-N 1 1 247.382 3.631 20 10 BHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@H]2C)cc1C(C)C ZINC000751926863 583940917 /nfs/dbraw/zinc/94/09/17/583940917.db2.gz XSNWFTWEZYVDJZ-CYBMUJFWSA-N 1 1 247.382 3.808 20 10 BHCDMO Cc1cc(O)c(C[N@H+]2CCC[C@@H]2C)cc1C(C)C ZINC000751926892 583940929 /nfs/dbraw/zinc/94/09/29/583940929.db2.gz XSNWFTWEZYVDJZ-ZDUSSCGKSA-N 1 1 247.382 3.808 20 10 BHCDMO Cc1cc(O)c(C[N@H+](C)[C@H](C)C2(C)CC2)cc1C ZINC000753111365 585253722 /nfs/dbraw/zinc/25/37/22/585253722.db2.gz OUSNBRICSWPICK-CYBMUJFWSA-N 1 1 247.382 3.629 20 10 BHCDMO Cc1cc(O)c(C[N@H+](C)[C@@H](C)C2(C)CC2)cc1C ZINC000753111367 585253950 /nfs/dbraw/zinc/25/39/50/585253950.db2.gz OUSNBRICSWPICK-ZDUSSCGKSA-N 1 1 247.382 3.629 20 10 BHCDMO C[C@H]1CCCC[C@H]1C[N@@H+](C)Cc1ccccc1O ZINC000753534188 585260975 /nfs/dbraw/zinc/26/09/75/585260975.db2.gz FKEKSXMJWBOMQA-KBPBESRZSA-N 1 1 247.382 3.650 20 10 BHCDMO C[C@@H]1CCCC[C@H]1C[N@@H+](C)Cc1ccccc1O ZINC000753534196 585260906 /nfs/dbraw/zinc/26/09/06/585260906.db2.gz FKEKSXMJWBOMQA-KGLIPLIRSA-N 1 1 247.382 3.650 20 10 BHCDMO Cc1cccc(C[N@@H+]2C[C@H](C)CC(C)(C)C2)c1O ZINC000753574322 585262215 /nfs/dbraw/zinc/26/22/15/585262215.db2.gz FJOIXIPALYMBFK-GFCCVEGCSA-N 1 1 247.382 3.569 20 10 BHCDMO Cc1cccc(C[N@@H+]2C[C@@H](C)CC(C)(C)C2)c1O ZINC000753574324 585262252 /nfs/dbraw/zinc/26/22/52/585262252.db2.gz FJOIXIPALYMBFK-LBPRGKRZSA-N 1 1 247.382 3.569 20 10 BHCDMO Cc1cc(C)c(O)c(C[N@@H+]2CCC[C@@H](C)CC2)c1 ZINC000754719343 585290071 /nfs/dbraw/zinc/29/00/71/585290071.db2.gz AIZVFZSEDHTRCX-GFCCVEGCSA-N 1 1 247.382 3.631 20 10 BHCDMO Cc1cc(C)c(O)c(C[N@@H+]2CCC[C@H](C)CC2)c1 ZINC000754719352 585289752 /nfs/dbraw/zinc/28/97/52/585289752.db2.gz AIZVFZSEDHTRCX-LBPRGKRZSA-N 1 1 247.382 3.631 20 10 BHCDMO Cc1cc(C)c(O)c(C[N@@H+](C)CC2CCCC2)c1 ZINC000754720123 584928354 /nfs/dbraw/zinc/92/83/54/584928354.db2.gz KORMPQBCMQUEFQ-UHFFFAOYSA-N 1 1 247.382 3.631 20 10 BHCDMO CCCC[N@@H+](CC)Cc1cc(C)cc(C)c1O ZINC000754722865 585289995 /nfs/dbraw/zinc/28/99/95/585289995.db2.gz FWIOTPLDMXQGJZ-UHFFFAOYSA-N 1 1 235.371 3.631 20 10 BHCDMO Cc1cc(C)c(O)c(C[N@H+](C)[C@H](C)C(C)(C)C)c1 ZINC000754723452 585289838 /nfs/dbraw/zinc/28/98/38/585289838.db2.gz KTKPGGTVAFPJNM-CYBMUJFWSA-N 1 1 249.398 3.875 20 10 BHCDMO Cc1cc(C)c(O)c(C[N@H+](C)[C@@H](C)C(C)(C)C)c1 ZINC000754723453 585289931 /nfs/dbraw/zinc/28/99/31/585289931.db2.gz KTKPGGTVAFPJNM-ZDUSSCGKSA-N 1 1 249.398 3.875 20 10 BHCDMO Cc1cc(C)c(O)c(C[N@@H+]2CCC[C@H]2C(C)C)c1 ZINC000754723743 585290038 /nfs/dbraw/zinc/29/00/38/585290038.db2.gz UDSGFVSHMVZJBX-HNNXBMFYSA-N 1 1 247.382 3.629 20 10 BHCDMO Cc1cc(C)c(O)c(C[N@@H+]2CCC[C@@H]2C(C)C)c1 ZINC000754723747 585289850 /nfs/dbraw/zinc/28/98/50/585289850.db2.gz UDSGFVSHMVZJBX-OAHLLOKOSA-N 1 1 247.382 3.629 20 10 BHCDMO Cc1cc(C)c(O)c(C[N@H+](CC(C)C)C2CC2)c1 ZINC000754724146 585289950 /nfs/dbraw/zinc/28/99/50/585289950.db2.gz PPUJNHVBPOSXRP-UHFFFAOYSA-N 1 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247.382 3.774 20 10 BHCDMO CC[C@H]1C[C@@H](C)C[N@H+]1Cc1cc(C)cc(C)c1O ZINC000754737280 585290315 /nfs/dbraw/zinc/29/03/15/585290315.db2.gz PRVNGCFXQCYVGE-DOMZBBRYSA-N 1 1 247.382 3.629 20 10 BHCDMO CC[C@@H]1C[C@@H](C)C[N@H+]1Cc1cc(C)cc(C)c1O ZINC000754737281 585290195 /nfs/dbraw/zinc/29/01/95/585290195.db2.gz PRVNGCFXQCYVGE-IUODEOHRSA-N 1 1 247.382 3.629 20 10 BHCDMO CC[C@@H]1C[C@H](C)C[N@H+]1Cc1cc(C)cc(C)c1O ZINC000754737282 585290093 /nfs/dbraw/zinc/29/00/93/585290093.db2.gz PRVNGCFXQCYVGE-SWLSCSKDSA-N 1 1 247.382 3.629 20 10 BHCDMO CC[C@H]1C[C@H](C)C[N@H+]1Cc1cc(C)cc(C)c1O ZINC000754737283 585290266 /nfs/dbraw/zinc/29/02/66/585290266.db2.gz PRVNGCFXQCYVGE-WFASDCNBSA-N 1 1 247.382 3.629 20 10 BHCDMO Cc1cc(C)c(O)c(C[N@H+](C)[C@H](C)C2(C)CC2)c1 ZINC000754738367 641815554 /nfs/dbraw/zinc/81/55/54/641815554.db2.gz ACORXAXYAXQNQC-CYBMUJFWSA-N 1 1 247.382 3.629 20 10 BHCDMO Cc1cc(C)c(O)c(C[N@H+](C)[C@@H](C)C2(C)CC2)c1 ZINC000754738371 641815304 /nfs/dbraw/zinc/81/53/04/641815304.db2.gz 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247.382 3.650 20 10 BHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)[C@@H](C)C(C)C ZINC000769151282 585550399 /nfs/dbraw/zinc/55/03/99/585550399.db2.gz FCUAZAHUTPFZKS-AWEZNQCLSA-N 1 1 248.414 3.619 20 10 BHCDMO CC[N@@H+](Cc1ccc(N(C)C)cc1)[C@H](C)C(C)C ZINC000769151285 585550267 /nfs/dbraw/zinc/55/02/67/585550267.db2.gz FCUAZAHUTPFZKS-CQSZACIVSA-N 1 1 248.414 3.619 20 10 BHCDMO Cc1cc(O)c(C[N@@H+]2CCC[C@@H](C)[C@H]2C)cc1C ZINC000769224681 585551286 /nfs/dbraw/zinc/55/12/86/585551286.db2.gz XCRDJJBFLOCJOJ-BXUZGUMPSA-N 1 1 247.382 3.629 20 10 BHCDMO Cc1cc(O)c(C[N@@H+]2CCC[C@H](C)[C@@H]2C)cc1C ZINC000769224686 585551371 /nfs/dbraw/zinc/55/13/71/585551371.db2.gz XCRDJJBFLOCJOJ-FZMZJTMJSA-N 1 1 247.382 3.629 20 10 BHCDMO Cc1cc(O)c(C[N@@H+]2CCC[C@@H](C)[C@@H]2C)cc1C ZINC000769224690 585551140 /nfs/dbraw/zinc/55/11/40/585551140.db2.gz XCRDJJBFLOCJOJ-RISCZKNCSA-N 1 1 247.382 3.629 20 10 BHCDMO Cc1cc(O)c(C[N@@H+]2CCC[C@H](C)[C@H]2C)cc1C ZINC000769224694 585551184 /nfs/dbraw/zinc/55/11/84/585551184.db2.gz XCRDJJBFLOCJOJ-SMDDNHRTSA-N 1 1 247.382 3.629 20 10 BHCDMO Cc1ccc(O)c(C[N@H+]2CCC[C@H]2C(C)(C)C)c1 ZINC000769309868 585553334 /nfs/dbraw/zinc/55/33/34/585553334.db2.gz GRNJSMJZMRUKAQ-HNNXBMFYSA-N 1 1 247.382 3.711 20 10 BHCDMO Cc1ccc(O)c(C[N@H+]2CCC[C@@H]2C(C)(C)C)c1 ZINC000769309869 585553262 /nfs/dbraw/zinc/55/32/62/585553262.db2.gz GRNJSMJZMRUKAQ-OAHLLOKOSA-N 1 1 247.382 3.711 20 10 BHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@@H]2C)cc1 ZINC000769389409 585555256 /nfs/dbraw/zinc/55/52/56/585555256.db2.gz NUKXBJQCUUXVCB-AWEZNQCLSA-N 1 1 246.398 3.517 20 10 BHCDMO CCN(CC)c1ccc(C[N@H+]2CCC[C@H]2C)cc1 ZINC000769389413 585555470 /nfs/dbraw/zinc/55/54/70/585555470.db2.gz NUKXBJQCUUXVCB-CQSZACIVSA-N 1 1 246.398 3.517 20 10 BHCDMO C[C@H]1CCCCC[N@H+]1Cc1ccc(N(C)C)cc1 ZINC000769405280 585555710 /nfs/dbraw/zinc/55/57/10/585555710.db2.gz SYMNYTOXZHIQAN-AWEZNQCLSA-N 1 1 246.398 3.517 20 10 BHCDMO C[C@@H]1CCCCC[N@H+]1Cc1ccc(N(C)C)cc1 ZINC000769405282 585555507 /nfs/dbraw/zinc/55/55/07/585555507.db2.gz 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/nfs/dbraw/zinc/55/69/02/585556902.db2.gz KWUUGEKFDKECMS-UHFFFAOYSA-N 1 1 246.398 3.517 20 10 BHCDMO CC(C)C[C@H]1CCCC[N@H+]1Cc1ccccc1O ZINC000770504483 584979453 /nfs/dbraw/zinc/97/94/53/584979453.db2.gz HLYNIBLTICXKHU-OAHLLOKOSA-N 1 1 247.382 3.793 20 10 BHCDMO CCN(C)c1ccc(C[N@@H+](C(C)C)C2CC2)cc1 ZINC000773731594 585643064 /nfs/dbraw/zinc/64/30/64/585643064.db2.gz VXELPJMRLLDBAZ-UHFFFAOYSA-N 1 1 246.398 3.516 20 10 BHCDMO CCN(C)c1ccc(C[N@@H+](C)C2CCCC2)cc1 ZINC000773733123 585642942 /nfs/dbraw/zinc/64/29/42/585642942.db2.gz GZDHPXNQKIZKRU-UHFFFAOYSA-N 1 1 246.398 3.517 20 10 BHCDMO CCN(C)c1ccc(C[N@@H+](C)[C@@H](C)C(C)C)cc1 ZINC000773734265 585642899 /nfs/dbraw/zinc/64/28/99/585642899.db2.gz OGMULMREVSFLKG-AWEZNQCLSA-N 1 1 248.414 3.619 20 10 BHCDMO CCN(C)c1ccc(C[N@@H+](C)[C@H](C)C(C)C)cc1 ZINC000773734267 585642845 /nfs/dbraw/zinc/64/28/45/585642845.db2.gz OGMULMREVSFLKG-CQSZACIVSA-N 1 1 248.414 3.619 20 10 BHCDMO CCN(C)c1ccc(C[N@H+]2CCCC2(C)C)cc1 ZINC000773746706 585643195 /nfs/dbraw/zinc/64/31/95/585643195.db2.gz BAUKQJBCNDOLMW-UHFFFAOYSA-N 1 1 246.398 3.517 20 10 BHCDMO CC[C@H]1CCC[N@H+]1Cc1ccc(N(C)CC)cc1 ZINC000773747840 585643239 /nfs/dbraw/zinc/64/32/39/585643239.db2.gz JUGKJUXIRSHWLN-HNNXBMFYSA-N 1 1 246.398 3.517 20 10 BHCDMO CC[C@@H]1CCC[N@H+]1Cc1ccc(N(C)CC)cc1 ZINC000773747842 585643230 /nfs/dbraw/zinc/64/32/30/585643230.db2.gz JUGKJUXIRSHWLN-OAHLLOKOSA-N 1 1 246.398 3.517 20 10 BHCDMO CCC[N@@H+](Cc1ccc(N(C)CC)cc1)C1CC1 ZINC000773748582 585643318 /nfs/dbraw/zinc/64/33/18/585643318.db2.gz ONRDQAQIFXYOKC-UHFFFAOYSA-N 1 1 246.398 3.517 20 10 BHCDMO CCN(C)c1ccc(C[N@@H+](CC)C2CCC2)cc1 ZINC000773755003 644696398 /nfs/dbraw/zinc/69/63/98/644696398.db2.gz TUFYPBODTJLIBX-UHFFFAOYSA-N 1 1 246.398 3.517 20 10 BHCDMO CCN(C)c1ccc(C[N@@H+]2[C@H](C)CC[C@@H]2C)cc1 ZINC000773767151 585643721 /nfs/dbraw/zinc/64/37/21/585643721.db2.gz XZYZPEYWVKMCFW-OKILXGFUSA-N 1 1 246.398 3.516 20 10 BHCDMO CCN(C)c1ccc(C[N@@H+](C)C(C)(C)CC)cc1 ZINC000773775325 585643759 /nfs/dbraw/zinc/64/37/59/585643759.db2.gz YXVOSSHQNFHRRU-UHFFFAOYSA-N 1 1 248.414 3.763 20 10 BHCDMO CC[C@H]1[C@H](C)CC[N@H+]1Cc1cc(C)cc(C)c1O ZINC000774619672 585662136 /nfs/dbraw/zinc/66/21/36/585662136.db2.gz QDLIVSNTAOLXON-DOMZBBRYSA-N 1 1 247.382 3.629 20 10 BHCDMO CC[C@@H]1[C@H](C)CC[N@H+]1Cc1cc(C)cc(C)c1O ZINC000774619675 585662173 /nfs/dbraw/zinc/66/21/73/585662173.db2.gz QDLIVSNTAOLXON-IUODEOHRSA-N 1 1 247.382 3.629 20 10 BHCDMO CC[C@@H]1[C@@H](C)CC[N@H+]1Cc1cc(C)cc(C)c1O ZINC000774619676 585662255 /nfs/dbraw/zinc/66/22/55/585662255.db2.gz QDLIVSNTAOLXON-SWLSCSKDSA-N 1 1 247.382 3.629 20 10 BHCDMO CC[C@H]1[C@@H](C)CC[N@H+]1Cc1cc(C)cc(C)c1O ZINC000774619678 585662221 /nfs/dbraw/zinc/66/22/21/585662221.db2.gz QDLIVSNTAOLXON-WFASDCNBSA-N 1 1 247.382 3.629 20 10 BHCDMO CCC[N@@H+](Cc1ccccc1O)CC1(C)CCC1 ZINC000774870671 585668113 /nfs/dbraw/zinc/66/81/13/585668113.db2.gz SLWSCYXEHRMDHP-UHFFFAOYSA-N 1 1 247.382 3.794 20 10 BHCDMO Cc1cccc(C[N@H+](CC2CCC2)C(C)C)c1O ZINC000775175617 644701327 /nfs/dbraw/zinc/70/13/27/644701327.db2.gz GSCKQNXEISURHO-UHFFFAOYSA-N 1 1 247.382 3.711 20 10 BHCDMO Cc1ccc(O)c(C[N@H+](CC2CCC2)C(C)C)c1 ZINC000775179421 585673094 /nfs/dbraw/zinc/67/30/94/585673094.db2.gz ZXNGFVKZIIYBPK-UHFFFAOYSA-N 1 1 247.382 3.711 20 10 BHCDMO C[C@@H](C1CCCCC1)[N@@H+](C)Cc1ccccc1O ZINC000775206395 585673276 /nfs/dbraw/zinc/67/32/76/585673276.db2.gz NWTSGKYFJNIVIJ-ZDUSSCGKSA-N 1 1 247.382 3.793 20 10 BHCDMO CCC[N@@H+](CC)Cc1cc(Cl)cc(C)c1O ZINC000775634295 585682011 /nfs/dbraw/zinc/68/20/11/585682011.db2.gz RAWSFDLUDIQHPA-UHFFFAOYSA-N 1 1 241.762 3.586 20 10 BHCDMO Cc1cccc(C[N@H+]([C@H](C)C(C)C)C2CC2)c1O ZINC000775637551 585682036 /nfs/dbraw/zinc/68/20/36/585682036.db2.gz QTTSKXWJCBVGCT-CYBMUJFWSA-N 1 1 247.382 3.710 20 10 BHCDMO Cc1cccc(C[N@H+]([C@@H](C)C(C)C)C2CC2)c1O ZINC000775637552 585681857 /nfs/dbraw/zinc/68/18/57/585681857.db2.gz QTTSKXWJCBVGCT-ZDUSSCGKSA-N 1 1 247.382 3.710 20 10 BHCDMO CCCC[N@@H+](C)Cc1cc(Cl)cc(C)c1O ZINC000775638531 585681959 /nfs/dbraw/zinc/68/19/59/585681959.db2.gz JXYVDXXISDDVML-UHFFFAOYSA-N 1 1 241.762 3.586 20 10 BHCDMO CCC(CC)[N@@H+](Cc1cccc(C)c1O)C1CC1 ZINC000775648368 585682249 /nfs/dbraw/zinc/68/22/49/585682249.db2.gz GGBAXPIPNZHDHS-UHFFFAOYSA-N 1 1 247.382 3.854 20 10 BHCDMO Cc1cccc(C[N@H+](CCC(C)C)C2CC2)c1O ZINC000775649468 585682506 /nfs/dbraw/zinc/68/25/06/585682506.db2.gz RVRYTLLFIMGRAJ-UHFFFAOYSA-N 1 1 247.382 3.711 20 10 BHCDMO CC[C@H](C)[N@@H+](C)Cc1cc(Cl)cc(C)c1O ZINC000775651277 585682618 /nfs/dbraw/zinc/68/26/18/585682618.db2.gz LWWHRPZKJVOZFT-JTQLQIEISA-N 1 1 241.762 3.584 20 10 BHCDMO CC[C@@H](C)[N@@H+](C)Cc1cc(Cl)cc(C)c1O ZINC000775651278 585682194 /nfs/dbraw/zinc/68/21/94/585682194.db2.gz LWWHRPZKJVOZFT-SNVBAGLBSA-N 1 1 241.762 3.584 20 10 BHCDMO Cc1cccc(C[N@H+]2CCC[C@H]2C(C)(C)C)c1O ZINC000775679180 585682970 /nfs/dbraw/zinc/68/29/70/585682970.db2.gz PSKIIAUOHFPNMF-AWEZNQCLSA-N 1 1 247.382 3.711 20 10 BHCDMO Cc1cccc(C[N@H+]2CCC[C@@H]2C(C)(C)C)c1O ZINC000775679181 585683047 /nfs/dbraw/zinc/68/30/47/585683047.db2.gz PSKIIAUOHFPNMF-CQSZACIVSA-N 1 1 247.382 3.711 20 10 BHCDMO CC[C@@]1(C)CCC[N@@H+](Cc2cccc(C)c2O)C1 ZINC000775699696 585683382 /nfs/dbraw/zinc/68/33/82/585683382.db2.gz BPSXAPMSCFZFKU-INIZCTEOSA-N 1 1 247.382 3.713 20 10 BHCDMO CC[C@]1(C)CCC[N@@H+](Cc2cccc(C)c2O)C1 ZINC000775699697 585683029 /nfs/dbraw/zinc/68/30/29/585683029.db2.gz BPSXAPMSCFZFKU-MRXNPFEDSA-N 1 1 247.382 3.713 20 10 BHCDMO Cc1cc(O)c(C[N@@H+]2CCCC[C@@H](C)C2)cc1C ZINC000775996642 585688750 /nfs/dbraw/zinc/68/87/50/585688750.db2.gz LHQRSYVDEJBTJQ-GFCCVEGCSA-N 1 1 247.382 3.631 20 10 BHCDMO Cc1cc(O)c(C[N@@H+]2CCCC[C@H](C)C2)cc1C ZINC000775996643 585688851 /nfs/dbraw/zinc/68/88/51/585688851.db2.gz LHQRSYVDEJBTJQ-LBPRGKRZSA-N 1 1 247.382 3.631 20 10 BHCDMO C[C@H](C1CCCCC1)[N@@H+](C)Cc1ccccc1O ZINC000777825045 585720711 /nfs/dbraw/zinc/72/07/11/585720711.db2.gz NWTSGKYFJNIVIJ-CYBMUJFWSA-N 1 1 247.382 3.793 20 10 BHCDMO Cc1cc(O)c(C[N@@H+]2CC=CCC2)cc1C(C)C ZINC000778576889 585737594 /nfs/dbraw/zinc/73/75/94/585737594.db2.gz ODYLTVDHBZRRIQ-UHFFFAOYSA-N 1 1 245.366 3.586 20 10 BHCDMO CCC(CC)[N@@H+](Cc1ccccc1O)C1CC1 ZINC000778994396 585743420 /nfs/dbraw/zinc/74/34/20/585743420.db2.gz DVNHNIKIDHTFDV-UHFFFAOYSA-N 1 1 233.355 3.545 20 10 BHCDMO Oc1ccccc1C[N@@H+](C1CC1)C1CCCCC1 ZINC000778995529 585743854 /nfs/dbraw/zinc/74/38/54/585743854.db2.gz BFRHNSNQFLKQNM-UHFFFAOYSA-N 1 1 245.366 3.689 20 10 BHCDMO CN(C)c1ccc(C[N@@H+](C)CCC(C)(C)C)cc1 ZINC000780894399 585785932 /nfs/dbraw/zinc/78/59/32/585785932.db2.gz DOGWNFXMCPFGPZ-UHFFFAOYSA-N 1 1 248.414 3.621 20 10 BHCDMO CCCC[N@@H+](C)Cc1ccc(N(CC)CC)cc1 ZINC000781616633 585800942 /nfs/dbraw/zinc/80/09/42/585800942.db2.gz BTBZZKVJQOWHRV-UHFFFAOYSA-N 1 1 248.414 3.765 20 10 BHCDMO C[N@@H+](CCCC(C)(C)C)Cc1ccccc1O ZINC000781897106 585804687 /nfs/dbraw/zinc/80/46/87/585804687.db2.gz NTXJXQRKYUQIHM-UHFFFAOYSA-N 1 1 235.371 3.650 20 10 BHCDMO Oc1ccccc1C[N@H+]1CCCC2(CCCC2)C1 ZINC000783745620 585841794 /nfs/dbraw/zinc/84/17/94/585841794.db2.gz OSDPXZPGNFPCGV-UHFFFAOYSA-N 1 1 245.366 3.548 20 10 BHCDMO CC[C@@H]1CC[C@H](C)[N@H+]1Cc1ccc(N(C)C)cc1 ZINC000785766559 585880050 /nfs/dbraw/zinc/88/00/50/585880050.db2.gz GLBHOCGDQNQRFK-DZGCQCFKSA-N 1 1 246.398 3.516 20 10 BHCDMO CC[C@H]1CC[C@@H](C)[N@H+]1Cc1ccc(N(C)C)cc1 ZINC000785766562 585880221 /nfs/dbraw/zinc/88/02/21/585880221.db2.gz GLBHOCGDQNQRFK-HIFRSBDPSA-N 1 1 246.398 3.516 20 10 BHCDMO CC[C@@H]1CC[C@@H](C)[N@H+]1Cc1ccc(N(C)C)cc1 ZINC000785766566 585880189 /nfs/dbraw/zinc/88/01/89/585880189.db2.gz GLBHOCGDQNQRFK-UKRRQHHQSA-N 1 1 246.398 3.516 20 10 BHCDMO CC[C@H]1CC[C@H](C)[N@H+]1Cc1ccc(N(C)C)cc1 ZINC000785766570 585880149 /nfs/dbraw/zinc/88/01/49/585880149.db2.gz GLBHOCGDQNQRFK-ZFWWWQNUSA-N 1 1 246.398 3.516 20 10 BHCDMO CN(C)c1ccc(C[N@@H+](C)C2(C)CCCC2)cc1 ZINC000786216638 585888794 /nfs/dbraw/zinc/88/87/94/585888794.db2.gz KVIYTGNFCODYCV-UHFFFAOYSA-N 1 1 246.398 3.517 20 10 BHCDMO C[N@@H+](Cc1ccccc1O)[C@H]1C=CCCCCC1 ZINC000787730141 636930936 /nfs/dbraw/zinc/93/09/36/636930936.db2.gz KHBMFPDVPPBJCO-HNNXBMFYSA-N 1 1 245.366 3.713 20 10 BHCDMO C[N@@H+](Cc1ccccc1O)[C@@H]1C=CCCCCC1 ZINC000787730149 636932026 /nfs/dbraw/zinc/93/20/26/636932026.db2.gz KHBMFPDVPPBJCO-OAHLLOKOSA-N 1 1 245.366 3.713 20 10 BHCDMO CCN(CC)c1ccc(C[N@@H+]2[C@H](C)C[C@@H]2C)cc1 ZINC000793228806 586014866 /nfs/dbraw/zinc/01/48/66/586014866.db2.gz RLEXJXKGXIXMBN-OKILXGFUSA-N 1 1 246.398 3.516 20 10 BHCDMO Cc1ccc(O)c(C[N@H+](C)[C@H]2CCC(C)(C)C2)c1 ZINC000793354080 586017137 /nfs/dbraw/zinc/01/71/37/586017137.db2.gz VDJKJEMTMASGGC-AWEZNQCLSA-N 1 1 247.382 3.711 20 10 BHCDMO Cc1ccc(O)c(C[N@H+](C)[C@@H]2CCC(C)(C)C2)c1 ZINC000793354081 586017188 /nfs/dbraw/zinc/01/71/88/586017188.db2.gz VDJKJEMTMASGGC-CQSZACIVSA-N 1 1 247.382 3.711 20 10 BHCDMO Cc1cccc(C[N@H+](C)[C@H]2CCC(C)(C)C2)c1O ZINC000793354085 586017335 /nfs/dbraw/zinc/01/73/35/586017335.db2.gz VWNLSBIRIKACPI-AWEZNQCLSA-N 1 1 247.382 3.711 20 10 BHCDMO Cc1cccc(C[N@H+](C)[C@@H]2CCC(C)(C)C2)c1O ZINC000793354086 586017331 /nfs/dbraw/zinc/01/73/31/586017331.db2.gz VWNLSBIRIKACPI-CQSZACIVSA-N 1 1 247.382 3.711 20 10 BHCDMO CC[N@H+](Cc1cc(C)c(C)cc1O)CC1CCC1 ZINC000793354191 586017170 /nfs/dbraw/zinc/01/71/70/586017170.db2.gz YSUMORLEHPXDMC-UHFFFAOYSA-N 1 1 247.382 3.631 20 10 BHCDMO CCN(CC)c1ccc(C[N@@H+](C)CC(C)C)cc1 ZINC000793569790 586023411 /nfs/dbraw/zinc/02/34/11/586023411.db2.gz QFBWNEZJTUXLGV-UHFFFAOYSA-N 1 1 248.414 3.621 20 10 BHCDMO CC[C@H]1CC[N@H+]1Cc1cc(C(C)C)c(C)cc1O ZINC000793819589 586026642 /nfs/dbraw/zinc/02/66/42/586026642.db2.gz IOWCXPHAOBJGBT-AWEZNQCLSA-N 1 1 247.382 3.808 20 10 BHCDMO CC[C@@H]1CC[N@H+]1Cc1cc(C(C)C)c(C)cc1O ZINC000793819594 586026646 /nfs/dbraw/zinc/02/66/46/586026646.db2.gz IOWCXPHAOBJGBT-CQSZACIVSA-N 1 1 247.382 3.808 20 10 BHCDMO CC[C@@H]1CC[N@H+]1Cc1c(O)ccc2ccccc21 ZINC000793823719 586027312 /nfs/dbraw/zinc/02/73/12/586027312.db2.gz OTEKRSVSNFCAHK-CYBMUJFWSA-N 1 1 241.334 3.530 20 10 BHCDMO CC[C@H]1CC[N@H+]1Cc1c(O)ccc2ccccc21 ZINC000793823820 586027220 /nfs/dbraw/zinc/02/72/20/586027220.db2.gz OTEKRSVSNFCAHK-ZDUSSCGKSA-N 1 1 241.334 3.530 20 10 BHCDMO CC[N@H+](Cc1cc(C)cc(C)c1O)CC1CCC1 ZINC000794684173 586046534 /nfs/dbraw/zinc/04/65/34/586046534.db2.gz TWXVBMYNUQZWDO-UHFFFAOYSA-N 1 1 247.382 3.631 20 10 BHCDMO Cc1cc(O)c(C[N@H+]2CCC(C)=C(C)C2)cc1C ZINC000794880380 586053001 /nfs/dbraw/zinc/05/30/01/586053001.db2.gz KXKRUKIAQRPGFC-UHFFFAOYSA-N 1 1 245.366 3.551 20 10 BHCDMO Cc1cc(C)c(O)c(C[N@H+]2CCC(C)=C(C)C2)c1 ZINC000794881164 586052945 /nfs/dbraw/zinc/05/29/45/586052945.db2.gz MZSQKMZJMZRDGN-UHFFFAOYSA-N 1 1 245.366 3.551 20 10 BHCDMO CC[C@@H]([NH2+]C1CCCC1)c1ccc(F)cc1O ZINC000796662872 586109478 /nfs/dbraw/zinc/10/94/78/586109478.db2.gz INPUSJFVKPFNHH-CYBMUJFWSA-N 1 1 237.318 3.515 20 10 BHCDMO CC[C@H]([NH2+]C1CCCC1)c1ccc(F)cc1O ZINC000796662875 586109636 /nfs/dbraw/zinc/10/96/36/586109636.db2.gz INPUSJFVKPFNHH-ZDUSSCGKSA-N 1 1 237.318 3.515 20 10 BHCDMO CCC(CC)[NH2+][C@H](CC)c1ccc(F)cc1O ZINC000796663780 586109658 /nfs/dbraw/zinc/10/96/58/586109658.db2.gz PZTQRVYXUFXONK-CYBMUJFWSA-N 1 1 239.334 3.761 20 10 BHCDMO CCC(CC)[NH2+][C@@H](CC)c1ccc(F)cc1O ZINC000796663782 586109609 /nfs/dbraw/zinc/10/96/09/586109609.db2.gz PZTQRVYXUFXONK-ZDUSSCGKSA-N 1 1 239.334 3.761 20 10 BHCDMO CCC[C@H](C)[NH2+][C@@H](CC)c1ccc(F)cc1O ZINC000796664515 586109571 /nfs/dbraw/zinc/10/95/71/586109571.db2.gz XTFSGQUOKBRXAW-GWCFXTLKSA-N 1 1 239.334 3.761 20 10 BHCDMO CCC[C@H](C)[NH2+][C@H](CC)c1ccc(F)cc1O ZINC000796664517 586109553 /nfs/dbraw/zinc/10/95/53/586109553.db2.gz XTFSGQUOKBRXAW-GXFFZTMASA-N 1 1 239.334 3.761 20 10 BHCDMO CCC[C@@H](C)[NH2+][C@@H](CC)c1ccc(F)cc1O ZINC000796664518 586109796 /nfs/dbraw/zinc/10/97/96/586109796.db2.gz XTFSGQUOKBRXAW-MFKMUULPSA-N 1 1 239.334 3.761 20 10 BHCDMO CCC[C@@H](C)[NH2+][C@H](CC)c1ccc(F)cc1O ZINC000796664519 586109701 /nfs/dbraw/zinc/10/97/01/586109701.db2.gz XTFSGQUOKBRXAW-ZWNOBZJWSA-N 1 1 239.334 3.761 20 10 BHCDMO CC[C@@H]([NH2+]CCC(C)C)c1ccc(F)cc1O ZINC000796665478 586109680 /nfs/dbraw/zinc/10/96/80/586109680.db2.gz JJACNBXSCGGGID-CYBMUJFWSA-N 1 1 239.334 3.618 20 10 BHCDMO CC[C@H]([NH2+]CCC(C)C)c1ccc(F)cc1O ZINC000796665480 586109863 /nfs/dbraw/zinc/10/98/63/586109863.db2.gz JJACNBXSCGGGID-ZDUSSCGKSA-N 1 1 239.334 3.618 20 10 BHCDMO CCCCC[NH2+][C@H](CC)c1ccc(F)cc1O ZINC000796666243 586109762 /nfs/dbraw/zinc/10/97/62/586109762.db2.gz OUKBVQWHCYKZME-CYBMUJFWSA-N 1 1 239.334 3.762 20 10 BHCDMO CCCCC[NH2+][C@@H](CC)c1ccc(F)cc1O ZINC000796666244 586109736 /nfs/dbraw/zinc/10/97/36/586109736.db2.gz OUKBVQWHCYKZME-ZDUSSCGKSA-N 1 1 239.334 3.762 20 10 BHCDMO CC[C@@H]([NH2+]CC(C)(C)C)c1ccc(F)cc1O ZINC000796704098 586110558 /nfs/dbraw/zinc/11/05/58/586110558.db2.gz GPOFAVVKNPBOPP-GFCCVEGCSA-N 1 1 239.334 3.618 20 10 BHCDMO CC[C@H]([NH2+]CC(C)(C)C)c1ccc(F)cc1O ZINC000796704099 586110577 /nfs/dbraw/zinc/11/05/77/586110577.db2.gz GPOFAVVKNPBOPP-LBPRGKRZSA-N 1 1 239.334 3.618 20 10 BHCDMO CC[C@@H]([NH2+][C@H]1CC=CCC1)c1ccc(F)cc1O ZINC000796816875 586113496 /nfs/dbraw/zinc/11/34/96/586113496.db2.gz LDCNOVSCJNCNPV-GXTWGEPZSA-N 1 1 249.329 3.681 20 10 BHCDMO CC[C@H]([NH2+][C@H]1CC=CCC1)c1ccc(F)cc1O ZINC000796816893 586113485 /nfs/dbraw/zinc/11/34/85/586113485.db2.gz LDCNOVSCJNCNPV-JSGCOSHPSA-N 1 1 249.329 3.681 20 10 BHCDMO CC[C@H]([NH2+][C@@H]1CC=CCC1)c1ccc(F)cc1O ZINC000796816896 586113489 /nfs/dbraw/zinc/11/34/89/586113489.db2.gz LDCNOVSCJNCNPV-OCCSQVGLSA-N 1 1 249.329 3.681 20 10 BHCDMO CC[C@@H]([NH2+][C@@H]1CC=CCC1)c1ccc(F)cc1O ZINC000796816899 586113528 /nfs/dbraw/zinc/11/35/28/586113528.db2.gz LDCNOVSCJNCNPV-TZMCWYRMSA-N 1 1 249.329 3.681 20 10 BHCDMO CC[C@@H]([NH2+]C1(C2CC2)CC1)c1ccc(F)cc1O ZINC000796890742 586116394 /nfs/dbraw/zinc/11/63/94/586116394.db2.gz WRCHGZJPAGTQPA-CYBMUJFWSA-N 1 1 249.329 3.515 20 10 BHCDMO CC[C@H]([NH2+]C1(C2CC2)CC1)c1ccc(F)cc1O ZINC000796890743 586116323 /nfs/dbraw/zinc/11/63/23/586116323.db2.gz WRCHGZJPAGTQPA-ZDUSSCGKSA-N 1 1 249.329 3.515 20 10 BHCDMO CC[C@@H]([NH2+]CC=C(C)C)c1ccc(F)cc1O ZINC000796965468 586118070 /nfs/dbraw/zinc/11/80/70/586118070.db2.gz JVHLGKUGJXSFJO-CYBMUJFWSA-N 1 1 237.318 3.538 20 10 BHCDMO CC[C@H]([NH2+]CC=C(C)C)c1ccc(F)cc1O ZINC000796965471 586118107 /nfs/dbraw/zinc/11/81/07/586118107.db2.gz JVHLGKUGJXSFJO-ZDUSSCGKSA-N 1 1 237.318 3.538 20 10 BHCDMO CC(C)C[C@@H](C)C[N@@H+](C)Cc1ccccc1O ZINC000799136800 586160614 /nfs/dbraw/zinc/16/06/14/586160614.db2.gz OBMDMONBZGBDRS-CYBMUJFWSA-N 1 1 235.371 3.506 20 10 BHCDMO CC(C)C[C@H](C)C[N@@H+](C)Cc1ccccc1O ZINC000799136801 586161119 /nfs/dbraw/zinc/16/11/19/586161119.db2.gz OBMDMONBZGBDRS-ZDUSSCGKSA-N 1 1 235.371 3.506 20 10 BHCDMO CCC[C@@H](C)[N@@H+](CCC)Cc1ccccc1O ZINC000800347069 586213111 /nfs/dbraw/zinc/21/31/11/586213111.db2.gz SMHPRNKQQJKMMM-CYBMUJFWSA-N 1 1 235.371 3.793 20 10 BHCDMO CCC[C@H](C)[N@@H+](CCC)Cc1ccccc1O ZINC000800347070 586213553 /nfs/dbraw/zinc/21/35/53/586213553.db2.gz SMHPRNKQQJKMMM-ZDUSSCGKSA-N 1 1 235.371 3.793 20 10 BHCDMO CCCC[N@H+](Cc1ccccc1O)CC(C)C ZINC000801595256 586265424 /nfs/dbraw/zinc/26/54/24/586265424.db2.gz KEGGRPJKNMJMFE-UHFFFAOYSA-N 1 1 235.371 3.650 20 10 BHCDMO CCCC[N@@H+](CCC1CC1)Cc1ccccc1O ZINC000801596166 586266244 /nfs/dbraw/zinc/26/62/44/586266244.db2.gz QZTRWAMAWLJFGI-UHFFFAOYSA-N 1 1 247.382 3.794 20 10 BHCDMO CCCC[N@H+](Cc1ccccc1O)CC1CCC1 ZINC000801597824 586265981 /nfs/dbraw/zinc/26/59/81/586265981.db2.gz PFZQPOZRCDWIHT-UHFFFAOYSA-N 1 1 247.382 3.794 20 10 BHCDMO CCCC[N@@H+](Cc1ccccc1O)CC1(C)CC1 ZINC000802657444 586309158 /nfs/dbraw/zinc/30/91/58/586309158.db2.gz DSBXZCGLHUGFCX-UHFFFAOYSA-N 1 1 247.382 3.794 20 10 BHCDMO CCCC[N@H+](Cc1ccccc1O)C[C@H]1C[C@@H]1C ZINC000802658003 586309240 /nfs/dbraw/zinc/30/92/40/586309240.db2.gz YWLRWUAHXJKALZ-DZGCQCFKSA-N 1 1 247.382 3.650 20 10 BHCDMO CCCC[N@H+](Cc1ccccc1O)C[C@@H]1C[C@H]1C ZINC000802658004 586309468 /nfs/dbraw/zinc/30/94/68/586309468.db2.gz YWLRWUAHXJKALZ-HIFRSBDPSA-N 1 1 247.382 3.650 20 10 BHCDMO CCCC[N@H+](Cc1ccccc1O)C[C@H]1C[C@H]1C ZINC000802658005 586309495 /nfs/dbraw/zinc/30/94/95/586309495.db2.gz YWLRWUAHXJKALZ-UKRRQHHQSA-N 1 1 247.382 3.650 20 10 BHCDMO CCCC[N@H+](Cc1ccccc1O)C[C@@H]1C[C@@H]1C ZINC000802658006 586308945 /nfs/dbraw/zinc/30/89/45/586308945.db2.gz YWLRWUAHXJKALZ-ZFWWWQNUSA-N 1 1 247.382 3.650 20 10 BHCDMO CC[C@@H]1CC[C@H](C)[N@H+]1Cc1cc(C)c(C)cc1O ZINC000809768361 586518645 /nfs/dbraw/zinc/51/86/45/586518645.db2.gz ITTCZWRIFPYGDP-DZGCQCFKSA-N 1 1 247.382 3.772 20 10 BHCDMO CC[C@H]1CC[C@@H](C)[N@H+]1Cc1cc(C)c(C)cc1O ZINC000809768362 586519268 /nfs/dbraw/zinc/51/92/68/586519268.db2.gz ITTCZWRIFPYGDP-HIFRSBDPSA-N 1 1 247.382 3.772 20 10 BHCDMO CC[C@@H]1CC[C@@H](C)[N@H+]1Cc1cc(C)c(C)cc1O ZINC000809768363 586519002 /nfs/dbraw/zinc/51/90/02/586519002.db2.gz ITTCZWRIFPYGDP-UKRRQHHQSA-N 1 1 247.382 3.772 20 10 BHCDMO CC[C@H]1CC[C@H](C)[N@H+]1Cc1cc(C)c(C)cc1O ZINC000809768364 586519111 /nfs/dbraw/zinc/51/91/11/586519111.db2.gz ITTCZWRIFPYGDP-ZFWWWQNUSA-N 1 1 247.382 3.772 20 10 BHCDMO CCC(CC)[N@@H+](CC)Cc1cc(C)ccc1O ZINC000809787483 586519568 /nfs/dbraw/zinc/51/95/68/586519568.db2.gz FPNIYGOATGIMGH-UHFFFAOYSA-N 1 1 235.371 3.711 20 10 BHCDMO CCC(CC)[N@@H+](CC)Cc1cccc(C)c1O ZINC000809787546 586519906 /nfs/dbraw/zinc/51/99/06/586519906.db2.gz HOSNDBZJEWVKTQ-UHFFFAOYSA-N 1 1 235.371 3.711 20 10 BHCDMO CCC(CC)[N@@H+](CC)Cc1cc(F)ccc1O ZINC000809788335 585436786 /nfs/dbraw/zinc/43/67/86/585436786.db2.gz QZXUFOIVEAYWJK-UHFFFAOYSA-N 1 1 239.334 3.542 20 10 BHCDMO CC[C@H]1CC[N@H+]1Cc1ccc(N(CC)CC)cc1 ZINC000814178810 586616009 /nfs/dbraw/zinc/61/60/09/586616009.db2.gz DPRDYIMVKZILQZ-HNNXBMFYSA-N 1 1 246.398 3.517 20 10 BHCDMO CC[C@@H]1CC[N@H+]1Cc1ccc(N(CC)CC)cc1 ZINC000814178811 586616055 /nfs/dbraw/zinc/61/60/55/586616055.db2.gz DPRDYIMVKZILQZ-OAHLLOKOSA-N 1 1 246.398 3.517 20 10 BHCDMO Cc1cc(C[N@H+](C)[C@@H](C)C(C)C)ccc1N(C)C ZINC000815014583 586663897 /nfs/dbraw/zinc/66/38/97/586663897.db2.gz UHQIGUOJJGNZSC-AWEZNQCLSA-N 1 1 248.414 3.537 20 10 BHCDMO Cc1cc(C[N@H+](C)[C@H](C)C(C)C)ccc1N(C)C ZINC000815014584 586664217 /nfs/dbraw/zinc/66/42/17/586664217.db2.gz UHQIGUOJJGNZSC-CQSZACIVSA-N 1 1 248.414 3.537 20 10 BHCDMO Cc1cc(C[N@@H+](C)CC(C)(C)C)ccc1N(C)C ZINC000815033670 586664659 /nfs/dbraw/zinc/66/46/59/586664659.db2.gz OURJDRLIZRVDCL-UHFFFAOYSA-N 1 1 248.414 3.539 20 10 BHCDMO CCC(C)(C)[N@@H+](C)Cc1ccc(N(C)C)c(C)c1 ZINC000815069572 586665498 /nfs/dbraw/zinc/66/54/98/586665498.db2.gz IDQDJLYVMMVLRI-UHFFFAOYSA-N 1 1 248.414 3.681 20 10 BHCDMO CCCC[N@@H+](C)Cc1ccc2ccccc2c1O ZINC000816480144 586735699 /nfs/dbraw/zinc/73/56/99/586735699.db2.gz DUPJDZDQOIRLBE-UHFFFAOYSA-N 1 1 243.350 3.777 20 10 BHCDMO CC(C)C[N@@H+](C)Cc1ccc2ccccc2c1O ZINC000816484130 586736218 /nfs/dbraw/zinc/73/62/18/586736218.db2.gz QHSIWFIPYDEXDF-UHFFFAOYSA-N 1 1 243.350 3.633 20 10 BHCDMO CC[N@@H+](Cc1ccc2ccccc2c1O)C(C)C ZINC000816484315 586735949 /nfs/dbraw/zinc/73/59/49/586735949.db2.gz XMYRSBQGCGUSAY-UHFFFAOYSA-N 1 1 243.350 3.776 20 10 BHCDMO CC[N@@H+](Cc1ccc2ccccc2c1O)C1CC1 ZINC000816486127 586735667 /nfs/dbraw/zinc/73/56/67/586735667.db2.gz PLWCHTADQKXMSM-UHFFFAOYSA-N 1 1 241.334 3.530 20 10 BHCDMO CC[C@@H](C)[N@@H+](C)Cc1ccc2ccccc2c1O ZINC000816487424 586736335 /nfs/dbraw/zinc/73/63/35/586736335.db2.gz MPYGJPKRGPFDSO-GFCCVEGCSA-N 1 1 243.350 3.776 20 10 BHCDMO CC[C@H](C)[N@@H+](C)Cc1ccc2ccccc2c1O ZINC000816487425 586736105 /nfs/dbraw/zinc/73/61/05/586736105.db2.gz MPYGJPKRGPFDSO-LBPRGKRZSA-N 1 1 243.350 3.776 20 10 BHCDMO C[C@@H]1CCC[N@H+]1Cc1ccc2ccccc2c1O ZINC000816508856 586737687 /nfs/dbraw/zinc/73/76/87/586737687.db2.gz WUVYXRZEAZMSBX-GFCCVEGCSA-N 1 1 241.334 3.530 20 10 BHCDMO C[C@H]1CCC[N@H+]1Cc1ccc2ccccc2c1O ZINC000816508857 586737497 /nfs/dbraw/zinc/73/74/97/586737497.db2.gz WUVYXRZEAZMSBX-LBPRGKRZSA-N 1 1 241.334 3.530 20 10 BHCDMO C[C@@H]1C[C@H](C)[N@@H+]1Cc1ccc2ccccc2c1O ZINC000816594392 586742577 /nfs/dbraw/zinc/74/25/77/586742577.db2.gz BQUYVDPPTIALQT-TXEJJXNPSA-N 1 1 241.334 3.528 20 10 BHCDMO Cc1cccc(C[N@H+]2CC(C)(C)[C@@H]2C(C)C)c1O ZINC000816624741 586746001 /nfs/dbraw/zinc/74/60/01/586746001.db2.gz GLFWHFPCJSQKGA-HNNXBMFYSA-N 1 1 247.382 3.567 20 10 BHCDMO Cc1cccc(C[N@H+]2CC(C)(C)[C@H]2C(C)C)c1O ZINC000816624742 586745697 /nfs/dbraw/zinc/74/56/97/586745697.db2.gz GLFWHFPCJSQKGA-OAHLLOKOSA-N 1 1 247.382 3.567 20 10 BHCDMO Cc1ccc(O)c(C[N@H+]2CC(C)(C)[C@@H]2C(C)C)c1 ZINC000816624876 584981203 /nfs/dbraw/zinc/98/12/03/584981203.db2.gz JZWLLAQMXPPIIQ-HNNXBMFYSA-N 1 1 247.382 3.567 20 10 BHCDMO Cc1ccc(O)c(C[N@H+]2CC(C)(C)[C@H]2C(C)C)c1 ZINC000816624877 584980940 /nfs/dbraw/zinc/98/09/40/584980940.db2.gz JZWLLAQMXPPIIQ-OAHLLOKOSA-N 1 1 247.382 3.567 20 10 BHCDMO CC/C=C\C[NH2+][C@H](CC)c1ccc(F)cc1O ZINC000834877746 587769056 /nfs/dbraw/zinc/76/90/56/587769056.db2.gz WMUQLWPYCPHWED-CFHLNLSMSA-N 1 1 237.318 3.538 20 10 BHCDMO CC/C=C/C[NH2+][C@@H](CC)c1ccc(F)cc1O ZINC000834877748 587769046 /nfs/dbraw/zinc/76/90/46/587769046.db2.gz WMUQLWPYCPHWED-GFUIURDCSA-N 1 1 237.318 3.538 20 10 BHCDMO CC/C=C\C[NH2+][C@@H](CC)c1ccc(F)cc1O ZINC000834877749 587769004 /nfs/dbraw/zinc/76/90/04/587769004.db2.gz WMUQLWPYCPHWED-SZZPACECSA-N 1 1 237.318 3.538 20 10 BHCDMO CC/C=C/C[NH2+][C@H](CC)c1ccc(F)cc1O ZINC000834877750 587769108 /nfs/dbraw/zinc/76/91/08/587769108.db2.gz WMUQLWPYCPHWED-URWSZGRFSA-N 1 1 237.318 3.538 20 10 BHCDMO C[C@@H](C[NH2+]c1ccc(N)cc1)Cc1ccccc1 ZINC000841040808 587938479 /nfs/dbraw/zinc/93/84/79/587938479.db2.gz ZKJZGTYWGFPIQL-CYBMUJFWSA-N 1 1 240.350 3.560 20 10 BHCDMO C[C@H](C[NH2+]c1ccc(N)cc1)Cc1ccccc1 ZINC000841040809 587938340 /nfs/dbraw/zinc/93/83/40/587938340.db2.gz ZKJZGTYWGFPIQL-ZDUSSCGKSA-N 1 1 240.350 3.560 20 10 BHCDMO C[C@@H]([NH2+]C1CCCC1)c1ccc(Cl)cc1O ZINC000841743882 583991340 /nfs/dbraw/zinc/99/13/40/583991340.db2.gz KMZXPKINVHCROO-SECBINFHSA-N 1 1 239.746 3.639 20 10 BHCDMO C[C@H]([NH2+]C1CCCC1)c1ccc(Cl)cc1O ZINC000841743884 583991380 /nfs/dbraw/zinc/99/13/80/583991380.db2.gz KMZXPKINVHCROO-VIFPVBQESA-N 1 1 239.746 3.639 20 10 BHCDMO C[C@@H]([NH2+]CC(C)(C)C)c1ccc(Cl)cc1O ZINC000841744962 587973501 /nfs/dbraw/zinc/97/35/01/587973501.db2.gz LTTNUWUDLFSQNS-SECBINFHSA-N 1 1 241.762 3.742 20 10 BHCDMO C[C@H]([NH2+]CC(C)(C)C)c1ccc(Cl)cc1O ZINC000841744964 587973933 /nfs/dbraw/zinc/97/39/33/587973933.db2.gz LTTNUWUDLFSQNS-VIFPVBQESA-N 1 1 241.762 3.742 20 10 BHCDMO CCC1([NH2+][C@H](C)c2ccc(Cl)cc2O)CC1 ZINC000841753219 587974259 /nfs/dbraw/zinc/97/42/59/587974259.db2.gz FCUYZNBFHGWJBC-SECBINFHSA-N 1 1 239.746 3.639 20 10 BHCDMO CCC1([NH2+][C@@H](C)c2ccc(Cl)cc2O)CC1 ZINC000841753220 587974325 /nfs/dbraw/zinc/97/43/25/587974325.db2.gz FCUYZNBFHGWJBC-VIFPVBQESA-N 1 1 239.746 3.639 20 10 BHCDMO Cc1cc(Cl)cc(C[N@H+](C)C(C)(C)C)c1O ZINC000843431190 588108979 /nfs/dbraw/zinc/10/89/79/588108979.db2.gz NYYZZASXMFLPKP-UHFFFAOYSA-N 1 1 241.762 3.584 20 10 BHCDMO Oc1ccccc1C[N@H+]1CCCC[C@H]1C1CCC1 ZINC000843437348 588110392 /nfs/dbraw/zinc/11/03/92/588110392.db2.gz DBQWSITZIIWCLI-HNNXBMFYSA-N 1 1 245.366 3.547 20 10 BHCDMO Oc1ccccc1C[N@H+]1CCCC[C@@H]1C1CCC1 ZINC000843437349 588110535 /nfs/dbraw/zinc/11/05/35/588110535.db2.gz DBQWSITZIIWCLI-OAHLLOKOSA-N 1 1 245.366 3.547 20 10 BHCDMO Cc1cc(O)c(C[N@H+]2CCC23CCCC3)cc1C ZINC000845999002 588253111 /nfs/dbraw/zinc/25/31/11/588253111.db2.gz GGBFSSOEBFAIFN-UHFFFAOYSA-N 1 1 245.366 3.528 20 10 BHCDMO C[C@H]([NH2+]C1(C2CCC2)CC1)c1ccc(F)cc1O ZINC000846208550 588260174 /nfs/dbraw/zinc/26/01/74/588260174.db2.gz ZPAWIVLXERZKPY-JTQLQIEISA-N 1 1 249.329 3.515 20 10 BHCDMO C[C@@H]([NH2+]C1(C2CCC2)CC1)c1ccc(F)cc1O ZINC000846208552 588259910 /nfs/dbraw/zinc/25/99/10/588259910.db2.gz ZPAWIVLXERZKPY-SNVBAGLBSA-N 1 1 249.329 3.515 20 10 BHCDMO CCc1cccc(C[N@@H+](C(C)C)C2CCC2)c1O ZINC000848887848 588417919 /nfs/dbraw/zinc/41/79/19/588417919.db2.gz GKWKGZSAQCQMKY-UHFFFAOYSA-N 1 1 247.382 3.718 20 10 BHCDMO CC[C@H]([NH2+]CC1=CCCC1)c1ccc(F)cc1O ZINC000850558434 588560901 /nfs/dbraw/zinc/56/09/01/588560901.db2.gz WUEZPAVTNSFBNH-AWEZNQCLSA-N 1 1 249.329 3.682 20 10 BHCDMO CC[C@@H]([NH2+]CC1=CCCC1)c1ccc(F)cc1O ZINC000850558435 588560915 /nfs/dbraw/zinc/56/09/15/588560915.db2.gz WUEZPAVTNSFBNH-CQSZACIVSA-N 1 1 249.329 3.682 20 10 BHCDMO CCC[N@H+](Cc1ccccc1O)CC1CC=CC1 ZINC000851792776 588629111 /nfs/dbraw/zinc/62/91/11/588629111.db2.gz SQNXPLHQDUGIEU-UHFFFAOYSA-N 1 1 245.366 3.570 20 10 BHCDMO C[C@H]([NH2+]C1(C2CCC2)CC1)c1c(O)cccc1F ZINC000886631513 592282155 /nfs/dbraw/zinc/28/21/55/592282155.db2.gz OWAXISGJIMEYJJ-JTQLQIEISA-N 1 1 249.329 3.515 20 10 BHCDMO C[C@@H]([NH2+]C1(C2CCC2)CC1)c1c(O)cccc1F ZINC000886631514 592282998 /nfs/dbraw/zinc/28/29/98/592282998.db2.gz OWAXISGJIMEYJJ-SNVBAGLBSA-N 1 1 249.329 3.515 20 10 BHCDMO C[C@H]([NH2+]C1CC2(CCC2)C1)c1c(O)cccc1F ZINC000886632654 592282943 /nfs/dbraw/zinc/28/29/43/592282943.db2.gz ALFIPMUFUZPORN-JTQLQIEISA-N 1 1 249.329 3.515 20 10 BHCDMO C[C@@H]([NH2+]C1CC2(CCC2)C1)c1c(O)cccc1F ZINC000886632655 592282362 /nfs/dbraw/zinc/28/23/62/592282362.db2.gz ALFIPMUFUZPORN-SNVBAGLBSA-N 1 1 249.329 3.515 20 10 BHCDMO C[C@H]([NH2+][C@H]1CCCC12CC2)c1c(O)cccc1F ZINC000886644443 592287962 /nfs/dbraw/zinc/28/79/62/592287962.db2.gz CXYUEVGRIKDVHE-GWCFXTLKSA-N 1 1 249.329 3.515 20 10 BHCDMO C[C@H]([NH2+][C@@H]1CCCC12CC2)c1c(O)cccc1F ZINC000886644444 592287834 /nfs/dbraw/zinc/28/78/34/592287834.db2.gz CXYUEVGRIKDVHE-GXFFZTMASA-N 1 1 249.329 3.515 20 10 BHCDMO C[C@@H]([NH2+][C@H]1CCCC12CC2)c1c(O)cccc1F ZINC000886644445 592287852 /nfs/dbraw/zinc/28/78/52/592287852.db2.gz CXYUEVGRIKDVHE-MFKMUULPSA-N 1 1 249.329 3.515 20 10 BHCDMO C[C@@H]([NH2+][C@@H]1CCCC12CC2)c1c(O)cccc1F ZINC000886644446 592286979 /nfs/dbraw/zinc/28/69/79/592286979.db2.gz CXYUEVGRIKDVHE-ZWNOBZJWSA-N 1 1 249.329 3.515 20 10 BHCDMO C[C@H]([NH2+]C1(C2CC2)CCC1)c1c(O)cccc1F ZINC000886824527 592346813 /nfs/dbraw/zinc/34/68/13/592346813.db2.gz BATLCBZEQLHYTK-JTQLQIEISA-N 1 1 249.329 3.515 20 10 BHCDMO C[C@@H]([NH2+]C1(C2CC2)CCC1)c1c(O)cccc1F ZINC000886824528 592347383 /nfs/dbraw/zinc/34/73/83/592347383.db2.gz BATLCBZEQLHYTK-SNVBAGLBSA-N 1 1 249.329 3.515 20 10 BHCDMO C[C@H]([NH2+]C1(C2CC2)CCC1)c1ccc(F)cc1O ZINC000886825198 592349014 /nfs/dbraw/zinc/34/90/14/592349014.db2.gz OLYJFQPRSYKANN-JTQLQIEISA-N 1 1 249.329 3.515 20 10 BHCDMO C[C@@H]([NH2+]C1(C2CC2)CCC1)c1ccc(F)cc1O ZINC000886825199 592348786 /nfs/dbraw/zinc/34/87/86/592348786.db2.gz OLYJFQPRSYKANN-SNVBAGLBSA-N 1 1 249.329 3.515 20 10 BHCDMO CCCC[N@@H+](CC)Cc1cc(C)c(C)cc1O ZINC000914567222 641736788 /nfs/dbraw/zinc/73/67/88/641736788.db2.gz JYHQVMUATHBUER-UHFFFAOYSA-N 1 1 235.371 3.631 20 10 BHCDMO CCCC[N@@H+](CC)Cc1cc2c(cc1O)CCC2 ZINC000914567399 641736043 /nfs/dbraw/zinc/73/60/43/641736043.db2.gz WQAZNBARUDETLM-UHFFFAOYSA-N 1 1 247.382 3.503 20 10 BHCDMO Cc1cc(O)c(C[N@H+](C)[C@H](C)C(C)(C)C)cc1C ZINC000914568601 641737475 /nfs/dbraw/zinc/73/74/75/641737475.db2.gz KVQSDENVFZVHCB-CYBMUJFWSA-N 1 1 249.398 3.875 20 10 BHCDMO Cc1cc(O)c(C[N@H+](C)[C@@H](C)C(C)(C)C)cc1C ZINC000914568602 641736898 /nfs/dbraw/zinc/73/68/98/641736898.db2.gz KVQSDENVFZVHCB-ZDUSSCGKSA-N 1 1 249.398 3.875 20 10 BHCDMO Cc1cc(C[N@H+](C)C2CC2)c(O)c(C(C)(C)C)c1 ZINC000914783783 641764414 /nfs/dbraw/zinc/76/44/14/641764414.db2.gz NUZBRHZOCHMEPO-UHFFFAOYSA-N 1 1 247.382 3.592 20 10 BHCDMO CCCC[N@@H+](Cc1cc(C)c(C)cc1O)C1CC1 ZINC000914784070 641765356 /nfs/dbraw/zinc/76/53/56/641765356.db2.gz WCIIDLGZWUGWMG-UHFFFAOYSA-N 1 1 247.382 3.774 20 10 BHCDMO CC[C@H]1CCC[N@@H+](Cc2cc(C)c(C)cc2O)C1 ZINC000915205665 641809778 /nfs/dbraw/zinc/80/97/78/641809778.db2.gz GTAYAFIABJZOTO-AWEZNQCLSA-N 1 1 247.382 3.631 20 10 BHCDMO CC[C@@H]1CCC[N@@H+](Cc2cc(C)c(C)cc2O)C1 ZINC000915205667 641809447 /nfs/dbraw/zinc/80/94/47/641809447.db2.gz GTAYAFIABJZOTO-CQSZACIVSA-N 1 1 247.382 3.631 20 10 BHCDMO Cc1cc(O)c(C[N@H+](CC2CC2)C(C)C)cc1C ZINC000915209453 641809303 /nfs/dbraw/zinc/80/93/03/641809303.db2.gz WUVVZKLPHOLZKI-UHFFFAOYSA-N 1 1 247.382 3.629 20 10 BHCDMO CCC[C@@H](C)[N@@H+](C)Cc1cc(C)c(C)cc1O ZINC000915212119 641809769 /nfs/dbraw/zinc/80/97/69/641809769.db2.gz VAHYXXCZXNMJMP-CYBMUJFWSA-N 1 1 235.371 3.629 20 10 BHCDMO CCC[C@H](C)[N@@H+](C)Cc1cc(C)c(C)cc1O ZINC000915212120 641809063 /nfs/dbraw/zinc/80/90/63/641809063.db2.gz VAHYXXCZXNMJMP-ZDUSSCGKSA-N 1 1 235.371 3.629 20 10 BHCDMO CC[C@H]1CCCC[N@H+]1Cc1cc(C)c(C)cc1O ZINC000915789797 641858322 /nfs/dbraw/zinc/85/83/22/641858322.db2.gz MELBCXSOKFHVSW-HNNXBMFYSA-N 1 1 247.382 3.774 20 10 BHCDMO CC[C@@H]1CCCC[N@H+]1Cc1cc(C)c(C)cc1O ZINC000915789799 641858339 /nfs/dbraw/zinc/85/83/39/641858339.db2.gz MELBCXSOKFHVSW-OAHLLOKOSA-N 1 1 247.382 3.774 20 10 BHCDMO CCC[N@H+](Cc1cc(C)c(C)cc1O)CC1CC1 ZINC000915794859 641859037 /nfs/dbraw/zinc/85/90/37/641859037.db2.gz OPNFPKDBIFGOEB-UHFFFAOYSA-N 1 1 247.382 3.631 20 10 BHCDMO CCCC[N@@H+](Cc1ccc(N(C)C)cc1)C(C)C ZINC000917074864 642002110 /nfs/dbraw/zinc/00/21/10/642002110.db2.gz INHDEUKLTCNEOG-UHFFFAOYSA-N 1 1 248.414 3.763 20 10 BHCDMO CCCC[N@@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC000917074990 642003180 /nfs/dbraw/zinc/00/31/80/642003180.db2.gz OCNYRBRPVVHGNE-UHFFFAOYSA-N 1 1 246.398 3.517 20 10 BHCDMO CC[N@@H+](Cc1cc(C)c(C)cc1O)C1CCCC1 ZINC000917463211 642063295 /nfs/dbraw/zinc/06/32/95/642063295.db2.gz YHWBRXYYFWZEOP-UHFFFAOYSA-N 1 1 247.382 3.774 20 10 BHCDMO Cc1cc(O)c(C[N@@H+](C)CC2CC2)cc1C(C)C ZINC000919944599 642408860 /nfs/dbraw/zinc/40/88/60/642408860.db2.gz WUIYSSFGYKFCHZ-UHFFFAOYSA-N 1 1 247.382 3.666 20 10 BHCDMO CC[C@H]1CCCC[N@H+]1Cc1ccc(N(C)C)cc1 ZINC000920256988 642462069 /nfs/dbraw/zinc/46/20/69/642462069.db2.gz ALSIUQLEJODHEQ-HNNXBMFYSA-N 1 1 246.398 3.517 20 10 BHCDMO CC[C@@H]1CCCC[N@H+]1Cc1ccc(N(C)C)cc1 ZINC000920256998 642462564 /nfs/dbraw/zinc/46/25/64/642462564.db2.gz ALSIUQLEJODHEQ-OAHLLOKOSA-N 1 1 246.398 3.517 20 10 BHCDMO C[C@@H]([N@@H+](C)Cc1ccc(N(C)C)cc1)C(C)(C)C ZINC000920258085 642464436 /nfs/dbraw/zinc/46/44/36/642464436.db2.gz HGYXQCVVBPVZEM-CYBMUJFWSA-N 1 1 248.414 3.619 20 10 BHCDMO C[C@H]([N@@H+](C)Cc1ccc(N(C)C)cc1)C(C)(C)C ZINC000920258086 642464860 /nfs/dbraw/zinc/46/48/60/642464860.db2.gz HGYXQCVVBPVZEM-ZDUSSCGKSA-N 1 1 248.414 3.619 20 10 BHCDMO Cc1cc(O)c(C[N@@H+]2CCC[C@H]2C(C)C)cc1C ZINC000920485547 642509968 /nfs/dbraw/zinc/50/99/68/642509968.db2.gz TVLFQXCVJLFHMA-HNNXBMFYSA-N 1 1 247.382 3.629 20 10 BHCDMO