smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name O=C(Cc1ccc(O)c(O)c1)NCc1ccc(-n2cc[nH+]c2)cc1 ZINC001136428472 790327723 /nfs/dbraw/zinc/32/77/23/790327723.db2.gz AOFUQEYJWZWUBA-UHFFFAOYSA-N 1 2 323.352 2.142 20 10 DECDLO O=C(/C=C\c1ccc(O)c(O)c1)NCc1ccn2cc[nH+]c2c1 ZINC000588407438 777090970 /nfs/dbraw/zinc/09/09/70/777090970.db2.gz JNUAXJMGGYCZBI-RQOWECAXSA-N 1 2 309.325 2.075 20 10 DECDLO CS(=O)(=O)[C@@H]1CCC[N@H+](Cc2ccc(Cl)cc2O)C1 ZINC001140466120 777190546 /nfs/dbraw/zinc/19/05/46/777190546.db2.gz XROVLAIVCSKDQT-GFCCVEGCSA-N 1 2 303.811 2.055 20 10 DECDLO CS(=O)(=O)[C@@H]1CCC[N@@H+](Cc2ccc(Cl)cc2O)C1 ZINC001140466120 777190549 /nfs/dbraw/zinc/19/05/49/777190549.db2.gz XROVLAIVCSKDQT-GFCCVEGCSA-N 1 2 303.811 2.055 20 10 DECDLO COc1c[nH+]c(NCc2ccc(O)c(O)c2)nc1NC1CC1 ZINC001169992713 785797302 /nfs/dbraw/zinc/79/73/02/785797302.db2.gz BPIKKHAEEGBJIS-UHFFFAOYSA-N 1 2 302.334 2.083 20 10 DECDLO Oc1cccc(F)c1C[NH+]1CCN(Cc2cccnc2)CC1 ZINC001137831716 796144234 /nfs/dbraw/zinc/14/42/34/796144234.db2.gz KWYWUICQSQAJPY-UHFFFAOYSA-N 1 2 301.365 2.244 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CC[C@@H](O)[C@@H](F)CC1 ZINC001139126771 796328223 /nfs/dbraw/zinc/32/82/23/796328223.db2.gz PTMZGFKENHJGBM-DZGCQCFKSA-N 1 2 321.348 2.102 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CC[C@@H](O)[C@@H](F)CC1 ZINC001139126771 796328226 /nfs/dbraw/zinc/32/82/26/796328226.db2.gz PTMZGFKENHJGBM-DZGCQCFKSA-N 1 2 321.348 2.102 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1C[C@H]2CC[C@@H](C1)O2 ZINC001139127426 796329324 /nfs/dbraw/zinc/32/93/24/796329324.db2.gz VZZDYQRJRSUALK-TXEJJXNPSA-N 1 2 301.342 2.170 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1C[C@H]2CC[C@@H](C1)O2 ZINC001139127426 796329327 /nfs/dbraw/zinc/32/93/27/796329327.db2.gz VZZDYQRJRSUALK-TXEJJXNPSA-N 1 2 301.342 2.170 20 10 DECDLO CC[C@@H]1COCC[N@@H+]1Cc1c(O)ccc2c(C)cc(=O)oc21 ZINC001139132096 796331102 /nfs/dbraw/zinc/33/11/02/796331102.db2.gz TVXOFRQXDIPLDB-GFCCVEGCSA-N 1 2 303.358 2.418 20 10 DECDLO CC[C@@H]1COCC[N@H+]1Cc1c(O)ccc2c(C)cc(=O)oc21 ZINC001139132096 796331105 /nfs/dbraw/zinc/33/11/05/796331105.db2.gz TVXOFRQXDIPLDB-GFCCVEGCSA-N 1 2 303.358 2.418 20 10 DECDLO CCOC[C@H]1C[N@H+](Cc2cc(F)ccc2O)Cc2ncn(C)c21 ZINC001140063171 796472385 /nfs/dbraw/zinc/47/23/85/796472385.db2.gz MFEIBGMHQAWGCI-CYBMUJFWSA-N 1 2 319.380 2.401 20 10 DECDLO CCOC[C@H]1C[N@@H+](Cc2cc(F)ccc2O)Cc2ncn(C)c21 ZINC001140063171 796472388 /nfs/dbraw/zinc/47/23/88/796472388.db2.gz MFEIBGMHQAWGCI-CYBMUJFWSA-N 1 2 319.380 2.401 20 10 DECDLO CN1C[C@@]2(CC1=O)CCCC[N@@H+]2Cc1c(O)cc(F)cc1F ZINC001140581690 796541060 /nfs/dbraw/zinc/54/10/60/796541060.db2.gz XPVUMLIFAKGNKK-INIZCTEOSA-N 1 2 310.344 2.257 20 10 DECDLO CN1C[C@@]2(CC1=O)CCCC[N@H+]2Cc1c(O)cc(F)cc1F ZINC001140581690 796541062 /nfs/dbraw/zinc/54/10/62/796541062.db2.gz XPVUMLIFAKGNKK-INIZCTEOSA-N 1 2 310.344 2.257 20 10 DECDLO C[C@H]1C[N@H+](Cc2ccc(N3CCOCC3)cc2F)CCCC1=O ZINC001140660319 796552236 /nfs/dbraw/zinc/55/22/36/796552236.db2.gz OBJDSVOLLOPGQS-AWEZNQCLSA-N 1 2 320.408 2.463 20 10 DECDLO C[C@H]1C[N@@H+](Cc2ccc(N3CCOCC3)cc2F)CCCC1=O ZINC001140660319 796552240 /nfs/dbraw/zinc/55/22/40/796552240.db2.gz OBJDSVOLLOPGQS-AWEZNQCLSA-N 1 2 320.408 2.463 20 10 DECDLO Cc1c(O)ccc(C[N@@H+]2C[C@@H]3C[C@H]2[C@H](C(F)(F)F)O3)c1O ZINC001140747627 796567358 /nfs/dbraw/zinc/56/73/58/796567358.db2.gz GVQFTYYNMNRYFN-OUJBWJOFSA-N 1 2 303.280 2.310 20 10 DECDLO Cc1c(O)ccc(C[N@H+]2C[C@@H]3C[C@H]2[C@H](C(F)(F)F)O3)c1O ZINC001140747627 796567361 /nfs/dbraw/zinc/56/73/61/796567361.db2.gz GVQFTYYNMNRYFN-OUJBWJOFSA-N 1 2 303.280 2.310 20 10 DECDLO COC(=O)[C@H](C(C)C)[N@H+](C)Cc1c(O)cc(OC)cc1OC ZINC001141030936 796621507 /nfs/dbraw/zinc/62/15/07/796621507.db2.gz RHCBDZYWXULZDO-HNNXBMFYSA-N 1 2 311.378 2.039 20 10 DECDLO COC(=O)[C@H](C(C)C)[N@@H+](C)Cc1c(O)cc(OC)cc1OC ZINC001141030936 796621509 /nfs/dbraw/zinc/62/15/09/796621509.db2.gz RHCBDZYWXULZDO-HNNXBMFYSA-N 1 2 311.378 2.039 20 10 DECDLO COc1cc(C)c(C[N@@H+]2CCN(CC(C)C)C(=O)C2)c(O)c1 ZINC001205477914 800361885 /nfs/dbraw/zinc/36/18/85/800361885.db2.gz NXZARLFNNYZDCS-UHFFFAOYSA-N 1 2 306.406 2.009 20 10 DECDLO COc1cc(C)c(C[N@H+]2CCN(CC(C)C)C(=O)C2)c(O)c1 ZINC001205477914 800361892 /nfs/dbraw/zinc/36/18/92/800361892.db2.gz NXZARLFNNYZDCS-UHFFFAOYSA-N 1 2 306.406 2.009 20 10 DECDLO Oc1cc(F)c(F)cc1C[N@@H+]1CCO[C@@]2(CCSC2)C1 ZINC001206392900 800524301 /nfs/dbraw/zinc/52/43/01/800524301.db2.gz NPVRZYPPCHBWFZ-AWEZNQCLSA-N 1 2 301.358 2.378 20 10 DECDLO Oc1cc(F)c(F)cc1C[N@H+]1CCO[C@@]2(CCSC2)C1 ZINC001206392900 800524306 /nfs/dbraw/zinc/52/43/06/800524306.db2.gz NPVRZYPPCHBWFZ-AWEZNQCLSA-N 1 2 301.358 2.378 20 10 DECDLO Cc1cc(C)c(N(C)S(=O)(=O)CCc2ccc(N)cc2)c[nH+]1 ZINC001213515738 801617549 /nfs/dbraw/zinc/61/75/49/801617549.db2.gz HYBAJNBOXAWBQJ-UHFFFAOYSA-N 1 2 319.430 2.289 20 10 DECDLO CCOC(=O)[C@H]1CCCC[N@@H+]1Cc1cc(OC)c(O)cc1O ZINC001231635359 801701040 /nfs/dbraw/zinc/70/10/40/801701040.db2.gz HJJKJKVUKPRLLW-GFCCVEGCSA-N 1 2 309.362 2.024 20 10 DECDLO CCOC(=O)[C@H]1CCCC[N@H+]1Cc1cc(OC)c(O)cc1O ZINC001231635359 801701042 /nfs/dbraw/zinc/70/10/42/801701042.db2.gz HJJKJKVUKPRLLW-GFCCVEGCSA-N 1 2 309.362 2.024 20 10 DECDLO C[N@@H+]1CC[C@H](Oc2cccc3c2C(=O)c2c(O)cccc2C3=O)C1 ZINC001226380147 803101182 /nfs/dbraw/zinc/10/11/82/803101182.db2.gz OCCSMRUBGPBKDN-NSHDSACASA-N 1 2 323.348 2.251 20 10 DECDLO C[N@H+]1CC[C@H](Oc2cccc3c2C(=O)c2c(O)cccc2C3=O)C1 ZINC001226380147 803101184 /nfs/dbraw/zinc/10/11/84/803101184.db2.gz OCCSMRUBGPBKDN-NSHDSACASA-N 1 2 323.348 2.251 20 10 DECDLO C[C@@H]([NH2+][C@@H]1CCCSC1)c1cccc(-c2nn[nH]n2)c1O ZINC001603659300 1070027898 /nfs/dbraw/zinc/02/78/98/1070027898.db2.gz ZXUAUHDMUXHQFO-NXEZZACHSA-N 1 2 305.407 2.119 20 10 DECDLO C[C@H](O)CC(C)(C)C[NH2+][C@@H](C)c1cccc(-c2nn[nH]n2)c1O ZINC001603697350 1070048920 /nfs/dbraw/zinc/04/89/20/1070048920.db2.gz YJACPSJDHCWSJZ-QWRGUYRKSA-N 1 2 319.409 2.020 20 10 DECDLO CC[C@H]([NH2+][C@H](C)c1cccc(-c2nn[nH]n2)c1O)[C@@H]1CCCO1 ZINC001604055494 1070188540 /nfs/dbraw/zinc/18/85/40/1070188540.db2.gz PRDJHRHGFNRPBZ-SWHYSGLUSA-N 1 2 317.393 2.181 20 10 DECDLO CC[C@H]([NH2+]CCCCCCO)c1cccc(-c2nn[nH]n2)c1O ZINC001604057038 1070190925 /nfs/dbraw/zinc/19/09/25/1070190925.db2.gz XXYMRVWPAFNBSQ-AWEZNQCLSA-N 1 2 319.409 2.166 20 10 DECDLO O=C(Cc1ccc(O)c(O)c1)Nc1ccc(-n2cc[nH+]c2)cc1 ZINC001629389266 1078316565 /nfs/dbraw/zinc/31/65/65/1078316565.db2.gz ODJNGWWYAFJKKA-UHFFFAOYSA-N 1 2 309.325 2.465 20 10 DECDLO O=C(c1cc2cc(O)c(O)cc2s1)N1CCn2c[nH+]cc2C1 ZINC001637134792 1078505237 /nfs/dbraw/zinc/50/52/37/1078505237.db2.gz RGNRTAPHVZPSOM-UHFFFAOYSA-N 1 2 315.354 2.165 20 10 DECDLO C[C@@H]([NH2+][C@@H]1CCOC(C)(C)C1)c1cccc(-c2nn[nH]n2)c1O ZINC001589952823 1076535119 /nfs/dbraw/zinc/53/51/19/1076535119.db2.gz DGQYSVMIAYCJGJ-GHMZBOCLSA-N 1 2 317.393 2.181 20 10 DECDLO C[C@H]([NH2+]CC1CC(F)(F)C1)c1cccc(-c2nn[nH]n2)c1O ZINC001589974984 1076540913 /nfs/dbraw/zinc/54/09/13/1076540913.db2.gz DLEMBHVRCNRSFG-QMMMGPOBSA-N 1 2 309.320 2.268 20 10 DECDLO O=S1(=O)CCC(C[NH2+]Cc2cc(Cl)cc(F)c2O)CC1 ZINC001662137826 1080573118 /nfs/dbraw/zinc/57/31/18/1080573118.db2.gz QENGQLLWDWTHHT-UHFFFAOYSA-N 1 2 321.801 2.099 20 10 DECDLO CC(C)(C)NC(=O)[C@@H]1CC12C[NH+](Cc1c(O)cccc1F)C2 ZINC001277485311 1083998699 /nfs/dbraw/zinc/99/86/99/1083998699.db2.gz ZDOUBCNYZXBFCR-LBPRGKRZSA-N 1 2 306.381 2.268 20 10 DECDLO Oc1c(Br)cc(F)cc1C[N@H+]1CCC[C@H](O)C1 ZINC001235297651 1084376734 /nfs/dbraw/zinc/37/67/34/1084376734.db2.gz OWXSBWPFBMQYLK-JTQLQIEISA-N 1 2 304.159 2.251 20 10 DECDLO Oc1c(Br)cc(F)cc1C[N@@H+]1CCC[C@H](O)C1 ZINC001235297651 1084376743 /nfs/dbraw/zinc/37/67/43/1084376743.db2.gz OWXSBWPFBMQYLK-JTQLQIEISA-N 1 2 304.159 2.251 20 10 DECDLO CC(C)C[N@H+](CC(N)=O)Cc1c(O)cccc1Br ZINC000707152473 1086662567 /nfs/dbraw/zinc/66/25/67/1086662567.db2.gz MMHQMFBWADOMHO-UHFFFAOYSA-N 1 2 315.211 2.098 20 10 DECDLO CC(C)C[N@@H+](CC(N)=O)Cc1c(O)cccc1Br ZINC000707152473 1086662573 /nfs/dbraw/zinc/66/25/73/1086662573.db2.gz MMHQMFBWADOMHO-UHFFFAOYSA-N 1 2 315.211 2.098 20 10 DECDLO COCCC[NH+]1CCN(Cc2cc(F)cc(Cl)c2O)CC1 ZINC001237799230 1138791603 /nfs/dbraw/zinc/79/16/03/1138791603.db2.gz PUGWUFFGKHUPFV-UHFFFAOYSA-N 1 2 316.804 2.339 20 10 DECDLO C[N@H+]1CCC[C@H](NC2CC[NH+](Cc3ccccc3O)CC2)C1 ZINC001255475699 1143653441 /nfs/dbraw/zinc/65/34/41/1143653441.db2.gz TYKFVLSZUAADBX-KRWDZBQOSA-N 1 2 303.450 2.040 20 10 DECDLO CN(C)c1ccc(CN(C)C(=O)[C@@H]2CCc3[nH+]ccn3C2)cc1 ZINC000372952955 529780148 /nfs/dbraw/zinc/78/01/48/529780148.db2.gz YKPDPMSNWRRMQX-OAHLLOKOSA-N 1 2 312.417 2.170 20 10 DECDLO O=C(C=Cc1c[nH]c[nH+]1)N1CCC[C@@H](O)c2cc(F)ccc21 ZINC000493438835 249296059 /nfs/dbraw/zinc/29/60/59/249296059.db2.gz ZCORZBCIGTUAOE-ZDTYVGOBSA-N 1 2 301.321 2.422 20 10 DECDLO COC(=O)[C@@H]1C[C@@H](OC)CC[N@@H+]1Cc1cccc(Cl)c1O ZINC000376821592 533043246 /nfs/dbraw/zinc/04/32/46/533043246.db2.gz FOJCRFNJDZWFJA-AAEUAGOBSA-N 1 2 313.781 2.198 20 10 DECDLO COC(=O)[C@@H]1C[C@@H](OC)CC[N@H+]1Cc1cccc(Cl)c1O ZINC000376821592 533043250 /nfs/dbraw/zinc/04/32/50/533043250.db2.gz FOJCRFNJDZWFJA-AAEUAGOBSA-N 1 2 313.781 2.198 20 10 DECDLO O=C(/C=C/c1ccc(O)c(O)c1)N1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000272385238 130025639 /nfs/dbraw/zinc/02/56/39/130025639.db2.gz GCPLKWJQHYGKID-DIECRNLCSA-N 1 2 313.357 2.240 20 10 DECDLO Cc1cc(C)nc(N2CC[NH+](Cc3cccc(F)c3O)CC2)n1 ZINC000272811287 130066546 /nfs/dbraw/zinc/06/65/46/130066546.db2.gz ASJIWGYBHHDQRT-UHFFFAOYSA-N 1 2 316.380 2.260 20 10 DECDLO COC(=O)c1ccc(O)c([C@H](C)N[C@H]2CC[N@@H+]3CCCC[C@H]23)c1 ZINC000273420887 130118824 /nfs/dbraw/zinc/11/88/24/130118824.db2.gz RZQADRJJSFZPRI-VBNZEHGJSA-N 1 2 318.417 2.456 20 10 DECDLO COC(=O)c1ccc(O)c([C@H](C)N[C@H]2CC[N@H+]3CCCC[C@H]23)c1 ZINC000273420887 130118828 /nfs/dbraw/zinc/11/88/28/130118828.db2.gz RZQADRJJSFZPRI-VBNZEHGJSA-N 1 2 318.417 2.456 20 10 DECDLO CC(=O)c1cc(Cl)cc(C[NH2+][C@H](C)c2ncn(C)n2)c1O ZINC000275476283 130324758 /nfs/dbraw/zinc/32/47/58/130324758.db2.gz DFASZTOZBBQLMZ-MRVPVSSYSA-N 1 2 308.769 2.228 20 10 DECDLO CC(C)(C)CNC(=O)C(C)(C)[NH2+]Cc1cc([N+](=O)[O-])ccc1O ZINC000121311837 402027719 /nfs/dbraw/zinc/02/77/19/402027719.db2.gz HZUNQBRQVUMQJK-UHFFFAOYSA-N 1 2 323.393 2.331 20 10 DECDLO CC[N@H+](Cc1c(O)cccc1Cl)[C@H](C)CS(C)(=O)=O ZINC000126230200 402270625 /nfs/dbraw/zinc/27/06/25/402270625.db2.gz CQQOSUCKJSKEOU-SNVBAGLBSA-N 1 2 305.827 2.301 20 10 DECDLO CC[N@@H+](Cc1c(O)cccc1Cl)[C@H](C)CS(C)(=O)=O ZINC000126230200 402270626 /nfs/dbraw/zinc/27/06/26/402270626.db2.gz CQQOSUCKJSKEOU-SNVBAGLBSA-N 1 2 305.827 2.301 20 10 DECDLO Cc1nccc(N2CC[NH+](Cc3cccc(Cl)c3O)CC2)n1 ZINC000184764077 402298221 /nfs/dbraw/zinc/29/82/21/402298221.db2.gz JVXVSJLUEGGWAP-UHFFFAOYSA-N 1 2 318.808 2.466 20 10 DECDLO C[C@H](C[NH2+][C@H](C)c1ccc(F)c(F)c1O)CN1CCOCC1 ZINC000187728770 402510171 /nfs/dbraw/zinc/51/01/71/402510171.db2.gz NEFHIGQEZMVFBO-VXGBXAGGSA-N 1 2 314.376 2.289 20 10 DECDLO Cn1cc2c(n1)CCC[C@@H]2[NH2+]Cc1cc([N+](=O)[O-])ccc1O ZINC000280046323 402966600 /nfs/dbraw/zinc/96/66/00/402966600.db2.gz JIHCVRCYCSQSEU-ZDUSSCGKSA-N 1 2 302.334 2.201 20 10 DECDLO CCOC(=O)[C@@H]([NH2+]Cc1cc2c(cc1O)OCO2)[C@@H](C)CC ZINC000276525562 403183576 /nfs/dbraw/zinc/18/35/76/403183576.db2.gz VYILCWXUHXWYCT-BONVTDFDSA-N 1 2 309.362 2.188 20 10 DECDLO C[C@H]1C[C@@H](N2CCOCC2)C[N@@H+]1Cc1cccc(Cl)c1O ZINC000377633477 404841267 /nfs/dbraw/zinc/84/12/67/404841267.db2.gz UVVAQXSWAFHJDL-GXTWGEPZSA-N 1 2 310.825 2.341 20 10 DECDLO C[C@H]1C[C@@H](N2CCOCC2)C[N@H+]1Cc1cccc(Cl)c1O ZINC000377633477 404841271 /nfs/dbraw/zinc/84/12/71/404841271.db2.gz UVVAQXSWAFHJDL-GXTWGEPZSA-N 1 2 310.825 2.341 20 10 DECDLO CN(C)c1ccc(C[N@@H+]2CCO[C@@H]([C@H]3CCCO3)C2)cc1F ZINC000367546201 405079933 /nfs/dbraw/zinc/07/99/33/405079933.db2.gz DRXFEPWLICLCBE-IAGOWNOFSA-N 1 2 308.397 2.272 20 10 DECDLO CN(C)c1ccc(C[N@H+]2CCO[C@@H]([C@H]3CCCO3)C2)cc1F ZINC000367546201 405079936 /nfs/dbraw/zinc/07/99/36/405079936.db2.gz DRXFEPWLICLCBE-IAGOWNOFSA-N 1 2 308.397 2.272 20 10 DECDLO CC(=O)Nc1cccc2c1CCCN2C(=O)C=Cc1c[nH]c[nH+]1 ZINC000492899367 277087858 /nfs/dbraw/zinc/08/78/58/277087858.db2.gz MAQOXUDTOSJWSF-FPLPWBNLSA-N 1 2 310.357 2.361 20 10 DECDLO Cc1cc(NCc2ccc(N3CCC(O)CC3)c(F)c2)nc[nH+]1 ZINC000301239062 336296190 /nfs/dbraw/zinc/29/61/90/336296190.db2.gz LONGPXOJLIGJIE-UHFFFAOYSA-N 1 2 316.380 2.497 20 10 DECDLO Oc1c(Cl)cccc1C[NH+]1CCN(c2cccnn2)CC1 ZINC000179972619 526327257 /nfs/dbraw/zinc/32/72/57/526327257.db2.gz JRJYVFDSBUBCJA-UHFFFAOYSA-N 1 2 304.781 2.158 20 10 DECDLO Cc1nc(NCc2ccc(N3CCOCC3)c(F)c2)cc[nH+]1 ZINC000266419714 527350664 /nfs/dbraw/zinc/35/06/64/527350664.db2.gz RVXRMXRIOXPXCQ-UHFFFAOYSA-N 1 2 302.353 2.373 20 10 DECDLO CC[C@H]1C[N@H+](Cc2cc(Br)cc(F)c2O)C[C@H]1O ZINC000894096799 636112936 /nfs/dbraw/zinc/11/29/36/636112936.db2.gz ZZSSJIWXXBBMMG-QPUJVOFHSA-N 1 2 318.186 2.497 20 10 DECDLO CC[C@H]1C[N@@H+](Cc2cc(Br)cc(F)c2O)C[C@H]1O ZINC000894096799 636112938 /nfs/dbraw/zinc/11/29/38/636112938.db2.gz ZZSSJIWXXBBMMG-QPUJVOFHSA-N 1 2 318.186 2.497 20 10 DECDLO CNc1cc(NCc2ccc(N3CCC(O)CC3)cc2)nc[nH+]1 ZINC000894613884 637131281 /nfs/dbraw/zinc/13/12/81/637131281.db2.gz UCBLQXONPIXVFY-UHFFFAOYSA-N 1 2 313.405 2.092 20 10 DECDLO CNc1cc(NCc2ccc(N3CCC(O)CC3)cc2)[nH+]cn1 ZINC000894613884 637131285 /nfs/dbraw/zinc/13/12/85/637131285.db2.gz UCBLQXONPIXVFY-UHFFFAOYSA-N 1 2 313.405 2.092 20 10 DECDLO COc1ccc(O)c(CNC(=O)NCc2c[nH+]c(C)cc2C)c1 ZINC000838474559 637580205 /nfs/dbraw/zinc/58/02/05/637580205.db2.gz MCIXAJRXABFAPQ-UHFFFAOYSA-N 1 2 315.373 2.412 20 10 DECDLO C[C@H](NC(=O)NCCc1cn(C)c[nH+]1)c1ccc(N(C)C)cc1 ZINC000838559135 637599128 /nfs/dbraw/zinc/59/91/28/637599128.db2.gz KNRPUJNOVCZFNO-ZDUSSCGKSA-N 1 2 315.421 2.089 20 10 DECDLO OC[C@@H]([NH2+]Cc1cc(Cl)cc(F)c1O)[C@H]1CCCOC1 ZINC000840961489 650395760 /nfs/dbraw/zinc/39/57/60/650395760.db2.gz BKBNFFVDEQTIFO-TVQRCGJNSA-N 1 2 303.761 2.062 20 10 DECDLO COC(=O)[C@@H]1CSCC[N@H+](Cc2cccc(Cl)c2O)C1 ZINC000840977943 650398722 /nfs/dbraw/zinc/39/87/22/650398722.db2.gz NVXOBHCOCDKTIA-NSHDSACASA-N 1 2 315.822 2.384 20 10 DECDLO COC(=O)[C@@H]1CSCC[N@@H+](Cc2cccc(Cl)c2O)C1 ZINC000840977943 650398724 /nfs/dbraw/zinc/39/87/24/650398724.db2.gz NVXOBHCOCDKTIA-NSHDSACASA-N 1 2 315.822 2.384 20 10 DECDLO CN1C[C@@H](CC[NH2+]Cc2cc(Cl)c(F)cc2O)CC1=O ZINC000896308075 638460216 /nfs/dbraw/zinc/46/02/16/638460216.db2.gz DEROOYOVQLRSJF-VIFPVBQESA-N 1 2 300.761 2.143 20 10 DECDLO O=S1(=O)CCCC[C@H]1C[NH2+]Cc1cc(Cl)cc(F)c1O ZINC000753568540 639313802 /nfs/dbraw/zinc/31/38/02/639313802.db2.gz RRJPUMJKWBHDGS-NSHDSACASA-N 1 2 321.801 2.242 20 10 DECDLO COc1ccc(N2CC[NH+](Cc3cc(C)nn3C)CC2)cc1F ZINC000841847761 650577732 /nfs/dbraw/zinc/57/77/32/650577732.db2.gz JQGQVHBDPFIWEZ-UHFFFAOYSA-N 1 2 318.396 2.198 20 10 DECDLO CCOc1cccc(C[N@H+](C)Cc2nnc3ccccn32)c1O ZINC000769204112 641192991 /nfs/dbraw/zinc/19/29/91/641192991.db2.gz RBAXVRXSYMPQTQ-UHFFFAOYSA-N 1 2 312.373 2.466 20 10 DECDLO CCOc1cccc(C[N@@H+](C)Cc2nnc3ccccn32)c1O ZINC000769204112 641192996 /nfs/dbraw/zinc/19/29/96/641192996.db2.gz RBAXVRXSYMPQTQ-UHFFFAOYSA-N 1 2 312.373 2.466 20 10 DECDLO CCC[C@@H]1C[N@H+](Cc2ccc([N+](=O)[O-])c(OC)c2O)CCO1 ZINC000774906283 641980449 /nfs/dbraw/zinc/98/04/49/641980449.db2.gz WXQOUGGKSSXEGG-GFCCVEGCSA-N 1 2 310.350 2.310 20 10 DECDLO CCC[C@@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])c(OC)c2O)CCO1 ZINC000774906283 641980454 /nfs/dbraw/zinc/98/04/54/641980454.db2.gz WXQOUGGKSSXEGG-GFCCVEGCSA-N 1 2 310.350 2.310 20 10 DECDLO Cc1nnc(C[NH2+][C@H](C)c2ccc(N3CCOCC3)cc2)o1 ZINC000775259082 642023115 /nfs/dbraw/zinc/02/31/15/642023115.db2.gz NWUHAWSNTRPGNY-GFCCVEGCSA-N 1 2 302.378 2.065 20 10 DECDLO CC(=O)N1CCC[N@H+](Cc2cc(Cl)cc(F)c2O)CC1 ZINC000775644637 642071021 /nfs/dbraw/zinc/07/10/21/642071021.db2.gz MBWMVHZBINIUIT-UHFFFAOYSA-N 1 2 300.761 2.239 20 10 DECDLO CC(=O)N1CCC[N@@H+](Cc2cc(Cl)cc(F)c2O)CC1 ZINC000775644637 642071027 /nfs/dbraw/zinc/07/10/27/642071027.db2.gz MBWMVHZBINIUIT-UHFFFAOYSA-N 1 2 300.761 2.239 20 10 DECDLO COC(=O)[C@H]1C[N@H+](Cc2cc(Cl)cc(F)c2O)C[C@@H]1C ZINC000775723616 642085252 /nfs/dbraw/zinc/08/52/52/642085252.db2.gz JFKAWLSXQAHQHS-KWQFWETISA-N 1 2 301.745 2.426 20 10 DECDLO COC(=O)[C@H]1C[N@@H+](Cc2cc(Cl)cc(F)c2O)C[C@@H]1C ZINC000775723616 642085260 /nfs/dbraw/zinc/08/52/60/642085260.db2.gz JFKAWLSXQAHQHS-KWQFWETISA-N 1 2 301.745 2.426 20 10 DECDLO OCCC1([NH2+]Cc2cc(Cl)cc(F)c2O)CCOCC1 ZINC000775760152 642090894 /nfs/dbraw/zinc/09/08/94/642090894.db2.gz WKCWYWQYVIQLHI-UHFFFAOYSA-N 1 2 303.761 2.206 20 10 DECDLO NC(=O)C1CCC([NH2+]Cc2cc(Cl)cc(F)c2O)CC1 ZINC000776175599 642138861 /nfs/dbraw/zinc/13/88/61/642138861.db2.gz PKMJEHIRYAJTTN-UHFFFAOYSA-N 1 2 300.761 2.318 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@@H+](C)[C@H](C)C(=O)NC(C)(C)C)c1O ZINC000776856001 642213412 /nfs/dbraw/zinc/21/34/12/642213412.db2.gz OHRVCZIAPGHBOF-SNVBAGLBSA-N 1 2 324.396 2.469 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@H+](C)[C@H](C)C(=O)NC(C)(C)C)c1O ZINC000776856001 642213417 /nfs/dbraw/zinc/21/34/17/642213417.db2.gz OHRVCZIAPGHBOF-SNVBAGLBSA-N 1 2 324.396 2.469 20 10 DECDLO Cc1cccn2cc(CCNC(=O)c3cccc(O)c3O)[nH+]c12 ZINC000790838909 643902518 /nfs/dbraw/zinc/90/25/18/643902518.db2.gz KEGPKUDHTCIONX-UHFFFAOYSA-N 1 2 311.341 2.026 20 10 DECDLO C[C@H]([NH2+][C@H](CO)C[C@H](O)C(C)(C)C)c1cc(F)cc(F)c1O ZINC000793566522 644274978 /nfs/dbraw/zinc/27/49/78/644274978.db2.gz GJBOZUAXYQSPEC-CHIMOYNISA-N 1 2 317.376 2.479 20 10 DECDLO C[C@H]([NH2+][C@@H](CO)C[C@@H](O)C(C)(C)C)c1cc(F)cc(F)c1O ZINC000793566524 644275134 /nfs/dbraw/zinc/27/51/34/644275134.db2.gz GJBOZUAXYQSPEC-DRCTWCGVSA-N 1 2 317.376 2.479 20 10 DECDLO C[C@H]1C[N@H+](Cc2cc(C(C)(C)C)cc(O)c2O)CC(=O)N1C ZINC000799955557 645236410 /nfs/dbraw/zinc/23/64/10/645236410.db2.gz ILZHVKBWISODTD-NSHDSACASA-N 1 2 306.406 2.058 20 10 DECDLO C[C@H]1C[N@@H+](Cc2cc(C(C)(C)C)cc(O)c2O)CC(=O)N1C ZINC000799955557 645236412 /nfs/dbraw/zinc/23/64/12/645236412.db2.gz ILZHVKBWISODTD-NSHDSACASA-N 1 2 306.406 2.058 20 10 DECDLO O=C(C[NH2+]Cc1cccc(Cl)c1O)NCc1ccccc1 ZINC000158125003 646591525 /nfs/dbraw/zinc/59/15/25/646591525.db2.gz CPLVMUKOHGQCEQ-UHFFFAOYSA-N 1 2 304.777 2.452 20 10 DECDLO CCNC(=O)[C@@H]([NH2+]Cc1cc(Cl)cc(F)c1O)C(C)C ZINC000816637807 647162151 /nfs/dbraw/zinc/16/21/51/647162151.db2.gz PJXTWKYUGKLACV-LBPRGKRZSA-N 1 2 302.777 2.435 20 10 DECDLO C[C@@H](NC1C[NH2+]C1)c1cc(Br)cc(Cl)c1O ZINC000817955767 647392319 /nfs/dbraw/zinc/39/23/19/647392319.db2.gz HIKJURGUXNWKOX-ZCFIWIBFSA-N 1 2 305.603 2.431 20 10 DECDLO CCOC(=O)C[N@@H+](Cc1ccccc1O)C[C@H]1CC[C@H](C)O1 ZINC000823576806 648445521 /nfs/dbraw/zinc/44/55/21/648445521.db2.gz ZZFAINLDFDADNA-DZGCQCFKSA-N 1 2 307.390 2.325 20 10 DECDLO CCOC(=O)C[N@H+](Cc1ccccc1O)C[C@H]1CC[C@H](C)O1 ZINC000823576806 648445524 /nfs/dbraw/zinc/44/55/24/648445524.db2.gz ZZFAINLDFDADNA-DZGCQCFKSA-N 1 2 307.390 2.325 20 10 DECDLO Cc1cc(O)c(C[NH+]2CCN(C(=O)N(C)C)CC2)cc1Cl ZINC000824556442 648609861 /nfs/dbraw/zinc/60/98/61/648609861.db2.gz UFALRRGYINICPE-UHFFFAOYSA-N 1 2 311.813 2.153 20 10 DECDLO CS(=O)(=O)C[C@@H]1CCCC[N@@H+]1Cc1c(O)cccc1Cl ZINC000824913534 648671643 /nfs/dbraw/zinc/67/16/43/648671643.db2.gz AJJDIBSVPRBKEO-NSHDSACASA-N 1 2 317.838 2.445 20 10 DECDLO CS(=O)(=O)C[C@@H]1CCCC[N@H+]1Cc1c(O)cccc1Cl ZINC000824913534 648671644 /nfs/dbraw/zinc/67/16/44/648671644.db2.gz AJJDIBSVPRBKEO-NSHDSACASA-N 1 2 317.838 2.445 20 10 DECDLO C[C@H]1OCC[C@@H]1[N@H+](CCO)Cc1cc(Cl)cc(F)c1O ZINC000825129878 648708052 /nfs/dbraw/zinc/70/80/52/648708052.db2.gz HGZYEUBXJYUSIT-RNCFNFMXSA-N 1 2 303.761 2.156 20 10 DECDLO C[C@H]1OCC[C@@H]1[N@@H+](CCO)Cc1cc(Cl)cc(F)c1O ZINC000825129878 648708054 /nfs/dbraw/zinc/70/80/54/648708054.db2.gz HGZYEUBXJYUSIT-RNCFNFMXSA-N 1 2 303.761 2.156 20 10 DECDLO Cc1cc(O)c(C[NH+]2CC(n3cc([C@@H](C)O)nn3)C2)cc1Cl ZINC000825461747 648765453 /nfs/dbraw/zinc/76/54/53/648765453.db2.gz NSBVJDPTVOPYJF-SNVBAGLBSA-N 1 2 322.796 2.056 20 10 DECDLO Cc1nnc(C[N@@H+](C)Cc2cc(Br)ccc2O)o1 ZINC000827039394 648963071 /nfs/dbraw/zinc/96/30/71/648963071.db2.gz RLNCHOTWUIQZKR-UHFFFAOYSA-N 1 2 312.167 2.478 20 10 DECDLO Cc1nnc(C[N@H+](C)Cc2cc(Br)ccc2O)o1 ZINC000827039394 648963073 /nfs/dbraw/zinc/96/30/73/648963073.db2.gz RLNCHOTWUIQZKR-UHFFFAOYSA-N 1 2 312.167 2.478 20 10 DECDLO C[C@H](O)CNc1cc(NCc2cc(Cl)ccc2O)nc[nH+]1 ZINC000845709562 651272683 /nfs/dbraw/zinc/27/26/83/651272683.db2.gz UWMILYJFFLQSTP-VIFPVBQESA-N 1 2 308.769 2.240 20 10 DECDLO C[C@H](O)CNc1cc(NCc2cc(Cl)ccc2O)[nH+]cn1 ZINC000845709562 651272684 /nfs/dbraw/zinc/27/26/84/651272684.db2.gz UWMILYJFFLQSTP-VIFPVBQESA-N 1 2 308.769 2.240 20 10 DECDLO COc1cccc([C@@H](C)[NH2+]Cc2nc([C@H]3CCCO3)n[nH]2)c1O ZINC000848558359 651470473 /nfs/dbraw/zinc/47/04/73/651470473.db2.gz PPRXNXRGSZJXCS-ZWNOBZJWSA-N 1 2 318.377 2.221 20 10 DECDLO CN(Cc1ccccc1O)C(=O)NCCCNc1cccc[nH+]1 ZINC000046945007 683907031 /nfs/dbraw/zinc/90/70/31/683907031.db2.gz VPERUQQFBCPPMR-UHFFFAOYSA-N 1 2 314.389 2.431 20 10 DECDLO CCNC(=O)C[N@H+](CC)Cc1cccc(Br)c1O ZINC000133617279 684221262 /nfs/dbraw/zinc/22/12/62/684221262.db2.gz JMUVJOISQYCRMW-UHFFFAOYSA-N 1 2 315.211 2.113 20 10 DECDLO CCNC(=O)C[N@@H+](CC)Cc1cccc(Br)c1O ZINC000133617279 684221266 /nfs/dbraw/zinc/22/12/66/684221266.db2.gz JMUVJOISQYCRMW-UHFFFAOYSA-N 1 2 315.211 2.113 20 10 DECDLO O=C(NCc1ccc(O)c(O)c1)c1ccc(Cn2cc[nH+]c2)cc1 ZINC000159013746 684307845 /nfs/dbraw/zinc/30/78/45/684307845.db2.gz WPEPOQRRXPFBEU-UHFFFAOYSA-N 1 2 323.352 2.273 20 10 DECDLO COc1ccc(N2CCN(Cc3[nH]c(C)c(C)[nH+]3)CC2)cc1 ZINC000862211013 686255182 /nfs/dbraw/zinc/25/51/82/686255182.db2.gz AETGWQZFAKEINE-UHFFFAOYSA-N 1 2 300.406 2.357 20 10 DECDLO COC(=O)[C@@H](C[C@H]1CCCOC1)[NH2+]Cc1cc(C)c(C)cc1O ZINC000862515948 686313190 /nfs/dbraw/zinc/31/31/90/686313190.db2.gz GPNOORPWTWRBBH-GDBMZVCRSA-N 1 2 321.417 2.457 20 10 DECDLO CCC(CC)[C@@H](C(=O)N(C)c1ccc(N)cc1)[NH+]1CCOCC1 ZINC000877077526 690014049 /nfs/dbraw/zinc/01/40/49/690014049.db2.gz LRSRVEBKFSHLDM-KRWDZBQOSA-N 1 2 319.449 2.369 20 10 DECDLO COCCO[C@@H]1CCC[N@H+](Cc2ccc(F)c(F)c2O)C1 ZINC000877502650 690133464 /nfs/dbraw/zinc/13/34/64/690133464.db2.gz OZVUILCHDFMMPN-GFCCVEGCSA-N 1 2 301.333 2.298 20 10 DECDLO COCCO[C@@H]1CCC[N@@H+](Cc2ccc(F)c(F)c2O)C1 ZINC000877502650 690133465 /nfs/dbraw/zinc/13/34/65/690133465.db2.gz OZVUILCHDFMMPN-GFCCVEGCSA-N 1 2 301.333 2.298 20 10 DECDLO CC(C)(O)CN1CC[C@H]([NH2+]Cc2cc(Cl)cc(F)c2O)C1 ZINC000877665338 690183691 /nfs/dbraw/zinc/18/36/91/690183691.db2.gz RLXXFUMYUSEXJU-LBPRGKRZSA-N 1 2 316.804 2.120 20 10 DECDLO Cc1cccc(O)c1CN(C)CC[NH+]1CC2(C1)CCOCC2 ZINC000877766292 690220200 /nfs/dbraw/zinc/22/02/00/690220200.db2.gz WVRZRGMIWABHEP-UHFFFAOYSA-N 1 2 304.434 2.245 20 10 DECDLO COc1ccc(N2CC[NH+](Cc3ccno3)CC2)c(OC)c1 ZINC000879462676 690646836 /nfs/dbraw/zinc/64/68/36/690646836.db2.gz RQYFTFCZZDUOBY-UHFFFAOYSA-N 1 2 303.362 2.014 20 10 DECDLO CN(CCO)c1ccc(NCc2cc(F)cc(F)c2O)[nH+]c1 ZINC000883050195 691420327 /nfs/dbraw/zinc/42/03/27/691420327.db2.gz HJNPKKZSIVYSJG-UHFFFAOYSA-N 1 2 309.316 2.106 20 10 DECDLO C[C@H]([NH2+]Cc1cccc(Br)c1O)C1(CO)CC1 ZINC000696126679 794560282 /nfs/dbraw/zinc/56/02/82/794560282.db2.gz NBCBESBQAZFBSP-VIFPVBQESA-N 1 2 300.196 2.405 20 10 DECDLO COc1cc(C)cc(C[NH2+]Cc2nc(C(F)(F)F)n[nH]2)c1O ZINC001184448672 796059520 /nfs/dbraw/zinc/05/95/20/796059520.db2.gz ARNNKPWXKYBLEI-UHFFFAOYSA-N 1 2 316.283 2.136 20 10 DECDLO CCN1C[C@@H](C)[N@H+](Cc2ccc3c(c2)CCCN3C)CC1=O ZINC001138359209 796205285 /nfs/dbraw/zinc/20/52/85/796205285.db2.gz NOGYXLLJQZNGMT-CQSZACIVSA-N 1 2 301.434 2.122 20 10 DECDLO CCN1C[C@@H](C)[N@@H+](Cc2ccc3c(c2)CCCN3C)CC1=O ZINC001138359209 796205289 /nfs/dbraw/zinc/20/52/89/796205289.db2.gz NOGYXLLJQZNGMT-CQSZACIVSA-N 1 2 301.434 2.122 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CCC[C@H](CO)CC1 ZINC001139126729 796327549 /nfs/dbraw/zinc/32/75/49/796327549.db2.gz OJWDABGHFYYYSR-ZDUSSCGKSA-N 1 2 317.385 2.401 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CCC[C@H](CO)CC1 ZINC001139126729 796327554 /nfs/dbraw/zinc/32/75/54/796327554.db2.gz OJWDABGHFYYYSR-ZDUSSCGKSA-N 1 2 317.385 2.401 20 10 DECDLO Oc1cc2c(cc1O)C[N@H+](Cc1cn3ccncc3n1)CCC2 ZINC001139699977 796412632 /nfs/dbraw/zinc/41/26/32/796412632.db2.gz SOLQQDLSOGGKIV-UHFFFAOYSA-N 1 2 310.357 2.089 20 10 DECDLO Oc1cc2c(cc1O)C[N@@H+](Cc1cn3ccncc3n1)CCC2 ZINC001139699977 796412634 /nfs/dbraw/zinc/41/26/34/796412634.db2.gz SOLQQDLSOGGKIV-UHFFFAOYSA-N 1 2 310.357 2.089 20 10 DECDLO COC(=O)C[N@H+](Cc1c(O)cc(OC)cc1OC)C1CCCC1 ZINC001141029286 796621237 /nfs/dbraw/zinc/62/12/37/796621237.db2.gz OAJYGIGXCNTVGL-UHFFFAOYSA-N 1 2 323.389 2.327 20 10 DECDLO COC(=O)C[N@@H+](Cc1c(O)cc(OC)cc1OC)C1CCCC1 ZINC001141029286 796621240 /nfs/dbraw/zinc/62/12/40/796621240.db2.gz OAJYGIGXCNTVGL-UHFFFAOYSA-N 1 2 323.389 2.327 20 10 DECDLO CC1(C)C(=O)NCC[N@H+]1Cc1cc2c3c(c1)CCCN3CCC2 ZINC001141076460 796632852 /nfs/dbraw/zinc/63/28/52/796632852.db2.gz SKHPZMZOPYJTAC-UHFFFAOYSA-N 1 2 313.445 2.096 20 10 DECDLO CC1(C)C(=O)NCC[N@@H+]1Cc1cc2c3c(c1)CCCN3CCC2 ZINC001141076460 796632858 /nfs/dbraw/zinc/63/28/58/796632858.db2.gz SKHPZMZOPYJTAC-UHFFFAOYSA-N 1 2 313.445 2.096 20 10 DECDLO Cc1cc(C)c(CNc2cc(-n3cncn3)nc(C)[nH+]2)c(O)c1 ZINC001160811483 798744416 /nfs/dbraw/zinc/74/44/16/798744416.db2.gz ODPIKQVHPVLNNX-UHFFFAOYSA-N 1 2 310.361 2.300 20 10 DECDLO O=C(Cc1ccc(-n2cc[nH+]c2)cc1)NCc1ccc(O)cc1O ZINC001162279174 799048353 /nfs/dbraw/zinc/04/83/53/799048353.db2.gz ULCALKLIBBOIOC-UHFFFAOYSA-N 1 2 323.352 2.142 20 10 DECDLO COC(=O)C[C@H]1COCC[N@@H+]1Cc1ccc(N2CCCC2)cc1 ZINC001204328809 800205120 /nfs/dbraw/zinc/20/51/20/800205120.db2.gz OGBUAOYWVIGJAN-KRWDZBQOSA-N 1 2 318.417 2.051 20 10 DECDLO COC(=O)C[C@H]1COCC[N@H+]1Cc1ccc(N2CCCC2)cc1 ZINC001204328809 800205124 /nfs/dbraw/zinc/20/51/24/800205124.db2.gz OGBUAOYWVIGJAN-KRWDZBQOSA-N 1 2 318.417 2.051 20 10 DECDLO COc1cc(C[N@@H+]2CCc3nc(C)sc3C2)cc(O)c1O ZINC001204345135 800207078 /nfs/dbraw/zinc/20/70/78/800207078.db2.gz MJMLGQJMWRYFNG-UHFFFAOYSA-N 1 2 306.387 2.430 20 10 DECDLO COc1cc(C[N@H+]2CCc3nc(C)sc3C2)cc(O)c1O ZINC001204345135 800207079 /nfs/dbraw/zinc/20/70/79/800207079.db2.gz MJMLGQJMWRYFNG-UHFFFAOYSA-N 1 2 306.387 2.430 20 10 DECDLO CCc1nccc(C[NH+]2CCN(c3ccc(OC)cc3)CC2)n1 ZINC001207083442 800678310 /nfs/dbraw/zinc/67/83/10/800678310.db2.gz ZJQKEUZSGMLZBG-UHFFFAOYSA-N 1 2 312.417 2.370 20 10 DECDLO COc1cc(O)c(C[N@@H+]2CCc3c(cnn3C)C2)cc1Cl ZINC001232269276 801834841 /nfs/dbraw/zinc/83/48/41/801834841.db2.gz UPAGMSJPSHLYHH-UHFFFAOYSA-N 1 2 307.781 2.346 20 10 DECDLO COc1cc(O)c(C[N@H+]2CCc3c(cnn3C)C2)cc1Cl ZINC001232269276 801834844 /nfs/dbraw/zinc/83/48/44/801834844.db2.gz UPAGMSJPSHLYHH-UHFFFAOYSA-N 1 2 307.781 2.346 20 10 DECDLO COc1cc(O)c(CN2CC([N@@H+]3CC[C@H](F)C3)C2)cc1Cl ZINC001232269881 801835943 /nfs/dbraw/zinc/83/59/43/801835943.db2.gz LVNWUVDEUPIQQO-NSHDSACASA-N 1 2 314.788 2.282 20 10 DECDLO COc1cc(O)c(CN2CC([N@H+]3CC[C@H](F)C3)C2)cc1Cl ZINC001232269881 801835948 /nfs/dbraw/zinc/83/59/48/801835948.db2.gz LVNWUVDEUPIQQO-NSHDSACASA-N 1 2 314.788 2.282 20 10 DECDLO CCOC(=O)c1nc[nH]c1C[N@H+](CC)Cc1ccccc1O ZINC001232917166 801982136 /nfs/dbraw/zinc/98/21/36/801982136.db2.gz PKWFXQYZHHSPRI-UHFFFAOYSA-N 1 2 303.362 2.314 20 10 DECDLO CCOC(=O)c1nc[nH]c1C[N@@H+](CC)Cc1ccccc1O ZINC001232917166 801982142 /nfs/dbraw/zinc/98/21/42/801982142.db2.gz PKWFXQYZHHSPRI-UHFFFAOYSA-N 1 2 303.362 2.314 20 10 DECDLO CCNC(=O)OC1CC[NH+](Cc2ccc(F)c(F)c2O)CC1 ZINC001233078999 802021966 /nfs/dbraw/zinc/02/19/66/802021966.db2.gz RRYMDJFAGCXDFJ-UHFFFAOYSA-N 1 2 314.332 2.381 20 10 DECDLO COc1cc(Cl)cc(C[N@@H+]2CC[C@](O)(CF)[C@@H](F)C2)c1O ZINC001233288088 802064399 /nfs/dbraw/zinc/06/43/99/802064399.db2.gz VJQVXWAGSUDNOO-JSGCOSHPSA-N 1 2 321.751 2.299 20 10 DECDLO COc1cc(Cl)cc(C[N@H+]2CC[C@](O)(CF)[C@@H](F)C2)c1O ZINC001233288088 802064401 /nfs/dbraw/zinc/06/44/01/802064401.db2.gz VJQVXWAGSUDNOO-JSGCOSHPSA-N 1 2 321.751 2.299 20 10 DECDLO COC(=O)C[C@@H]1C[N@H+](Cc2cc(C(C)(C)C)ccc2O)CCO1 ZINC001233286379 802065286 /nfs/dbraw/zinc/06/52/86/802065286.db2.gz RFEWMMMWILKLEW-OAHLLOKOSA-N 1 2 321.417 2.454 20 10 DECDLO COC(=O)C[C@@H]1C[N@@H+](Cc2cc(C(C)(C)C)ccc2O)CCO1 ZINC001233286379 802065296 /nfs/dbraw/zinc/06/52/96/802065296.db2.gz RFEWMMMWILKLEW-OAHLLOKOSA-N 1 2 321.417 2.454 20 10 DECDLO C[C@H](C[C@@H]1CCOC1)[NH2+][C@H](C)c1cccc(-c2nn[nH]n2)c1O ZINC001603465040 1069972636 /nfs/dbraw/zinc/97/26/36/1069972636.db2.gz CWKYVHHFTORWGR-UTUOFQBUSA-N 1 2 317.393 2.038 20 10 DECDLO C[C@H](C[C@H]1CCOC1)[NH2+][C@H](C)c1cccc(-c2nn[nH]n2)c1O ZINC001603465038 1069972798 /nfs/dbraw/zinc/97/27/98/1069972798.db2.gz CWKYVHHFTORWGR-IJLUTSLNSA-N 1 2 317.393 2.038 20 10 DECDLO C[C@H]([NH2+]C[C@H]1CCO[C@H](C)C1)c1cccc(-c2nn[nH]n2)c1O ZINC001603851268 1070121451 /nfs/dbraw/zinc/12/14/51/1070121451.db2.gz WGHCEJLFKNVYGA-WOPDTQHZSA-N 1 2 317.393 2.038 20 10 DECDLO CCC(CC)[C@H](O)C[NH2+][C@@H](C)c1cccc(-c2nn[nH]n2)c1O ZINC001604023734 1070178900 /nfs/dbraw/zinc/17/89/00/1070178900.db2.gz ZXKLKHYXQDHEQJ-IINYFYTJSA-N 1 2 319.409 2.020 20 10 DECDLO CC(C)C[C@@H](C(=O)NCc1cc(O)ccc1O)n1cc[nH+]c1 ZINC001471661985 1060265411 /nfs/dbraw/zinc/26/54/11/1060265411.db2.gz JRKBPPCBBLWHTC-AWEZNQCLSA-N 1 2 303.362 2.198 20 10 DECDLO CN(Cc1ccc(N2CCCC2)cc1)C(=O)C[C@H]([NH3+])C(F)F ZINC001578489737 1067118115 /nfs/dbraw/zinc/11/81/15/1067118115.db2.gz IVDZTFRAPWGFKB-AWEZNQCLSA-N 1 2 311.376 2.228 20 10 DECDLO Cc1cccn2cc(CC(=O)N3Cc4cccc(O)c4C3)[nH+]c12 ZINC001643168592 1078787922 /nfs/dbraw/zinc/78/79/22/1078787922.db2.gz GSLYOIQAYOJWOT-UHFFFAOYSA-N 1 2 307.353 2.433 20 10 DECDLO Nc1ccc(CNC(=O)C[C@H](n2cc[nH+]c2)C(F)(F)F)cc1 ZINC001515331670 1068863563 /nfs/dbraw/zinc/86/35/63/1068863563.db2.gz GBQWINSNQGUTGR-LBPRGKRZSA-N 1 2 312.295 2.275 20 10 DECDLO C[C@@H](NC(=O)CCc1[nH+]ccn1C)c1ccc(N(C)C)cc1 ZINC001521334426 1069233840 /nfs/dbraw/zinc/23/38/40/1069233840.db2.gz ANSCGZAQLCCHID-CYBMUJFWSA-N 1 2 300.406 2.296 20 10 DECDLO Oc1cccc(F)c1C[NH2+]Cc1cn(Cc2ccccc2)nn1 ZINC001561015744 1075149353 /nfs/dbraw/zinc/14/93/53/1075149353.db2.gz GAARDYGJALRSRU-UHFFFAOYSA-N 1 2 312.348 2.461 20 10 DECDLO C[C@H]([NH2+][C@@H](C)[C@@H]1CCCOC1)c1cccc(-c2nn[nH]n2)c1O ZINC001589949969 1076532323 /nfs/dbraw/zinc/53/23/23/1076532323.db2.gz PDXMTHXRNWOBBM-SDDRHHMPSA-N 1 2 317.393 2.038 20 10 DECDLO C[C@@H]([NH2+][C@@H](C)c1cscn1)c1cccc(-c2nn[nH]n2)c1O ZINC001589952293 1076533928 /nfs/dbraw/zinc/53/39/28/1076533928.db2.gz MUJIMMGBWBFBPJ-BDAKNGLRSA-N 1 2 316.390 2.441 20 10 DECDLO CSC(C)(C)C[NH2+][C@H](C)c1cccc(-c2nn[nH]n2)c1O ZINC001591685019 1076770778 /nfs/dbraw/zinc/77/07/78/1076770778.db2.gz MOPBNZGLUNAFSI-SECBINFHSA-N 1 2 307.423 2.365 20 10 DECDLO O=C(NCC1C[NH+](Cc2ccc(Cl)cc2O)C1)C(F)(F)F ZINC001658775913 1080216814 /nfs/dbraw/zinc/21/68/14/1080216814.db2.gz PIWPOWXEZWDPEG-UHFFFAOYSA-N 1 2 322.714 2.156 20 10 DECDLO OC[C@@]1(F)CC[N@H+](Cc2c(O)cccc2OC(F)(F)F)C1 ZINC001237120704 1080443717 /nfs/dbraw/zinc/44/37/17/1080443717.db2.gz RNGFTQZMIZDWBI-GFCCVEGCSA-N 1 2 309.259 2.197 20 10 DECDLO OC[C@@]1(F)CC[N@@H+](Cc2c(O)cccc2OC(F)(F)F)C1 ZINC001237120704 1080443722 /nfs/dbraw/zinc/44/37/22/1080443722.db2.gz RNGFTQZMIZDWBI-GFCCVEGCSA-N 1 2 309.259 2.197 20 10 DECDLO OCc1ncn2c1C[N@H+](Cc1cc3ccccc3cc1O)CC2 ZINC001235508411 1084450818 /nfs/dbraw/zinc/45/08/18/1084450818.db2.gz KUVMBXLFEYRPQN-UHFFFAOYSA-N 1 2 309.369 2.250 20 10 DECDLO OCc1ncn2c1C[N@@H+](Cc1cc3ccccc3cc1O)CC2 ZINC001235508411 1084450822 /nfs/dbraw/zinc/45/08/22/1084450822.db2.gz KUVMBXLFEYRPQN-UHFFFAOYSA-N 1 2 309.369 2.250 20 10 DECDLO CCOC(=O)[C@@H]1C[N@H+](Cc2ccc(C(C)(C)C)cc2O)CCO1 ZINC001235684750 1084498668 /nfs/dbraw/zinc/49/86/68/1084498668.db2.gz JREGPKZCPBBVBH-INIZCTEOSA-N 1 2 321.417 2.454 20 10 DECDLO CCOC(=O)[C@@H]1C[N@@H+](Cc2ccc(C(C)(C)C)cc2O)CCO1 ZINC001235684750 1084498673 /nfs/dbraw/zinc/49/86/73/1084498673.db2.gz JREGPKZCPBBVBH-INIZCTEOSA-N 1 2 321.417 2.454 20 10 DECDLO CN1CC[N@H+](Cc2cc(Cl)c(Cl)cc2O)CCC1=O ZINC001236796531 1138430166 /nfs/dbraw/zinc/43/01/66/1138430166.db2.gz PZIWGGDZAIIROH-UHFFFAOYSA-N 1 2 303.189 2.363 20 10 DECDLO CN1CC[N@@H+](Cc2cc(Cl)c(Cl)cc2O)CCC1=O ZINC001236796531 1138430172 /nfs/dbraw/zinc/43/01/72/1138430172.db2.gz PZIWGGDZAIIROH-UHFFFAOYSA-N 1 2 303.189 2.363 20 10 DECDLO CN1CCC2(C[NH+](Cc3cc(Cl)c(Cl)cc3O)C2)C1=O ZINC001236805201 1138433903 /nfs/dbraw/zinc/43/39/03/1138433903.db2.gz XAVZDECUILAFJL-UHFFFAOYSA-N 1 2 315.200 2.363 20 10 DECDLO CCOC(=O)C[N@H+](C)Cc1ccc(OCC(F)(F)F)cc1O ZINC001237053438 1138490813 /nfs/dbraw/zinc/49/08/13/1138490813.db2.gz LPYUMYGIOLKXKC-UHFFFAOYSA-N 1 2 321.295 2.328 20 10 DECDLO CCOC(=O)C[N@@H+](C)Cc1ccc(OCC(F)(F)F)cc1O ZINC001237053438 1138490820 /nfs/dbraw/zinc/49/08/20/1138490820.db2.gz LPYUMYGIOLKXKC-UHFFFAOYSA-N 1 2 321.295 2.328 20 10 DECDLO CN(C)C(=O)[C@@H]1CCC[N@H+](Cc2cc(Cl)cc(F)c2O)C1 ZINC001237621193 1138719684 /nfs/dbraw/zinc/71/96/84/1138719684.db2.gz WLCQFELZOQGZDZ-SNVBAGLBSA-N 1 2 314.788 2.485 20 10 DECDLO CN(C)C(=O)[C@@H]1CCC[N@@H+](Cc2cc(Cl)cc(F)c2O)C1 ZINC001237621193 1138719688 /nfs/dbraw/zinc/71/96/88/1138719688.db2.gz WLCQFELZOQGZDZ-SNVBAGLBSA-N 1 2 314.788 2.485 20 10 DECDLO CCOC(=O)[C@H]1[C@@H]2C[N@@H+](Cc3cc(Cl)cc(F)c3O)C[C@@H]21 ZINC001237622953 1138720481 /nfs/dbraw/zinc/72/04/81/1138720481.db2.gz FZSWGKKEQNFKIE-PJXYFTJBSA-N 1 2 313.756 2.426 20 10 DECDLO CCOC(=O)[C@H]1[C@@H]2C[N@H+](Cc3cc(Cl)cc(F)c3O)C[C@@H]21 ZINC001237622953 1138720486 /nfs/dbraw/zinc/72/04/86/1138720486.db2.gz FZSWGKKEQNFKIE-PJXYFTJBSA-N 1 2 313.756 2.426 20 10 DECDLO CC1C[NH+](Cc2cccc(I)c2O)C1 ZINC001237774927 1138785960 /nfs/dbraw/zinc/78/59/60/1138785960.db2.gz ARGUPDSZZCKSMJ-UHFFFAOYSA-N 1 2 303.143 2.449 20 10 DECDLO CC(=O)N[C@@H]1CCC[N@H+](Cc2cc(F)cc(Cl)c2O)C1 ZINC001237800915 1138792645 /nfs/dbraw/zinc/79/26/45/1138792645.db2.gz DRQWBDXZLYJQKT-GFCCVEGCSA-N 1 2 300.761 2.285 20 10 DECDLO CC(=O)N[C@@H]1CCC[N@@H+](Cc2cc(F)cc(Cl)c2O)C1 ZINC001237800915 1138792654 /nfs/dbraw/zinc/79/26/54/1138792654.db2.gz DRQWBDXZLYJQKT-GFCCVEGCSA-N 1 2 300.761 2.285 20 10 DECDLO COC(=O)[C@H](Cc1ccc(O)c(O)c1)[NH2+][C@@H]1CCC[C@H](C)C1 ZINC001258806749 1144042829 /nfs/dbraw/zinc/04/28/29/1144042829.db2.gz BKJXDHROJVTYLU-YUTCNCBUSA-N 1 2 307.390 2.350 20 10 DECDLO C[C@H]([NH2+]CC(C)(C)N1CCOCC1)c1ccc(F)c(F)c1O ZINC000191184407 299277104 /nfs/dbraw/zinc/27/71/04/299277104.db2.gz SZWGLNLDDHUQRK-NSHDSACASA-N 1 2 314.376 2.432 20 10 DECDLO C[C@@H]([NH2+]C[C@H](C)CN1CCOCC1)c1ccc(F)c(F)c1O ZINC000187728754 296130985 /nfs/dbraw/zinc/13/09/85/296130985.db2.gz NEFHIGQEZMVFBO-NWDGAFQWSA-N 1 2 314.376 2.289 20 10 DECDLO COC[C@@H]1C[N@H+](Cc2cc(Br)ccc2O)CCO1 ZINC000093528197 193264373 /nfs/dbraw/zinc/26/43/73/193264373.db2.gz CYUIEPSJFIXMON-LBPRGKRZSA-N 1 2 316.195 2.002 20 10 DECDLO COC[C@@H]1C[N@@H+](Cc2cc(Br)ccc2O)CCO1 ZINC000093528197 193264374 /nfs/dbraw/zinc/26/43/74/193264374.db2.gz CYUIEPSJFIXMON-LBPRGKRZSA-N 1 2 316.195 2.002 20 10 DECDLO C[C@@H]([C@H](C)S(C)(=O)=O)[N@H+](C)Cc1cccc(Cl)c1O ZINC000180260103 296220647 /nfs/dbraw/zinc/22/06/47/296220647.db2.gz JRIPAZJWOJWVAY-UWVGGRQHSA-N 1 2 305.827 2.299 20 10 DECDLO C[C@@H]([C@H](C)S(C)(=O)=O)[N@@H+](C)Cc1cccc(Cl)c1O ZINC000180260103 296220648 /nfs/dbraw/zinc/22/06/48/296220648.db2.gz JRIPAZJWOJWVAY-UWVGGRQHSA-N 1 2 305.827 2.299 20 10 DECDLO O=C1CCCN1[C@H]1CC[N@@H+](Cc2cc(Cl)c(F)cc2O)C1 ZINC000294706463 224181532 /nfs/dbraw/zinc/18/15/32/224181532.db2.gz OMINXADSLJTKFB-NSHDSACASA-N 1 2 312.772 2.381 20 10 DECDLO O=C1CCCN1[C@H]1CC[N@H+](Cc2cc(Cl)c(F)cc2O)C1 ZINC000294706463 224181535 /nfs/dbraw/zinc/18/15/35/224181535.db2.gz OMINXADSLJTKFB-NSHDSACASA-N 1 2 312.772 2.381 20 10 DECDLO COC(=O)c1ccc(O)c([C@H](C)N[C@@H]2CC[N@@H+]3CCCC[C@H]23)c1 ZINC000273420881 130119599 /nfs/dbraw/zinc/11/95/99/130119599.db2.gz RZQADRJJSFZPRI-APHBMKBZSA-N 1 2 318.417 2.456 20 10 DECDLO COC(=O)c1ccc(O)c([C@H](C)N[C@@H]2CC[N@H+]3CCCC[C@H]23)c1 ZINC000273420881 130119600 /nfs/dbraw/zinc/11/96/00/130119600.db2.gz RZQADRJJSFZPRI-APHBMKBZSA-N 1 2 318.417 2.456 20 10 DECDLO Cc1cc(Cl)cc(C[N@@H+]2CCC[C@H](S(C)(=O)=O)C2)c1O ZINC000274182282 130214087 /nfs/dbraw/zinc/21/40/87/130214087.db2.gz YGYMDPNUJXJQJC-ZDUSSCGKSA-N 1 2 317.838 2.363 20 10 DECDLO Cc1cc(Cl)cc(C[N@H+]2CCC[C@H](S(C)(=O)=O)C2)c1O ZINC000274182282 130214088 /nfs/dbraw/zinc/21/40/88/130214088.db2.gz YGYMDPNUJXJQJC-ZDUSSCGKSA-N 1 2 317.838 2.363 20 10 DECDLO COc1ccc(N2CC[NH+](Cc3cnccc3OC)CC2)cc1 ZINC000286664441 131245317 /nfs/dbraw/zinc/24/53/17/131245317.db2.gz ACAJITIAAAUKLC-UHFFFAOYSA-N 1 2 313.401 2.421 20 10 DECDLO Cc1cc(C[N@@H+](C)Cc2ccc(N3CCOCC3)cc2)no1 ZINC000071004857 402268524 /nfs/dbraw/zinc/26/85/24/402268524.db2.gz YPVQEBLFXQZHGL-UHFFFAOYSA-N 1 2 301.390 2.452 20 10 DECDLO Cc1cc(C[N@H+](C)Cc2ccc(N3CCOCC3)cc2)no1 ZINC000071004857 402268527 /nfs/dbraw/zinc/26/85/27/402268527.db2.gz YPVQEBLFXQZHGL-UHFFFAOYSA-N 1 2 301.390 2.452 20 10 DECDLO CS(=O)(=O)CCCCC[NH2+]Cc1cccc(Cl)c1O ZINC000187692253 402508895 /nfs/dbraw/zinc/50/88/95/402508895.db2.gz GDHJVXQDORASKL-UHFFFAOYSA-N 1 2 305.827 2.350 20 10 DECDLO CS(=O)(=O)CC1CC[NH+](Cc2cccc(Cl)c2O)CC1 ZINC000292812823 403378652 /nfs/dbraw/zinc/37/86/52/403378652.db2.gz OYEHXNSUIRAKEC-UHFFFAOYSA-N 1 2 317.838 2.302 20 10 DECDLO COC(=O)[C@@]1(F)CC[N@H+](Cc2cc(Cl)c(F)cc2O)C1 ZINC000294377488 403717631 /nfs/dbraw/zinc/71/76/31/403717631.db2.gz UQJSBRGWWDBCJM-CYBMUJFWSA-N 1 2 305.708 2.272 20 10 DECDLO COC(=O)[C@@]1(F)CC[N@@H+](Cc2cc(Cl)c(F)cc2O)C1 ZINC000294377488 403717634 /nfs/dbraw/zinc/71/76/34/403717634.db2.gz UQJSBRGWWDBCJM-CYBMUJFWSA-N 1 2 305.708 2.272 20 10 DECDLO COc1c(O)c(C[N@@H+]2CCC[C@@H]2c2ncc[nH]2)ccc1[N+](=O)[O-] ZINC000364762116 404530559 /nfs/dbraw/zinc/53/05/59/404530559.db2.gz YCIQAUADUZNCKW-GFCCVEGCSA-N 1 2 318.333 2.369 20 10 DECDLO COc1c(O)c(C[N@H+]2CCC[C@@H]2c2ncc[nH]2)ccc1[N+](=O)[O-] ZINC000364762116 404530568 /nfs/dbraw/zinc/53/05/68/404530568.db2.gz YCIQAUADUZNCKW-GFCCVEGCSA-N 1 2 318.333 2.369 20 10 DECDLO COCC[C@H]1COCC[N@H+]1Cc1cc(Cl)cc(OC)c1O ZINC000365849939 404732556 /nfs/dbraw/zinc/73/25/56/404732556.db2.gz SYWVORJEHZFKPE-ZDUSSCGKSA-N 1 2 315.797 2.292 20 10 DECDLO CC(=O)c1cc(Cl)cc(C[N@H+](C)[C@@H]2CCCCNC2=O)c1O ZINC000365883441 404738761 /nfs/dbraw/zinc/73/87/61/404738761.db2.gz RENHNZHCELOCRN-CQSZACIVSA-N 1 2 324.808 2.349 20 10 DECDLO Oc1c(Cl)cc(Cl)cc1C[N@@H+]1CCN2CCOC[C@@H]2C1 ZINC000375239610 404719627 /nfs/dbraw/zinc/71/96/27/404719627.db2.gz VDJPCJKGSVMMAQ-LBPRGKRZSA-N 1 2 317.216 2.215 20 10 DECDLO Oc1c(Cl)cc(Cl)cc1C[N@H+]1CCN2CCOC[C@@H]2C1 ZINC000375239610 404719630 /nfs/dbraw/zinc/71/96/30/404719630.db2.gz VDJPCJKGSVMMAQ-LBPRGKRZSA-N 1 2 317.216 2.215 20 10 DECDLO C[C@H]1OCC[C@]1(O)C[NH2+]Cc1cc(Cl)cc(Cl)c1O ZINC000227970922 225208729 /nfs/dbraw/zinc/20/87/29/225208729.db2.gz ZJTRACSXQLOACR-OQPBUACISA-N 1 2 306.189 2.329 20 10 DECDLO Cc1c2ccccc2n(C)c1CNC(=O)CCc1c[nH+]cn1C ZINC000530310132 340787207 /nfs/dbraw/zinc/78/72/07/340787207.db2.gz UDRSWGJZNSKEPY-UHFFFAOYSA-N 1 2 310.401 2.469 20 10 DECDLO CN(C)c1ccc(/C=C/C[N@@H+]2CCOC[C@]23CCOC3)cc1 ZINC000835052089 649872551 /nfs/dbraw/zinc/87/25/51/649872551.db2.gz NTJVSLNZGXACMP-OAJJDEHYSA-N 1 2 302.418 2.257 20 10 DECDLO CN(C)c1ccc(/C=C/C[N@H+]2CCOC[C@]23CCOC3)cc1 ZINC000835052089 649872555 /nfs/dbraw/zinc/87/25/55/649872555.db2.gz NTJVSLNZGXACMP-OAJJDEHYSA-N 1 2 302.418 2.257 20 10 DECDLO CCC[N@H+](Cc1cc(F)cc(F)c1O)[C@@H]1CCS(=O)(=O)C1 ZINC000893894412 636062143 /nfs/dbraw/zinc/06/21/43/636062143.db2.gz XVIKCKRXEOLCLB-GFCCVEGCSA-N 1 2 319.373 2.070 20 10 DECDLO CCC[N@@H+](Cc1cc(F)cc(F)c1O)[C@@H]1CCS(=O)(=O)C1 ZINC000893894412 636062144 /nfs/dbraw/zinc/06/21/44/636062144.db2.gz XVIKCKRXEOLCLB-GFCCVEGCSA-N 1 2 319.373 2.070 20 10 DECDLO O=C(c1cc2cc(O)c(O)cc2s1)N1CC[NH+](C2CC2)CC1 ZINC000895940674 638278067 /nfs/dbraw/zinc/27/80/67/638278067.db2.gz WLKGGQZLBUQSTR-UHFFFAOYSA-N 1 2 318.398 2.233 20 10 DECDLO O=C1NCCC2(CC[NH+](Cc3cc(F)cc(F)c3O)CC2)O1 ZINC000897010662 639130708 /nfs/dbraw/zinc/13/07/08/639130708.db2.gz OYPOZFUVXVFOAD-UHFFFAOYSA-N 1 2 312.316 2.135 20 10 DECDLO C[C@H](CN1CCOCC1)[NH2+][C@H](C)c1cc(F)cc(F)c1O ZINC000756412991 639659684 /nfs/dbraw/zinc/65/96/84/639659684.db2.gz BDDRRRPBXPAOGA-GHMZBOCLSA-N 1 2 300.349 2.042 20 10 DECDLO C[C@@H]([NH2+][C@@H](C)c1cc(F)cc(F)c1O)[C@H](C)N1CCOCC1 ZINC000756542611 639671289 /nfs/dbraw/zinc/67/12/89/639671289.db2.gz KPIAESAFFIVCFX-WOPDTQHZSA-N 1 2 314.376 2.430 20 10 DECDLO CCC[C@@H]1CN(C(=O)C2=CC(=O)CS2)CC[N@@H+]1CCOC ZINC000767153699 640949919 /nfs/dbraw/zinc/94/99/19/640949919.db2.gz UQHZPEKAXPEIRA-GFCCVEGCSA-N 1 2 312.435 2.027 20 10 DECDLO CCC[C@@H]1CN(C(=O)C2=CC(=O)CS2)CC[N@H+]1CCOC ZINC000767153699 640949927 /nfs/dbraw/zinc/94/99/27/640949927.db2.gz UQHZPEKAXPEIRA-GFCCVEGCSA-N 1 2 312.435 2.027 20 10 DECDLO COc1c(O)c(C[NH2+]Cc2csc(C)n2)ccc1[N+](=O)[O-] ZINC000774948136 641985135 /nfs/dbraw/zinc/98/51/35/641985135.db2.gz GVFGGNXTCNSFGV-UHFFFAOYSA-N 1 2 309.347 2.364 20 10 DECDLO NC(=O)CC1CC[NH+](Cc2cc(Cl)cc(F)c2O)CC1 ZINC000775650165 642073413 /nfs/dbraw/zinc/07/34/13/642073413.db2.gz QYTGIFUXMHMULM-UHFFFAOYSA-N 1 2 300.761 2.272 20 10 DECDLO COCCc1noc(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)n1 ZINC000775837405 642104135 /nfs/dbraw/zinc/10/41/35/642104135.db2.gz SGLGVAHFFCDWBS-LBPRGKRZSA-N 1 2 304.394 2.175 20 10 DECDLO CS(=O)(=O)CCCCC[NH2+]Cc1cc(Cl)cc(F)c1O ZINC000776014262 642122525 /nfs/dbraw/zinc/12/25/25/642122525.db2.gz NDOSCUUEDMZYEP-UHFFFAOYSA-N 1 2 323.817 2.489 20 10 DECDLO O=C1NCC2(CC[NH+](Cc3cc(Cl)cc(F)c3O)CC2)O1 ZINC000783721827 643042836 /nfs/dbraw/zinc/04/28/36/643042836.db2.gz QDPOIKNPHAGWJK-UHFFFAOYSA-N 1 2 314.744 2.259 20 10 DECDLO C[C@@H]([NH2+]CCN1CCCOCC1)c1cc(F)cc(F)c1O ZINC000903227707 643298877 /nfs/dbraw/zinc/29/88/77/643298877.db2.gz NBIMQUYJSSWBAK-LLVKDONJSA-N 1 2 300.349 2.043 20 10 DECDLO C[C@H]([NH2+]CCC1(O)CCOCC1)c1cc(F)cc(F)c1O ZINC000797029801 644828577 /nfs/dbraw/zinc/82/85/77/644828577.db2.gz AESROKITIDIPRE-JTQLQIEISA-N 1 2 301.333 2.253 20 10 DECDLO O=C1N[C@H]2C[N@H+](Cc3cc(Cl)cc(F)c3O)CC[C@@H]2CO1 ZINC000843434905 650974352 /nfs/dbraw/zinc/97/43/52/650974352.db2.gz UTQRCRARBKINCU-PELKAZGASA-N 1 2 314.744 2.115 20 10 DECDLO O=C1N[C@H]2C[N@@H+](Cc3cc(Cl)cc(F)c3O)CC[C@@H]2CO1 ZINC000843434905 650974355 /nfs/dbraw/zinc/97/43/55/650974355.db2.gz UTQRCRARBKINCU-PELKAZGASA-N 1 2 314.744 2.115 20 10 DECDLO COc1cc(C[N@H+]2CC(=O)N(C)[C@@H](C)C2)c(O)c(C(C)(C)C)c1 ZINC000799957076 645237390 /nfs/dbraw/zinc/23/73/90/645237390.db2.gz ZHYDJUJGTNGSOJ-LBPRGKRZSA-N 1 2 320.433 2.361 20 10 DECDLO COc1cc(C[N@@H+]2CC(=O)N(C)[C@@H](C)C2)c(O)c(C(C)(C)C)c1 ZINC000799957076 645237393 /nfs/dbraw/zinc/23/73/93/645237393.db2.gz ZHYDJUJGTNGSOJ-LBPRGKRZSA-N 1 2 320.433 2.361 20 10 DECDLO Cc1cn(C(C)(C)C(=O)NCc2ccc3cccnc3c2O)c[nH+]1 ZINC000911263243 645668687 /nfs/dbraw/zinc/66/86/87/645668687.db2.gz VRTYDYQPQFTCNZ-UHFFFAOYSA-N 1 2 324.384 2.497 20 10 DECDLO CC(C)C(=O)NCCC[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000816558777 647152378 /nfs/dbraw/zinc/15/23/78/647152378.db2.gz LHNWJAKYLIDJRF-UHFFFAOYSA-N 1 2 302.777 2.437 20 10 DECDLO O=C(NCCCNc1cccc[nH+]1)NCc1c(O)cccc1F ZINC000914153628 647176218 /nfs/dbraw/zinc/17/62/18/647176218.db2.gz GMQRNQSBANQGCO-UHFFFAOYSA-N 1 2 318.352 2.228 20 10 DECDLO C[C@H](NC1C[NH2+]C1)c1cc(Br)cc(Cl)c1O ZINC000817955766 647392979 /nfs/dbraw/zinc/39/29/79/647392979.db2.gz HIKJURGUXNWKOX-LURJTMIESA-N 1 2 305.603 2.431 20 10 DECDLO CS(=O)(=O)C[C@H]1CCCC[N@@H+]1Cc1cc(Cl)ccc1O ZINC000824914770 648672019 /nfs/dbraw/zinc/67/20/19/648672019.db2.gz YRKRQABWKHIKMY-CYBMUJFWSA-N 1 2 317.838 2.445 20 10 DECDLO CS(=O)(=O)C[C@H]1CCCC[N@H+]1Cc1cc(Cl)ccc1O ZINC000824914770 648672023 /nfs/dbraw/zinc/67/20/23/648672023.db2.gz YRKRQABWKHIKMY-CYBMUJFWSA-N 1 2 317.838 2.445 20 10 DECDLO Cc1cc(C[N@H+]2CCN(C)C(=O)C2)ccc1N1CCCCC1 ZINC000827878191 649098699 /nfs/dbraw/zinc/09/86/99/649098699.db2.gz PIESPNLMEOJEBF-UHFFFAOYSA-N 1 2 301.434 2.259 20 10 DECDLO Cc1cc(C[N@@H+]2CCN(C)C(=O)C2)ccc1N1CCCCC1 ZINC000827878191 649098702 /nfs/dbraw/zinc/09/87/02/649098702.db2.gz PIESPNLMEOJEBF-UHFFFAOYSA-N 1 2 301.434 2.259 20 10 DECDLO CC(=O)c1cc(Cl)cc(C[N@@H+]2CC[C@](O)(C(F)F)C2)c1O ZINC000831175009 649548704 /nfs/dbraw/zinc/54/87/04/649548704.db2.gz CCUULUDYZNUUCI-CQSZACIVSA-N 1 2 319.735 2.450 20 10 DECDLO CC(=O)c1cc(Cl)cc(C[N@H+]2CC[C@](O)(C(F)F)C2)c1O ZINC000831175009 649548711 /nfs/dbraw/zinc/54/87/11/649548711.db2.gz CCUULUDYZNUUCI-CQSZACIVSA-N 1 2 319.735 2.450 20 10 DECDLO CCCCCNC(=O)C[NH+]1CCN(c2ccc(OC)cc2)CC1 ZINC000007354802 651885671 /nfs/dbraw/zinc/88/56/71/651885671.db2.gz FMPNIDMCBBECPB-UHFFFAOYSA-N 1 2 319.449 2.124 20 10 DECDLO CC(=O)c1cc(Cl)cc(C[N@H+](C)C[C@@H]2COCCO2)c1O ZINC000852495297 652409643 /nfs/dbraw/zinc/40/96/43/652409643.db2.gz IVVZVRQLKIKZFC-CYBMUJFWSA-N 1 2 313.781 2.095 20 10 DECDLO CNC(=O)C(C)(C)C[NH2+]Cc1cccc(Br)c1O ZINC000120325323 684095038 /nfs/dbraw/zinc/09/50/38/684095038.db2.gz NZCIPCGTZCPSLT-UHFFFAOYSA-N 1 2 315.211 2.017 20 10 DECDLO CCN(Cc1ccc(N(C)C)cc1)C(=O)CCc1c[nH]c[nH+]1 ZINC000188784123 684363433 /nfs/dbraw/zinc/36/34/33/684363433.db2.gz MEYSJCLDUYCRDL-UHFFFAOYSA-N 1 2 300.406 2.457 20 10 DECDLO CCN(Cc1ccc(N(C)C)cc1)C(=O)CCc1c[nH+]c[nH]1 ZINC000188784123 684363438 /nfs/dbraw/zinc/36/34/38/684363438.db2.gz MEYSJCLDUYCRDL-UHFFFAOYSA-N 1 2 300.406 2.457 20 10 DECDLO Cc1cc(N(C)C)ccc1C[C@H](C)Nc1nc(C)[nH+]c(N)n1 ZINC000865880844 687366550 /nfs/dbraw/zinc/36/65/50/687366550.db2.gz QHDRXVVYRNLCFB-NSHDSACASA-N 1 2 300.410 2.180 20 10 DECDLO Cc1cc(N(C)C)ccc1C[C@H](C)Nc1nc(N)nc(C)[nH+]1 ZINC000865880844 687366556 /nfs/dbraw/zinc/36/65/56/687366556.db2.gz QHDRXVVYRNLCFB-NSHDSACASA-N 1 2 300.410 2.180 20 10 DECDLO CCOC(=O)C[N@H+](C/C=C(/C)COC)Cc1ccccc1O ZINC000930763786 694235930 /nfs/dbraw/zinc/23/59/30/694235930.db2.gz ODEXBVIFVKKSFD-ZROIWOOFSA-N 1 2 307.390 2.350 20 10 DECDLO CCOC(=O)C[N@@H+](C/C=C(/C)COC)Cc1ccccc1O ZINC000930763786 694235933 /nfs/dbraw/zinc/23/59/33/694235933.db2.gz ODEXBVIFVKKSFD-ZROIWOOFSA-N 1 2 307.390 2.350 20 10 DECDLO C[N@H+](Cc1ccon1)Cc1ccc(N2CCC(O)CC2)cc1 ZINC000876755962 689927752 /nfs/dbraw/zinc/92/77/52/689927752.db2.gz NPAZAZTVUIQILD-UHFFFAOYSA-N 1 2 301.390 2.268 20 10 DECDLO C[N@@H+](Cc1ccon1)Cc1ccc(N2CCC(O)CC2)cc1 ZINC000876755962 689927753 /nfs/dbraw/zinc/92/77/53/689927753.db2.gz NPAZAZTVUIQILD-UHFFFAOYSA-N 1 2 301.390 2.268 20 10 DECDLO CC1(C)C[N@H+](Cc2ccc(F)c(F)c2O)C[C@@]2(CCOC2)O1 ZINC000877492918 690130442 /nfs/dbraw/zinc/13/04/42/690130442.db2.gz XHASXGAQLIODGO-MRXNPFEDSA-N 1 2 313.344 2.440 20 10 DECDLO CC1(C)C[N@@H+](Cc2ccc(F)c(F)c2O)C[C@@]2(CCOC2)O1 ZINC000877492918 690130445 /nfs/dbraw/zinc/13/04/45/690130445.db2.gz XHASXGAQLIODGO-MRXNPFEDSA-N 1 2 313.344 2.440 20 10 DECDLO Oc1c(Cl)cccc1C[NH2+]Cc1nnc(C2CCOCC2)[nH]1 ZINC000877677228 690187381 /nfs/dbraw/zinc/18/73/81/690187381.db2.gz PSGRSOAZMSTQJG-UHFFFAOYSA-N 1 2 322.796 2.348 20 10 DECDLO CCN(C)c1ccc(C[NH+]2CCN(CCCCCO)CC2)cc1 ZINC000931495319 694412912 /nfs/dbraw/zinc/41/29/12/694412912.db2.gz IPCBTCBADKHEIX-UHFFFAOYSA-N 1 2 319.493 2.423 20 10 DECDLO Cn1cc[nH+]c1[C@@H]1CCCN(C(=O)NCc2ccc(N)cc2)C1 ZINC001346738658 1151019226 /nfs/dbraw/zinc/01/92/26/1151019226.db2.gz IVDHTIUSMNSOQS-CQSZACIVSA-N 1 2 313.405 2.092 20 10 DECDLO Cc1cc(C(=O)NCCc2[nH+]ccn2C)c(C)n1-c1ccccn1 ZINC001348074492 1151117868 /nfs/dbraw/zinc/11/78/68/1151117868.db2.gz ARLZXDXFRZWSEM-UHFFFAOYSA-N 1 2 323.400 2.195 20 10 DECDLO COC[C@H]1Cn2nccc2C[N@H+](Cc2cc(F)c(F)cc2O)C1 ZINC001142520542 780790578 /nfs/dbraw/zinc/79/05/78/780790578.db2.gz LJOOWOFYUCFHPU-LLVKDONJSA-N 1 2 323.343 2.145 20 10 DECDLO COC[C@H]1Cn2nccc2C[N@@H+](Cc2cc(F)c(F)cc2O)C1 ZINC001142520542 780790587 /nfs/dbraw/zinc/79/05/87/780790587.db2.gz LJOOWOFYUCFHPU-LLVKDONJSA-N 1 2 323.343 2.145 20 10 DECDLO Cc1nc2n(n1)C[C@@H]([NH2+]Cc1cc(Cl)cc(F)c1O)CC2 ZINC001177631588 794716703 /nfs/dbraw/zinc/71/67/03/794716703.db2.gz QIAPWBCWIPXKQM-NSHDSACASA-N 1 2 310.760 2.189 20 10 DECDLO NC(=O)c1cccc2c1CC[N@H+](Cc1cccc(F)c1O)C2 ZINC001183066232 795800628 /nfs/dbraw/zinc/80/06/28/795800628.db2.gz VWYHUARBXCQWBC-UHFFFAOYSA-N 1 2 300.333 2.189 20 10 DECDLO NC(=O)c1cccc2c1CC[N@@H+](Cc1cccc(F)c1O)C2 ZINC001183066232 795800631 /nfs/dbraw/zinc/80/06/31/795800631.db2.gz VWYHUARBXCQWBC-UHFFFAOYSA-N 1 2 300.333 2.189 20 10 DECDLO COC[C@@H]1C[N@H+](Cc2c(O)cccc2F)Cc2cn(C)nc21 ZINC001137834455 796143954 /nfs/dbraw/zinc/14/39/54/796143954.db2.gz HKNHGDHERJYAPZ-LBPRGKRZSA-N 1 2 305.353 2.011 20 10 DECDLO COC[C@@H]1C[N@@H+](Cc2c(O)cccc2F)Cc2cn(C)nc21 ZINC001137834455 796143957 /nfs/dbraw/zinc/14/39/57/796143957.db2.gz HKNHGDHERJYAPZ-LBPRGKRZSA-N 1 2 305.353 2.011 20 10 DECDLO CCn1cc2c(n1)C[N@@H+](Cc1cccc(F)c1O)C[C@@H]2COC ZINC001138125468 796167968 /nfs/dbraw/zinc/16/79/68/796167968.db2.gz QATJFIWMMYYKMW-CYBMUJFWSA-N 1 2 319.380 2.494 20 10 DECDLO CCn1cc2c(n1)C[N@H+](Cc1cccc(F)c1O)C[C@@H]2COC ZINC001138125468 796167972 /nfs/dbraw/zinc/16/79/72/796167972.db2.gz QATJFIWMMYYKMW-CYBMUJFWSA-N 1 2 319.380 2.494 20 10 DECDLO CC(=O)[C@@H]1CCC[N@@H+]1Cc1c(O)ccc2c(C)cc(=O)oc21 ZINC001139130048 796329797 /nfs/dbraw/zinc/32/97/97/796329797.db2.gz OVUSBYZTPOIXDO-AWEZNQCLSA-N 1 2 301.342 2.360 20 10 DECDLO CC(=O)[C@@H]1CCC[N@H+]1Cc1c(O)ccc2c(C)cc(=O)oc21 ZINC001139130048 796329801 /nfs/dbraw/zinc/32/98/01/796329801.db2.gz OVUSBYZTPOIXDO-AWEZNQCLSA-N 1 2 301.342 2.360 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1C[C@H]2OC[C@@H](C)[C@H]2C1 ZINC001139131979 796330016 /nfs/dbraw/zinc/33/00/16/796330016.db2.gz RDDAVSKVAZZMJY-AXAPSJFSSA-N 1 2 315.369 2.274 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1C[C@H]2OC[C@@H](C)[C@H]2C1 ZINC001139131979 796330022 /nfs/dbraw/zinc/33/00/22/796330022.db2.gz RDDAVSKVAZZMJY-AXAPSJFSSA-N 1 2 315.369 2.274 20 10 DECDLO Cc1ccc(C)n1-c1ccc(O)c(C(=O)NCCn2cc[nH+]c2)c1 ZINC001186825922 796448754 /nfs/dbraw/zinc/44/87/54/796448754.db2.gz IFUAYUPJDNNPLJ-UHFFFAOYSA-N 1 2 324.384 2.426 20 10 DECDLO CSc1ncc(C[N@@H+]2CCc3cccc(O)c3C2)c(N)n1 ZINC001140251237 796496186 /nfs/dbraw/zinc/49/61/86/796496186.db2.gz CGMWZFRTKRCRMU-UHFFFAOYSA-N 1 2 302.403 2.045 20 10 DECDLO CSc1ncc(C[N@H+]2CCc3cccc(O)c3C2)c(N)n1 ZINC001140251237 796496188 /nfs/dbraw/zinc/49/61/88/796496188.db2.gz CGMWZFRTKRCRMU-UHFFFAOYSA-N 1 2 302.403 2.045 20 10 DECDLO CCn1cc2c(n1)C[N@@H+](Cc1cc(O)ccc1O)C[C@H]2COC ZINC001141157655 796642526 /nfs/dbraw/zinc/64/25/26/796642526.db2.gz LEXGLMVNUPLROZ-ZDUSSCGKSA-N 1 2 317.389 2.060 20 10 DECDLO CCn1cc2c(n1)C[N@H+](Cc1cc(O)ccc1O)C[C@H]2COC ZINC001141157655 796642528 /nfs/dbraw/zinc/64/25/28/796642528.db2.gz LEXGLMVNUPLROZ-ZDUSSCGKSA-N 1 2 317.389 2.060 20 10 DECDLO Cc1nc(NCCc2cc(O)c(O)cc2O)c2c([nH+]1)CCC2 ZINC001157245281 798169001 /nfs/dbraw/zinc/16/90/01/798169001.db2.gz SXIQZRPYAZWTMX-UHFFFAOYSA-N 1 2 301.346 2.045 20 10 DECDLO COc1ccc(C[NH+]2CC(C)(NC(=O)OC(C)(C)C)C2)c(O)c1 ZINC001203627612 800094824 /nfs/dbraw/zinc/09/48/24/800094824.db2.gz LATWYJNLKJDSKL-UHFFFAOYSA-N 1 2 322.405 2.500 20 10 DECDLO O=C(c1ccco1)N1CCC[N@@H+](Cc2ccc(O)c(O)c2)CC1 ZINC001203880779 800139999 /nfs/dbraw/zinc/13/99/99/800139999.db2.gz ZJQCUHMRRGBQFS-UHFFFAOYSA-N 1 2 316.357 2.039 20 10 DECDLO O=C(c1ccco1)N1CCC[N@H+](Cc2ccc(O)c(O)c2)CC1 ZINC001203880779 800140004 /nfs/dbraw/zinc/14/00/04/800140004.db2.gz ZJQCUHMRRGBQFS-UHFFFAOYSA-N 1 2 316.357 2.039 20 10 DECDLO Oc1c(Cl)cccc1C[N@@H+]1CC[C@H](Oc2ncccn2)C1 ZINC001231913522 801749509 /nfs/dbraw/zinc/74/95/09/801749509.db2.gz LGMSFDOLPRRFMJ-LBPRGKRZSA-N 1 2 305.765 2.489 20 10 DECDLO CC[N@H+](Cc1ccccc1O)Cc1c(OC)ncnc1OC ZINC001232520435 801909085 /nfs/dbraw/zinc/90/90/85/801909085.db2.gz SRXYQOXUUPHTBY-UHFFFAOYSA-N 1 2 303.362 2.222 20 10 DECDLO CC[N@@H+](Cc1ccccc1O)Cc1c(OC)ncnc1OC ZINC001232520435 801909091 /nfs/dbraw/zinc/90/90/91/801909091.db2.gz SRXYQOXUUPHTBY-UHFFFAOYSA-N 1 2 303.362 2.222 20 10 DECDLO CCOC(=O)[C@H]1C[N@H+](Cc2c(O)ccc(F)c2F)CCS1 ZINC001233335899 802079000 /nfs/dbraw/zinc/07/90/00/802079000.db2.gz QFVMERIIPWRYAU-GFCCVEGCSA-N 1 2 317.357 2.151 20 10 DECDLO CCOC(=O)[C@H]1C[N@@H+](Cc2c(O)ccc(F)c2F)CCS1 ZINC001233335899 802079007 /nfs/dbraw/zinc/07/90/07/802079007.db2.gz QFVMERIIPWRYAU-GFCCVEGCSA-N 1 2 317.357 2.151 20 10 DECDLO COC[C@@H]1C[N@H+](Cc2c(O)ccc(F)c2F)Cc2cn(C)nc21 ZINC001233333227 802081012 /nfs/dbraw/zinc/08/10/12/802081012.db2.gz OJWSGOZMJZOFBG-NSHDSACASA-N 1 2 323.343 2.150 20 10 DECDLO COC[C@@H]1C[N@@H+](Cc2c(O)ccc(F)c2F)Cc2cn(C)nc21 ZINC001233333227 802081018 /nfs/dbraw/zinc/08/10/18/802081018.db2.gz OJWSGOZMJZOFBG-NSHDSACASA-N 1 2 323.343 2.150 20 10 DECDLO CC(=O)[C@H]1C[N@H+](Cc2ccc(C(F)(F)F)cc2O)CCO1 ZINC001233455460 802120465 /nfs/dbraw/zinc/12/04/65/802120465.db2.gz LVLADZAFXVQWNG-CYBMUJFWSA-N 1 2 303.280 2.201 20 10 DECDLO COc1cc2c(cc1OC)C[NH+](Cc1cc(O)c(O)cc1O)C2 ZINC001233487486 802128937 /nfs/dbraw/zinc/12/89/37/802128937.db2.gz FVNFHNIJKLDMAO-UHFFFAOYSA-N 1 2 317.341 2.336 20 10 DECDLO CC(C)(C)[C@@H](Cn1cc[nH+]c1)NC(=O)Cc1ccc(N)cc1 ZINC000315918969 802491169 /nfs/dbraw/zinc/49/11/69/802491169.db2.gz SZMMLJIWKIUWEZ-OAHLLOKOSA-N 1 2 300.406 2.239 20 10 DECDLO Cn1c2ccc(F)cc2c(C[NH2+]C[C@@H]2CCC[N@@H+]2C)c1C(=O)[O-] ZINC001598602671 993584504 /nfs/dbraw/zinc/58/45/04/993584504.db2.gz LLYXGHDFRSNZCV-LBPRGKRZSA-N 1 2 319.380 2.199 20 10 DECDLO Cn1c2ccc(F)cc2c(C[NH2+]C[C@@H]2CCC[N@H+]2C)c1C(=O)[O-] ZINC001598602671 993584514 /nfs/dbraw/zinc/58/45/14/993584514.db2.gz LLYXGHDFRSNZCV-LBPRGKRZSA-N 1 2 319.380 2.199 20 10 DECDLO Cn1cc[nH+]c1CCC(=O)NCc1ccc2c(c1)CCCN2C ZINC001346380670 1150977529 /nfs/dbraw/zinc/97/75/29/1150977529.db2.gz IQBSKKAJRZTICR-UHFFFAOYSA-N 1 2 312.417 2.052 20 10 DECDLO C[C@H]([NH2+]CCC1CCOCC1)c1cccc(-c2nn[nH]n2)c1O ZINC001603661918 1070028601 /nfs/dbraw/zinc/02/86/01/1070028601.db2.gz DMZIOZFPOXNVGN-NSHDSACASA-N 1 2 317.393 2.040 20 10 DECDLO CCC(CC)[C@@H](O)C[NH2+][C@@H](C)c1cccc(-c2nn[nH]n2)c1O ZINC001604023733 1070179592 /nfs/dbraw/zinc/17/95/92/1070179592.db2.gz ZXKLKHYXQDHEQJ-HZMBPMFUSA-N 1 2 319.409 2.020 20 10 DECDLO COC(=O)[C@@H](COC1CCC1)[N@H+](C)Cc1ccc(C)cc1O ZINC001461866158 1058730892 /nfs/dbraw/zinc/73/08/92/1058730892.db2.gz USANZWPXGXIPHY-OAHLLOKOSA-N 1 2 307.390 2.243 20 10 DECDLO COC(=O)[C@@H](COC1CCC1)[N@@H+](C)Cc1ccc(C)cc1O ZINC001461866158 1058730911 /nfs/dbraw/zinc/73/09/11/1058730911.db2.gz USANZWPXGXIPHY-OAHLLOKOSA-N 1 2 307.390 2.243 20 10 DECDLO COc1c(O)c(C[NH2+][C@@H]2C[C@@H](C)n3ccnc32)ccc1[N+](=O)[O-] ZINC001462241398 1058786442 /nfs/dbraw/zinc/78/64/42/1058786442.db2.gz WQFSYEOJWQRYRQ-MWLCHTKSSA-N 1 2 318.333 2.301 20 10 DECDLO C[N@H+]1Cc2ccccc2[C@@H](NC(=O)c2c(F)ccc(O)c2O)C1 ZINC001638553669 1078570364 /nfs/dbraw/zinc/57/03/64/1078570364.db2.gz DRDHTWCYPCZMKC-ZDUSSCGKSA-N 1 2 316.332 2.153 20 10 DECDLO C[N@@H+]1Cc2ccccc2[C@@H](NC(=O)c2c(F)ccc(O)c2O)C1 ZINC001638553669 1078570371 /nfs/dbraw/zinc/57/03/71/1078570371.db2.gz DRDHTWCYPCZMKC-ZDUSSCGKSA-N 1 2 316.332 2.153 20 10 DECDLO Oc1c(Br)cc(F)cc1C[N@H+]1CCC[C@@H](O)C1 ZINC001235297659 1079010668 /nfs/dbraw/zinc/01/06/68/1079010668.db2.gz OWXSBWPFBMQYLK-SNVBAGLBSA-N 1 2 304.159 2.251 20 10 DECDLO Oc1c(Br)cc(F)cc1C[N@@H+]1CCC[C@@H](O)C1 ZINC001235297659 1079010683 /nfs/dbraw/zinc/01/06/83/1079010683.db2.gz OWXSBWPFBMQYLK-SNVBAGLBSA-N 1 2 304.159 2.251 20 10 DECDLO O=C(NCC[NH2+]Cc1cc(Cl)cc(F)c1O)c1ccco1 ZINC001620706507 1076086594 /nfs/dbraw/zinc/08/65/94/1076086594.db2.gz LCEIIQIXCKZSOC-UHFFFAOYSA-N 1 2 312.728 2.297 20 10 DECDLO C[C@H]([NH2+]C1CCSCC1)c1cccc(-c2nn[nH]n2)c1O ZINC001589952788 1076534731 /nfs/dbraw/zinc/53/47/31/1076534731.db2.gz DBWVFFFWUVMNBL-VIFPVBQESA-N 1 2 305.407 2.119 20 10 DECDLO C[C@@H]([NH2+]C[C@@H]1CCOC1(C)C)c1cccc(-c2nn[nH]n2)c1O ZINC001589962089 1076537672 /nfs/dbraw/zinc/53/76/72/1076537672.db2.gz GJRIIEQYKPIKTN-MNOVXSKESA-N 1 2 317.393 2.038 20 10 DECDLO C[C@H]([NH2+]CC[C@@H]1CCCCO1)c1cccc(-c2nn[nH]n2)c1O ZINC001589963760 1076538468 /nfs/dbraw/zinc/53/84/68/1076538468.db2.gz YDPZHFILSQUEQW-RYUDHWBXSA-N 1 2 317.393 2.182 20 10 DECDLO C[C@@H]([NH2+]C[C@@H]1CCC[C@@H](C)O1)c1cccc(-c2nn[nH]n2)c1O ZINC001590244329 1076597782 /nfs/dbraw/zinc/59/77/82/1076597782.db2.gz TWANHOJGNSUIMK-UTUOFQBUSA-N 1 2 317.393 2.181 20 10 DECDLO CC[C@@H]([NH2+]C[C@H]1CCC=CO1)c1cccc(-c2nn[nH]n2)c1O ZINC001590466718 1076633394 /nfs/dbraw/zinc/63/33/94/1076633394.db2.gz MDUCYDDXIMWTJC-BXUZGUMPSA-N 1 2 315.377 2.306 20 10 DECDLO C[C@H](CO[C@@H]1CCOC1)[NH2+]Cc1cc(Cl)cc(F)c1O ZINC001657545903 1080177586 /nfs/dbraw/zinc/17/75/86/1080177586.db2.gz YQEJKTFPYPZMEF-BXKDBHETSA-N 1 2 303.761 2.468 20 10 DECDLO Cc1nccnc1N1CC[NH+](Cc2cc(F)c(F)cc2O)CC1 ZINC001664455536 1080911717 /nfs/dbraw/zinc/91/17/17/1080911717.db2.gz NUKLEOCMUCJANH-UHFFFAOYSA-N 1 2 320.343 2.091 20 10 DECDLO Oc1c(F)cc(Br)cc1C[NH+]1CC(C2COC2)C1 ZINC001235056643 1084291967 /nfs/dbraw/zinc/29/19/67/1084291967.db2.gz BTSVNOFHQCSCKB-UHFFFAOYSA-N 1 2 316.170 2.372 20 10 DECDLO COc1cc(C)c(C[N@@H+]2CCO[C@@H](C(F)(F)F)C2)c(O)c1 ZINC001236811209 1138437713 /nfs/dbraw/zinc/43/77/13/1138437713.db2.gz MXTKMQKWWBZBOH-CYBMUJFWSA-N 1 2 305.296 2.472 20 10 DECDLO COc1cc(C)c(C[N@H+]2CCO[C@@H](C(F)(F)F)C2)c(O)c1 ZINC001236811209 1138437719 /nfs/dbraw/zinc/43/77/19/1138437719.db2.gz MXTKMQKWWBZBOH-CYBMUJFWSA-N 1 2 305.296 2.472 20 10 DECDLO Oc1cc(Cl)c(F)cc1CN1CC([N@@H+]2CC[C@H](F)C2)C1 ZINC001237949893 1138811941 /nfs/dbraw/zinc/81/19/41/1138811941.db2.gz OAZJWQDRYALLGS-JTQLQIEISA-N 1 2 302.752 2.413 20 10 DECDLO Oc1cc(Cl)c(F)cc1CN1CC([N@H+]2CC[C@H](F)C2)C1 ZINC001237949893 1138811943 /nfs/dbraw/zinc/81/19/43/1138811943.db2.gz OAZJWQDRYALLGS-JTQLQIEISA-N 1 2 302.752 2.413 20 10 DECDLO CCOC(=O)[C@H]1[C@@H]2C[N@@H+](Cc3cc(F)c(Cl)cc3O)C[C@@H]21 ZINC001237950376 1138812037 /nfs/dbraw/zinc/81/20/37/1138812037.db2.gz SJNWXHZUNAOOBQ-MSRIBSCDSA-N 1 2 313.756 2.426 20 10 DECDLO CCOC(=O)[C@H]1[C@@H]2C[N@H+](Cc3cc(F)c(Cl)cc3O)C[C@@H]21 ZINC001237950376 1138812038 /nfs/dbraw/zinc/81/20/38/1138812038.db2.gz SJNWXHZUNAOOBQ-MSRIBSCDSA-N 1 2 313.756 2.426 20 10 DECDLO CCOc1ccc(N2CC[NH+](C/C=C(\C)C(=O)OC)CC2)cc1 ZINC001319613251 1140625681 /nfs/dbraw/zinc/62/56/81/1140625681.db2.gz ZPLHXCXGMAGUMJ-OQLLNIDSSA-N 1 2 318.417 2.327 20 10 DECDLO C[C@H]([NH2+]CCN1CCC(CO)CC1)c1cc(F)cc(F)c1O ZINC001323830136 1141890414 /nfs/dbraw/zinc/89/04/14/1141890414.db2.gz PAEZCRRGKJLVNI-NSHDSACASA-N 1 2 314.376 2.025 20 10 DECDLO CC(C)Cc1nnc(-c2ccc(O)c(C[NH+]3CCOCC3)c2)o1 ZINC001256518674 1143851457 /nfs/dbraw/zinc/85/14/57/1143851457.db2.gz XASRKVJBBPXFEB-UHFFFAOYSA-N 1 2 317.389 2.473 20 10 DECDLO O=C(C[NH2+][C@H]1CCCN(C2CCCC2)C1)c1ccc(O)c(O)c1 ZINC001256904747 1143874268 /nfs/dbraw/zinc/87/42/68/1143874268.db2.gz MRHNEZLHSZHDDG-AWEZNQCLSA-N 1 2 318.417 2.277 20 10 DECDLO CN(C)c1ccc(C[N@@H+]2CCOC[C@H]2[C@H]2CCCC2=O)cc1F ZINC000375469244 529780289 /nfs/dbraw/zinc/78/02/89/529780289.db2.gz NCKBBQRFJAQBKR-PBHICJAKSA-N 1 2 320.408 2.462 20 10 DECDLO CN(C)c1ccc(C[N@H+]2CCOC[C@H]2[C@H]2CCCC2=O)cc1F ZINC000375469244 529780290 /nfs/dbraw/zinc/78/02/90/529780290.db2.gz NCKBBQRFJAQBKR-PBHICJAKSA-N 1 2 320.408 2.462 20 10 DECDLO CN(Cc1cccs1)c1ccc(C[N@@H+]2CCNC(=O)C2)cc1 ZINC000294575440 530009725 /nfs/dbraw/zinc/00/97/25/530009725.db2.gz PDEXWLFYQSVVBU-UHFFFAOYSA-N 1 2 315.442 2.316 20 10 DECDLO CN(Cc1cccs1)c1ccc(C[N@H+]2CCNC(=O)C2)cc1 ZINC000294575440 530009726 /nfs/dbraw/zinc/00/97/26/530009726.db2.gz PDEXWLFYQSVVBU-UHFFFAOYSA-N 1 2 315.442 2.316 20 10 DECDLO CN1CCCc2cc(CNC(=O)[C@H]3CCc4[nH+]ccn4C3)ccc21 ZINC000376942084 530065860 /nfs/dbraw/zinc/06/58/60/530065860.db2.gz XVRXXWVZRQTABK-INIZCTEOSA-N 1 2 324.428 2.144 20 10 DECDLO CN(C)c1ccc(CN(C)C(=O)[C@H]2CCn3c[nH+]cc3C2)cc1 ZINC000151262757 402026477 /nfs/dbraw/zinc/02/64/77/402026477.db2.gz QCAFQAKZOMSMLS-HNNXBMFYSA-N 1 2 312.417 2.170 20 10 DECDLO C[C@H](C[NH2+][C@H](C)c1ccc(F)c(F)c1O)N1CCOCC1 ZINC000191192915 402649596 /nfs/dbraw/zinc/64/95/96/402649596.db2.gz OAYGNNWRZUUDRQ-GHMZBOCLSA-N 1 2 300.349 2.042 20 10 DECDLO COc1cc(O)c(CNc2ccc(N(C)C)[nH+]c2)cc1OC ZINC000272024857 402888277 /nfs/dbraw/zinc/88/82/77/402888277.db2.gz XYSSHRMWCZYBFV-UHFFFAOYSA-N 1 2 303.362 2.483 20 10 DECDLO CCN(Cc1ccc(N(C)C)cc1)C(=O)Cc1[nH]c[nH+]c1C ZINC000279229067 402919271 /nfs/dbraw/zinc/91/92/71/402919271.db2.gz ORRCASGLZOMMRE-UHFFFAOYSA-N 1 2 300.406 2.375 20 10 DECDLO COCCn1cc(C[NH2+][C@@H](C)c2ccc(F)c(F)c2O)cn1 ZINC000282446404 403154883 /nfs/dbraw/zinc/15/48/83/403154883.db2.gz FCSUNDUQSUDJEM-JTQLQIEISA-N 1 2 311.332 2.364 20 10 DECDLO CON(C)C(=O)C1CC[NH+](Cc2cccc(Cl)c2O)CC1 ZINC000291290300 404380011 /nfs/dbraw/zinc/38/00/11/404380011.db2.gz PMFGFPUEQJDTJL-UHFFFAOYSA-N 1 2 312.797 2.277 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@@H+]2CCC(F)(F)[C@@H](CO)C2)c1O ZINC000291863681 404556455 /nfs/dbraw/zinc/55/64/55/404556455.db2.gz PMCMUPZPITWNQW-LLVKDONJSA-N 1 2 317.307 2.183 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@H+]2CCC(F)(F)[C@@H](CO)C2)c1O ZINC000291863681 404556458 /nfs/dbraw/zinc/55/64/58/404556458.db2.gz PMCMUPZPITWNQW-LLVKDONJSA-N 1 2 317.307 2.183 20 10 DECDLO C[C@@H]1C[N@H+](Cc2c(O)ccc(Cl)c2F)CC[S@](=O)C1 ZINC000365446205 404662991 /nfs/dbraw/zinc/66/29/91/404662991.db2.gz HKFIVWIKUXAVBY-HOGDKLEQSA-N 1 2 305.802 2.385 20 10 DECDLO C[C@@H]1C[N@@H+](Cc2c(O)ccc(Cl)c2F)CC[S@](=O)C1 ZINC000365446205 404662994 /nfs/dbraw/zinc/66/29/94/404662994.db2.gz HKFIVWIKUXAVBY-HOGDKLEQSA-N 1 2 305.802 2.385 20 10 DECDLO CCS(=O)(=O)C[C@H](C)[N@H+](C)Cc1c(O)cccc1Cl ZINC000126495734 521650836 /nfs/dbraw/zinc/65/08/36/521650836.db2.gz SVIILIVTDAPWOG-JTQLQIEISA-N 1 2 305.827 2.301 20 10 DECDLO CCS(=O)(=O)C[C@H](C)[N@@H+](C)Cc1c(O)cccc1Cl ZINC000126495734 521650839 /nfs/dbraw/zinc/65/08/39/521650839.db2.gz SVIILIVTDAPWOG-JTQLQIEISA-N 1 2 305.827 2.301 20 10 DECDLO CCC[C@H]1C(=O)NCC[N@H+]1C/C=C/c1ccc(N(C)C)cc1 ZINC000835028039 649868544 /nfs/dbraw/zinc/86/85/44/649868544.db2.gz IRBRESNNHOOHHF-UABRLCRWSA-N 1 2 301.434 2.366 20 10 DECDLO CCC[C@H]1C(=O)NCC[N@@H+]1C/C=C/c1ccc(N(C)C)cc1 ZINC000835028039 649868545 /nfs/dbraw/zinc/86/85/45/649868545.db2.gz IRBRESNNHOOHHF-UABRLCRWSA-N 1 2 301.434 2.366 20 10 DECDLO CCCOC(=O)[C@H](C)[N@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000158639482 520217905 /nfs/dbraw/zinc/21/79/05/520217905.db2.gz KPZPWUOLXKKHMH-HNNXBMFYSA-N 1 2 320.433 2.297 20 10 DECDLO CCCOC(=O)[C@H](C)[N@@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000158639482 520217910 /nfs/dbraw/zinc/21/79/10/520217910.db2.gz KPZPWUOLXKKHMH-HNNXBMFYSA-N 1 2 320.433 2.297 20 10 DECDLO C[C@@H]1C[N@H+](C/C=C\c2ccc(N(C)C)cc2)CC[S@](=O)C1 ZINC000835048363 649871183 /nfs/dbraw/zinc/87/11/83/649871183.db2.gz HMBPBIGYIGDQPP-CYUBDGMSSA-N 1 2 306.475 2.466 20 10 DECDLO C[C@@H]1C[N@@H+](C/C=C\c2ccc(N(C)C)cc2)CC[S@](=O)C1 ZINC000835048363 649871185 /nfs/dbraw/zinc/87/11/85/649871185.db2.gz HMBPBIGYIGDQPP-CYUBDGMSSA-N 1 2 306.475 2.466 20 10 DECDLO CS(=O)(=O)CC[N@H+](Cc1cc(Cl)ccc1O)C1CC1 ZINC000093816456 634482862 /nfs/dbraw/zinc/48/28/62/634482862.db2.gz YUGYXKWVLFVRQT-UHFFFAOYSA-N 1 2 303.811 2.055 20 10 DECDLO CS(=O)(=O)CC[N@@H+](Cc1cc(Cl)ccc1O)C1CC1 ZINC000093816456 634482865 /nfs/dbraw/zinc/48/28/65/634482865.db2.gz YUGYXKWVLFVRQT-UHFFFAOYSA-N 1 2 303.811 2.055 20 10 DECDLO c1cc(-c2nnc(C[NH2+]Cc3ccc4c(c3)CCCO4)[nH]2)ccn1 ZINC000922183901 635976815 /nfs/dbraw/zinc/97/68/15/635976815.db2.gz CEFYDFWVTFLGPO-UHFFFAOYSA-N 1 2 321.384 2.482 20 10 DECDLO O=C1C[C@H]([C@@H]2CCCC[N@H+]2Cc2cc(F)cc(F)c2O)CN1 ZINC000894095816 636111533 /nfs/dbraw/zinc/11/15/33/636111533.db2.gz SNWYWWLEGZNEKK-HZMBPMFUSA-N 1 2 310.344 2.161 20 10 DECDLO O=C1C[C@H]([C@@H]2CCCC[N@@H+]2Cc2cc(F)cc(F)c2O)CN1 ZINC000894095816 636111535 /nfs/dbraw/zinc/11/15/35/636111535.db2.gz SNWYWWLEGZNEKK-HZMBPMFUSA-N 1 2 310.344 2.161 20 10 DECDLO Oc1c(F)cc(F)cc1C[NH2+]C[C@H]1CCN1C1CCOCC1 ZINC000922954010 636881966 /nfs/dbraw/zinc/88/19/66/636881966.db2.gz GBAXLRZVSIYALD-CQSZACIVSA-N 1 2 312.360 2.013 20 10 DECDLO OC[C@H]1C[C@H]([NH2+]Cc2cc(Br)cc(F)c2O)C1 ZINC000923005824 636905454 /nfs/dbraw/zinc/90/54/54/636905454.db2.gz UXQVAYUOJKJJSI-GVJMRKKJSA-N 1 2 304.159 2.154 20 10 DECDLO CC1(C)C[N@H+](Cc2cc(Br)cc(F)c2O)C[C@@H]1O ZINC000894595656 637126082 /nfs/dbraw/zinc/12/60/82/637126082.db2.gz JFIXBZZWGKWDQL-NSHDSACASA-N 1 2 318.186 2.497 20 10 DECDLO CC1(C)C[N@@H+](Cc2cc(Br)cc(F)c2O)C[C@@H]1O ZINC000894595656 637126085 /nfs/dbraw/zinc/12/60/85/637126085.db2.gz JFIXBZZWGKWDQL-NSHDSACASA-N 1 2 318.186 2.497 20 10 DECDLO C[C@@H]1C[N@H+](Cc2cc(F)cc(F)c2O)CC2(CCOCC2)O1 ZINC000894595143 637126224 /nfs/dbraw/zinc/12/62/24/637126224.db2.gz AINVTNSGFFZRRC-LLVKDONJSA-N 1 2 313.344 2.440 20 10 DECDLO C[C@@H]1C[N@@H+](Cc2cc(F)cc(F)c2O)CC2(CCOCC2)O1 ZINC000894595143 637126229 /nfs/dbraw/zinc/12/62/29/637126229.db2.gz AINVTNSGFFZRRC-LLVKDONJSA-N 1 2 313.344 2.440 20 10 DECDLO Cc1cc(O)c(C[NH+]2CCC(S(C)(=O)=O)CC2)c(Cl)c1 ZINC000840918329 650382074 /nfs/dbraw/zinc/38/20/74/650382074.db2.gz ZTBVCPGGRJINSB-UHFFFAOYSA-N 1 2 317.838 2.363 20 10 DECDLO COC(=O)[C@@H](CC1CCOCC1)[NH2+]Cc1cc(C)c(C)cc1O ZINC000895591318 638106095 /nfs/dbraw/zinc/10/60/95/638106095.db2.gz NRHVHZHYVCCPQT-MRXNPFEDSA-N 1 2 321.417 2.457 20 10 DECDLO COCC1C[NH+](Cc2cc(Br)cc(F)c2O)C1 ZINC000895975889 638285633 /nfs/dbraw/zinc/28/56/33/638285633.db2.gz IVMSQTQSHOMKOV-UHFFFAOYSA-N 1 2 304.159 2.372 20 10 DECDLO COC(=O)C(C)(C)[N@H+](C)Cc1cc(Cl)cc(OC)c1O ZINC000761193505 640283296 /nfs/dbraw/zinc/28/32/96/640283296.db2.gz GDDOTBIDPCPWOU-UHFFFAOYSA-N 1 2 301.770 2.438 20 10 DECDLO COC(=O)C(C)(C)[N@@H+](C)Cc1cc(Cl)cc(OC)c1O ZINC000761193505 640283300 /nfs/dbraw/zinc/28/33/00/640283300.db2.gz GDDOTBIDPCPWOU-UHFFFAOYSA-N 1 2 301.770 2.438 20 10 DECDLO Cn1cc(CN2CC[NH+](Cc3c(O)cccc3Cl)CC2)cn1 ZINC000769310038 641214604 /nfs/dbraw/zinc/21/46/04/641214604.db2.gz WVNFSIZPHOUBKY-UHFFFAOYSA-N 1 2 320.824 2.097 20 10 DECDLO COCC[C@@]1([NH2+]Cc2cc(Cl)cc(F)c2O)CCOC1 ZINC000775202987 642016118 /nfs/dbraw/zinc/01/61/18/642016118.db2.gz IIUZXXKQVQXBIT-CQSZACIVSA-N 1 2 303.761 2.470 20 10 DECDLO CCOc1ccc(O)c(C[N@@H+]2CCN(CC(C)C)C(=O)[C@@H]2C)c1 ZINC000779202260 642472048 /nfs/dbraw/zinc/47/20/48/642472048.db2.gz LXFPCVJPZNBYGI-AWEZNQCLSA-N 1 2 320.433 2.480 20 10 DECDLO CCOc1ccc(O)c(C[N@H+]2CCN(CC(C)C)C(=O)[C@@H]2C)c1 ZINC000779202260 642472052 /nfs/dbraw/zinc/47/20/52/642472052.db2.gz LXFPCVJPZNBYGI-AWEZNQCLSA-N 1 2 320.433 2.480 20 10 DECDLO CC(C)OC[C@@H](CO)[N@H+](C)Cc1cc(Cl)cc(F)c1O ZINC000809768515 646281511 /nfs/dbraw/zinc/28/15/11/646281511.db2.gz NWUDUFIMMDFEIO-GFCCVEGCSA-N 1 2 305.777 2.402 20 10 DECDLO CC(C)OC[C@@H](CO)[N@@H+](C)Cc1cc(Cl)cc(F)c1O ZINC000809768515 646281513 /nfs/dbraw/zinc/28/15/13/646281513.db2.gz NWUDUFIMMDFEIO-GFCCVEGCSA-N 1 2 305.777 2.402 20 10 DECDLO COC(=O)[C@@H](COC(C)C)[N@H+](C)Cc1ccc(N(C)C)c(C)c1 ZINC000815062448 646962277 /nfs/dbraw/zinc/96/22/77/646962277.db2.gz URKLFSMFMATSAM-QGZVFWFLSA-N 1 2 322.449 2.459 20 10 DECDLO COC(=O)[C@@H](COC(C)C)[N@@H+](C)Cc1ccc(N(C)C)c(C)c1 ZINC000815062448 646962280 /nfs/dbraw/zinc/96/22/80/646962280.db2.gz URKLFSMFMATSAM-QGZVFWFLSA-N 1 2 322.449 2.459 20 10 DECDLO OCC[C@@H]1CSCC[N@@H+]1Cc1cc(Cl)c(F)cc1O ZINC000816520646 647146573 /nfs/dbraw/zinc/14/65/73/647146573.db2.gz UPAFQZAXTJEKGX-SNVBAGLBSA-N 1 2 305.802 2.485 20 10 DECDLO OCC[C@@H]1CSCC[N@H+]1Cc1cc(Cl)c(F)cc1O ZINC000816520646 647146574 /nfs/dbraw/zinc/14/65/74/647146574.db2.gz UPAFQZAXTJEKGX-SNVBAGLBSA-N 1 2 305.802 2.485 20 10 DECDLO NC(=O)[C@@H]1[C@H]2CCC[C@H]2C[N@@H+]1Cc1cc(Cl)c(F)cc1O ZINC000816588978 647156457 /nfs/dbraw/zinc/15/64/57/647156457.db2.gz HRLGFOYBSCXSPM-BXGCZWRVSA-N 1 2 312.772 2.271 20 10 DECDLO NC(=O)[C@@H]1[C@H]2CCC[C@H]2C[N@H+]1Cc1cc(Cl)c(F)cc1O ZINC000816588978 647156459 /nfs/dbraw/zinc/15/64/59/647156459.db2.gz HRLGFOYBSCXSPM-BXGCZWRVSA-N 1 2 312.772 2.271 20 10 DECDLO Cc1cc(C(=O)C[N@H+](C)CCO)c(C)n1-c1cccc(F)c1 ZINC000153119619 647360007 /nfs/dbraw/zinc/36/00/07/647360007.db2.gz DCJKQRFYTJTOKG-UHFFFAOYSA-N 1 2 304.365 2.340 20 10 DECDLO Cc1cc(C(=O)C[N@@H+](C)CCO)c(C)n1-c1cccc(F)c1 ZINC000153119619 647360012 /nfs/dbraw/zinc/36/00/12/647360012.db2.gz DCJKQRFYTJTOKG-UHFFFAOYSA-N 1 2 304.365 2.340 20 10 DECDLO O=C(NCc1cn2c([nH+]1)CCCC2)NCc1c(O)cccc1F ZINC000916342250 647860335 /nfs/dbraw/zinc/86/03/35/647860335.db2.gz RADYMXFGDGIILR-UHFFFAOYSA-N 1 2 318.352 2.064 20 10 DECDLO C[N@H+](Cc1cc(Cl)cc(F)c1O)[C@H]1CCN2CCO[C@H]1C2 ZINC000824501380 648598340 /nfs/dbraw/zinc/59/83/40/648598340.db2.gz JLKDRTXQEGGNRM-KBPBESRZSA-N 1 2 314.788 2.090 20 10 DECDLO C[N@@H+](Cc1cc(Cl)cc(F)c1O)[C@H]1CCN2CCO[C@H]1C2 ZINC000824501380 648598343 /nfs/dbraw/zinc/59/83/43/648598343.db2.gz JLKDRTXQEGGNRM-KBPBESRZSA-N 1 2 314.788 2.090 20 10 DECDLO Oc1c(Br)cccc1C[N@@H+]1CC[C@@](O)(C(F)F)C1 ZINC000824726612 648644066 /nfs/dbraw/zinc/64/40/66/648644066.db2.gz PQJQXSQYFOOWMV-LBPRGKRZSA-N 1 2 322.149 2.357 20 10 DECDLO CN(C)c1ccc(C[N@@H+]2CCC[C@@H]2C(N)=O)c(C(F)(F)F)c1 ZINC000824960109 648678365 /nfs/dbraw/zinc/67/83/65/648678365.db2.gz QRAXSUKUPWSSGB-CYBMUJFWSA-N 1 2 315.339 2.221 20 10 DECDLO CN(C)c1ccc(C[N@H+]2CCC[C@@H]2C(N)=O)c(C(F)(F)F)c1 ZINC000824960109 648678368 /nfs/dbraw/zinc/67/83/68/648678368.db2.gz QRAXSUKUPWSSGB-CYBMUJFWSA-N 1 2 315.339 2.221 20 10 DECDLO O=C1OCCN1[C@H]1CC[N@@H+](Cc2c(O)ccc(Cl)c2F)C1 ZINC000827000763 648958797 /nfs/dbraw/zinc/95/87/97/648958797.db2.gz NRKUSTIRJSIIGE-VIFPVBQESA-N 1 2 314.744 2.211 20 10 DECDLO O=C1OCCN1[C@H]1CC[N@H+](Cc2c(O)ccc(Cl)c2F)C1 ZINC000827000763 648958801 /nfs/dbraw/zinc/95/88/01/648958801.db2.gz NRKUSTIRJSIIGE-VIFPVBQESA-N 1 2 314.744 2.211 20 10 DECDLO Oc1cc(F)c(Cl)cc1CN1CC[NH+]([C@H]2CCOC2)CC1 ZINC000827125995 648977188 /nfs/dbraw/zinc/97/71/88/648977188.db2.gz VEGGMKXSVDCJEL-LBPRGKRZSA-N 1 2 314.788 2.091 20 10 DECDLO COc1cccc([C@H](C)[NH2+]Cc2nc([C@H]3CCCO3)n[nH]2)c1O ZINC000848558354 651470483 /nfs/dbraw/zinc/47/04/83/651470483.db2.gz PPRXNXRGSZJXCS-GXFFZTMASA-N 1 2 318.377 2.221 20 10 DECDLO COC[C@H](C)NC(=[NH2+])NCc1cc(Cl)cc(Cl)c1O ZINC000849028511 651588175 /nfs/dbraw/zinc/58/81/75/651588175.db2.gz LMTDKZWAIMBIMP-ZETCQYMHSA-N 1 2 306.193 2.348 20 10 DECDLO COCc1n[nH]c(C[NH2+]Cc2ccc(N3CCCCC3)cc2)n1 ZINC000850360849 651910549 /nfs/dbraw/zinc/91/05/49/651910549.db2.gz OYPIDIBODQANDS-UHFFFAOYSA-N 1 2 315.421 2.231 20 10 DECDLO CC[C@@H]([NH2+]Cc1nc(C(N)=O)cs1)c1ccc(F)cc1O ZINC000850539432 651948830 /nfs/dbraw/zinc/94/88/30/651948830.db2.gz CMYLDELBHYONKJ-SNVBAGLBSA-N 1 2 309.366 2.328 20 10 DECDLO Cc1cc(C(=O)NCCn2cc[nH+]c2)c(C)n1-c1ccccn1 ZINC000077496419 683952975 /nfs/dbraw/zinc/95/29/75/683952975.db2.gz UMFRBJPPDLNFRL-UHFFFAOYSA-N 1 2 309.373 2.116 20 10 DECDLO COC(=O)[C@@H](C[C@@H]1CCCOC1)[NH2+]Cc1cc(C)c(C)cc1O ZINC000862515949 686313542 /nfs/dbraw/zinc/31/35/42/686313542.db2.gz GPNOORPWTWRBBH-GOEBONIOSA-N 1 2 321.417 2.457 20 10 DECDLO CN1CCCc2cc(CNC(=O)[C@@H]3C[C@H]3c3c[nH]c[nH+]3)ccc21 ZINC000874251191 689377034 /nfs/dbraw/zinc/37/70/34/689377034.db2.gz HPFUBNGHXSHEKZ-HUUCEWRRSA-N 1 2 310.401 2.212 20 10 DECDLO CN1CCCc2cc(CNC(=O)[C@@H]3C[C@H]3c3c[nH+]c[nH]3)ccc21 ZINC000874251191 689377035 /nfs/dbraw/zinc/37/70/35/689377035.db2.gz HPFUBNGHXSHEKZ-HUUCEWRRSA-N 1 2 310.401 2.212 20 10 DECDLO Oc1c(C[NH2+][C@H]2COc3ccccc3[C@H]2O)ccc(F)c1F ZINC000877537596 690144948 /nfs/dbraw/zinc/14/49/48/690144948.db2.gz MXBOXGCDCGIKGV-BLLLJJGKSA-N 1 2 307.296 2.255 20 10 DECDLO Oc1c(F)cc(F)cc1C[NH2+][C@H]1CCN(CC(F)(F)F)C1 ZINC000882944292 691394797 /nfs/dbraw/zinc/39/47/97/691394797.db2.gz BEKWERUYISDFKV-JTQLQIEISA-N 1 2 310.266 2.397 20 10 DECDLO C[C@@]1(O)C[C@H]([NH2+]Cc2cc(Br)cc(F)c2O)C1 ZINC000883147542 691441013 /nfs/dbraw/zinc/44/10/13/691441013.db2.gz ZMAVSFKYZJJEQB-WVSHTKLVSA-N 1 2 304.159 2.297 20 10 DECDLO CCn1cc(C[N@@H+](Cc2ccccc2O)C[C@H]2CCCO2)nn1 ZINC000886151982 692013189 /nfs/dbraw/zinc/01/31/89/692013189.db2.gz ZCLPUWFKUVZYEM-MRXNPFEDSA-N 1 2 316.405 2.185 20 10 DECDLO CCn1cc(C[N@H+](Cc2ccccc2O)C[C@H]2CCCO2)nn1 ZINC000886151982 692013193 /nfs/dbraw/zinc/01/31/93/692013193.db2.gz ZCLPUWFKUVZYEM-MRXNPFEDSA-N 1 2 316.405 2.185 20 10 DECDLO CCC[N@@H+]1CCC[C@H]1CNCc1ccc(OC)c(OC)c1O ZINC001335060525 1150371594 /nfs/dbraw/zinc/37/15/94/1150371594.db2.gz ATFDIDDJUSUNAI-AWEZNQCLSA-N 1 2 308.422 2.373 20 10 DECDLO CCC[N@H+]1CCC[C@H]1CNCc1ccc(OC)c(OC)c1O ZINC001335060525 1150371599 /nfs/dbraw/zinc/37/15/99/1150371599.db2.gz ATFDIDDJUSUNAI-AWEZNQCLSA-N 1 2 308.422 2.373 20 10 DECDLO Oc1c(F)cc(Br)cc1C[N@H+]1C[C@H](O)C2(CC2)C1 ZINC001353595655 1151841175 /nfs/dbraw/zinc/84/11/75/1151841175.db2.gz YDTKEIDXSPQSPK-NSHDSACASA-N 1 2 316.170 2.251 20 10 DECDLO Oc1c(F)cc(Br)cc1C[N@@H+]1C[C@H](O)C2(CC2)C1 ZINC001353595655 1151841179 /nfs/dbraw/zinc/84/11/79/1151841179.db2.gz YDTKEIDXSPQSPK-NSHDSACASA-N 1 2 316.170 2.251 20 10 DECDLO COC(=O)N1CCC[N@H+](Cc2cc(Cl)c(F)cc2O)CC1 ZINC001347700915 1151092005 /nfs/dbraw/zinc/09/20/05/1151092005.db2.gz CQBLSRLFKVRNEC-UHFFFAOYSA-N 1 2 316.760 2.459 20 10 DECDLO COC(=O)N1CCC[N@@H+](Cc2cc(Cl)c(F)cc2O)CC1 ZINC001347700915 1151092010 /nfs/dbraw/zinc/09/20/10/1151092010.db2.gz CQBLSRLFKVRNEC-UHFFFAOYSA-N 1 2 316.760 2.459 20 10 DECDLO NC(=O)N=Nc1ccc(C(=O)N[C@H]2CCC[N@H+](CCF)C2)cc1 ZINC001009677109 785505709 /nfs/dbraw/zinc/50/57/09/785505709.db2.gz VMUWOLKQOSCORC-ZDUSSCGKSA-N 1 2 321.356 2.013 20 10 DECDLO NC(=O)N=Nc1ccc(C(=O)N[C@H]2CCC[N@@H+](CCF)C2)cc1 ZINC001009677109 785505718 /nfs/dbraw/zinc/50/57/18/785505718.db2.gz VMUWOLKQOSCORC-ZDUSSCGKSA-N 1 2 321.356 2.013 20 10 DECDLO OCC1([NH2+]Cc2cc(Br)cc(F)c2O)CCC1 ZINC000715761768 792511141 /nfs/dbraw/zinc/51/11/41/792511141.db2.gz UPAYMZKTZNDJQC-UHFFFAOYSA-N 1 2 304.159 2.298 20 10 DECDLO COc1ccc(N2CC[NH+](Cc3c(O)cccc3F)CC2)nc1 ZINC001137841922 796145394 /nfs/dbraw/zinc/14/53/94/796145394.db2.gz ZUUZZODSBMWPEI-UHFFFAOYSA-N 1 2 317.364 2.257 20 10 DECDLO COC[C@H]1C[N@H+](Cc2cccc(F)c2O)Cc2ncn(C)c21 ZINC001138125803 796167454 /nfs/dbraw/zinc/16/74/54/796167454.db2.gz XHTQOBSYQRIEIX-GFCCVEGCSA-N 1 2 305.353 2.011 20 10 DECDLO COC[C@H]1C[N@@H+](Cc2cccc(F)c2O)Cc2ncn(C)c21 ZINC001138125803 796167458 /nfs/dbraw/zinc/16/74/58/796167458.db2.gz XHTQOBSYQRIEIX-GFCCVEGCSA-N 1 2 305.353 2.011 20 10 DECDLO Cn1ncc2c1CC[N@H+](Cc1cc(Br)ccc1O)C2 ZINC001203649681 796459175 /nfs/dbraw/zinc/45/91/75/796459175.db2.gz ALPJVOVIBWKGCJ-UHFFFAOYSA-N 1 2 322.206 2.447 20 10 DECDLO Cn1ncc2c1CC[N@@H+](Cc1cc(Br)ccc1O)C2 ZINC001203649681 796459180 /nfs/dbraw/zinc/45/91/80/796459180.db2.gz ALPJVOVIBWKGCJ-UHFFFAOYSA-N 1 2 322.206 2.447 20 10 DECDLO Cc1cnc(O[C@H]2CC[N@H+](Cc3c(O)cc(F)cc3F)C2)nc1 ZINC001140585973 796541594 /nfs/dbraw/zinc/54/15/94/796541594.db2.gz XVQHAIPMEXPRJM-LBPRGKRZSA-N 1 2 321.327 2.422 20 10 DECDLO Cc1cnc(O[C@H]2CC[N@@H+](Cc3c(O)cc(F)cc3F)C2)nc1 ZINC001140585973 796541597 /nfs/dbraw/zinc/54/15/97/796541597.db2.gz XVQHAIPMEXPRJM-LBPRGKRZSA-N 1 2 321.327 2.422 20 10 DECDLO C[N@H+](Cc1ccncn1)Cc1ccc(N2CCOCC2)cc1F ZINC001140667121 796553667 /nfs/dbraw/zinc/55/36/67/796553667.db2.gz IGHPQWJZUFDHPU-UHFFFAOYSA-N 1 2 316.380 2.084 20 10 DECDLO C[N@@H+](Cc1ccncn1)Cc1ccc(N2CCOCC2)cc1F ZINC001140667121 796553671 /nfs/dbraw/zinc/55/36/71/796553671.db2.gz IGHPQWJZUFDHPU-UHFFFAOYSA-N 1 2 316.380 2.084 20 10 DECDLO COC(=O)c1ccc(C[N@@H+]2CCCc3cc(O)c(O)cc3C2)o1 ZINC001142636415 796756360 /nfs/dbraw/zinc/75/63/60/796756360.db2.gz UTBPTBOTQJGXHP-UHFFFAOYSA-N 1 2 317.341 2.426 20 10 DECDLO COC(=O)c1ccc(C[N@H+]2CCCc3cc(O)c(O)cc3C2)o1 ZINC001142636415 796756362 /nfs/dbraw/zinc/75/63/62/796756362.db2.gz UTBPTBOTQJGXHP-UHFFFAOYSA-N 1 2 317.341 2.426 20 10 DECDLO O=C(Nc1cc[nH+]c2c1CCC2)c1ccc(O)c(O)c1Cl ZINC001193208929 797521985 /nfs/dbraw/zinc/52/19/85/797521985.db2.gz BIOQDSVCRLTDQI-UHFFFAOYSA-N 1 2 304.733 2.309 20 10 DECDLO CCOC(=O)[C@]1(C)C[N@H+](Cc2ccc(N(C)CC)cc2)CCO1 ZINC001197114445 798150455 /nfs/dbraw/zinc/15/04/55/798150455.db2.gz HCQRQWBSDLHMAP-SFHVURJKSA-N 1 2 320.433 2.297 20 10 DECDLO CCOC(=O)[C@]1(C)C[N@@H+](Cc2ccc(N(C)CC)cc2)CCO1 ZINC001197114445 798150457 /nfs/dbraw/zinc/15/04/57/798150457.db2.gz HCQRQWBSDLHMAP-SFHVURJKSA-N 1 2 320.433 2.297 20 10 DECDLO CCn1ncc2c1[C@H](COC)C[N@H+](Cc1ccc(O)c(O)c1)C2 ZINC001203878535 800138796 /nfs/dbraw/zinc/13/87/96/800138796.db2.gz VHMNGGHHDXZLQJ-AWEZNQCLSA-N 1 2 317.389 2.060 20 10 DECDLO CCn1ncc2c1[C@H](COC)C[N@@H+](Cc1ccc(O)c(O)c1)C2 ZINC001203878535 800138799 /nfs/dbraw/zinc/13/87/99/800138799.db2.gz VHMNGGHHDXZLQJ-AWEZNQCLSA-N 1 2 317.389 2.060 20 10 DECDLO COc1cc(C)cc(C[N@@H+]2CCN(CC(C)C)C(=O)[C@H]2C)c1O ZINC001205489165 800363812 /nfs/dbraw/zinc/36/38/12/800363812.db2.gz LHAUCJMNPYWRAJ-CQSZACIVSA-N 1 2 320.433 2.398 20 10 DECDLO COc1cc(C)cc(C[N@H+]2CCN(CC(C)C)C(=O)[C@H]2C)c1O ZINC001205489165 800363817 /nfs/dbraw/zinc/36/38/17/800363817.db2.gz LHAUCJMNPYWRAJ-CQSZACIVSA-N 1 2 320.433 2.398 20 10 DECDLO Oc1cc(C[N@@H+]2CCCC[C@@](O)(C(F)(F)F)C2)cc(O)c1O ZINC001233009987 802001153 /nfs/dbraw/zinc/00/11/53/802001153.db2.gz GDJXJPSPBRBBFV-ZDUSSCGKSA-N 1 2 321.295 2.083 20 10 DECDLO Oc1cc(C[N@H+]2CCCC[C@@](O)(C(F)(F)F)C2)cc(O)c1O ZINC001233009987 802001158 /nfs/dbraw/zinc/00/11/58/802001158.db2.gz GDJXJPSPBRBBFV-ZDUSSCGKSA-N 1 2 321.295 2.083 20 10 DECDLO CC[C@H]([NH2+]CC(C)(C)CCO)c1cccc(-c2nn[nH]n2)c1O ZINC001604055726 1070189447 /nfs/dbraw/zinc/18/94/47/1070189447.db2.gz OIOOGCKWDSOSJM-ZDUSSCGKSA-N 1 2 319.409 2.022 20 10 DECDLO CCOCCC[NH2+][C@H](CC)c1cccc(-c2nn[nH]n2)c1O ZINC001604431097 1070383331 /nfs/dbraw/zinc/38/33/31/1070383331.db2.gz PRVAMGXKPGLLNW-CYBMUJFWSA-N 1 2 305.382 2.040 20 10 DECDLO COC1CCC([NH2+][C@@H](C)c2cccc(-c3nn[nH]n3)c2O)CC1 ZINC001605029507 1070583124 /nfs/dbraw/zinc/58/31/24/1070583124.db2.gz MHTXVVVTNXELQD-UNXYVOJBSA-N 1 2 317.393 2.181 20 10 DECDLO COCC(C)(C)CC[NH2+][C@@H](C)c1cccc(-c2nn[nH]n2)c1O ZINC001605043654 1070593455 /nfs/dbraw/zinc/59/34/55/1070593455.db2.gz ADKWOPVUIYRVHQ-NSHDSACASA-N 1 2 319.409 2.286 20 10 DECDLO CCNC(=O)N1CC[C@H]([NH2+]Cc2cc(Cl)cc(F)c2O)C1 ZINC001620832148 1076393681 /nfs/dbraw/zinc/39/36/81/1076393681.db2.gz RTIDPNNWEVIERF-NSHDSACASA-N 1 2 315.776 2.078 20 10 DECDLO Cc1[nH]c(CNC(=O)c2ccc(N=NC(N)=O)cc2)[nH+]c1C ZINC001587804973 1076427706 /nfs/dbraw/zinc/42/77/06/1076427706.db2.gz DMUBHEDRCLYSAM-UHFFFAOYSA-N 1 2 300.322 2.119 20 10 DECDLO CC[C@H]([NH2+][C@@H](C)c1cccc(-c2nn[nH]n2)c1O)[C@H](O)C(C)C ZINC001590462104 1076631721 /nfs/dbraw/zinc/63/17/21/1076631721.db2.gz NFCHKRLKXZQAFB-LEWSCRJBSA-N 1 2 319.409 2.018 20 10 DECDLO Cc1cccnc1CC[NH2+][C@H](C)c1cccc(-c2nn[nH]n2)c1O ZINC001592263000 1076884752 /nfs/dbraw/zinc/88/47/52/1076884752.db2.gz JLUUPHXKJQKUML-GFCCVEGCSA-N 1 2 324.388 2.169 20 10 DECDLO CC[C@@H]([NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1)C1(C(=O)[O-])CCC1 ZINC001609938282 1077953792 /nfs/dbraw/zinc/95/37/92/1077953792.db2.gz WUCXMOVSQCCXMJ-HZPDHXFCSA-N 1 2 319.449 2.376 20 10 DECDLO CNC(=O)[C@H](Cc1ccccc1)[NH2+]Cc1ccc(F)c(F)c1O ZINC001652196351 1079857527 /nfs/dbraw/zinc/85/75/27/1079857527.db2.gz GTXKYHZEMDAJGH-AWEZNQCLSA-N 1 2 320.339 2.117 20 10 DECDLO CS(=O)(=O)c1ccc(C[NH2+]Cc2cccc(Cl)c2O)o1 ZINC001658140969 1080198015 /nfs/dbraw/zinc/19/80/15/1080198015.db2.gz MGYMFIMWIFHVME-UHFFFAOYSA-N 1 2 315.778 2.332 20 10 DECDLO CCOC(=O)[C@@H](F)C1C[NH+](Cc2ccc(Cl)cc2O)C1 ZINC001664843439 1080970670 /nfs/dbraw/zinc/97/06/70/1080970670.db2.gz OVICSPQPHXRWGA-ZDUSSCGKSA-N 1 2 301.745 2.379 20 10 DECDLO Cc1cc(Br)c(O)c(CN2CC3(CC[N@H+]3C)C2)c1 ZINC001276776021 1083603416 /nfs/dbraw/zinc/60/34/16/1083603416.db2.gz WSXJVSKYZXKQBX-UHFFFAOYSA-N 1 2 311.223 2.353 20 10 DECDLO Cc1cc(Br)c(O)c(CN2CC3(CC[N@@H+]3C)C2)c1 ZINC001276776021 1083603427 /nfs/dbraw/zinc/60/34/27/1083603427.db2.gz WSXJVSKYZXKQBX-UHFFFAOYSA-N 1 2 311.223 2.353 20 10 DECDLO COc1ccc(N2CC3(C2)C[NH+](Cc2cccc(=O)[nH]2)C3)cc1 ZINC001276927149 1083684254 /nfs/dbraw/zinc/68/42/54/1083684254.db2.gz MQSVKAJQBKTMIR-UHFFFAOYSA-N 1 2 311.385 2.118 20 10 DECDLO CC(C)(C)NC(=O)[C@H]1CCC2(C[NH+](Cc3ccccc3O)C2)O1 ZINC001277442582 1083972153 /nfs/dbraw/zinc/97/21/53/1083972153.db2.gz XPBXZTABTQUIND-OAHLLOKOSA-N 1 2 318.417 2.040 20 10 DECDLO O=S1(=O)CCC[C@H]([NH2+]Cc2cccc(Cl)c2O)CC1 ZINC000822188351 1090624164 /nfs/dbraw/zinc/62/41/64/1090624164.db2.gz HIOYXDHRONCZBP-NSHDSACASA-N 1 2 303.811 2.103 20 10 DECDLO Oc1cc(C[NH+]2CC3(C2)CCOC3)c(O)cc1Br ZINC001236773196 1138423842 /nfs/dbraw/zinc/42/38/42/1138423842.db2.gz PDDWBQIJYPJZQE-UHFFFAOYSA-N 1 2 314.179 2.083 20 10 DECDLO COc1cc(O)c(C[N@@H+]2C[C@H](F)C[C@@H](CO)C2)c(Cl)c1 ZINC001236797273 1138432220 /nfs/dbraw/zinc/43/22/20/1138432220.db2.gz DMRJIVLDWFZWNV-NXEZZACHSA-N 1 2 303.761 2.207 20 10 DECDLO COc1cc(O)c(C[N@H+]2C[C@H](F)C[C@@H](CO)C2)c(Cl)c1 ZINC001236797273 1138432225 /nfs/dbraw/zinc/43/22/25/1138432225.db2.gz DMRJIVLDWFZWNV-NXEZZACHSA-N 1 2 303.761 2.207 20 10 DECDLO COc1ccc(CN2C[C@H]3C[C@@]3(C[NH+](C)C)C2)c(O)c1Cl ZINC001236810827 1138436268 /nfs/dbraw/zinc/43/62/68/1138436268.db2.gz XVBJRXZKEMPTGI-MLGOLLRUSA-N 1 2 310.825 2.438 20 10 DECDLO COCC[NH+]1CCN(Cc2c(O)ccc(Cl)c2Cl)CC1 ZINC001237079079 1138500439 /nfs/dbraw/zinc/50/04/39/1138500439.db2.gz GYDAWUONFVTKKM-UHFFFAOYSA-N 1 2 319.232 2.463 20 10 DECDLO O=C1NC2(CO1)CC[NH+](Cc1cc(F)cc(Cl)c1O)CC2 ZINC001237806367 1138796490 /nfs/dbraw/zinc/79/64/90/1138796490.db2.gz UZVMADXNPWJUAC-UHFFFAOYSA-N 1 2 314.744 2.259 20 10 DECDLO Oc1cc(Cl)c(F)cc1C[NH+]1CCN(c2cccnn2)CC1 ZINC001237936657 1138811769 /nfs/dbraw/zinc/81/17/69/1138811769.db2.gz KWTXNKGEEBQPBU-UHFFFAOYSA-N 1 2 322.771 2.297 20 10 DECDLO CC(=O)[C@H]1C[N@H+](Cc2ccc3c(c2O)C=CC(C)(C)O3)CCO1 ZINC001249263708 1141865837 /nfs/dbraw/zinc/86/58/37/1141865837.db2.gz STEZDFXKZSYPDK-MRXNPFEDSA-N 1 2 317.385 2.366 20 10 DECDLO CC(=O)[C@H]1C[N@@H+](Cc2ccc3c(c2O)C=CC(C)(C)O3)CCO1 ZINC001249263708 1141865838 /nfs/dbraw/zinc/86/58/38/1141865838.db2.gz STEZDFXKZSYPDK-MRXNPFEDSA-N 1 2 317.385 2.366 20 10 DECDLO CCOc1ccc(N2CC[NH+](CC(=O)N[C@H](C)CC)CC2)cc1 ZINC001253832250 1142974120 /nfs/dbraw/zinc/97/41/20/1142974120.db2.gz WIWFEPSUNYGCAA-OAHLLOKOSA-N 1 2 319.449 2.122 20 10 DECDLO C[C@@H]1C[C@H]1c1nnc(-c2ccc(O)c(C[NH+]3CCOCC3)c2)o1 ZINC001256774283 1143866757 /nfs/dbraw/zinc/86/67/57/1143866757.db2.gz RHWJIDOYHFMTTG-BXUZGUMPSA-N 1 2 315.373 2.398 20 10 DECDLO COCCN(Cc1[nH+]ccn1C)c1ccc(OC)c(OC)c1 ZINC000083212604 185219929 /nfs/dbraw/zinc/21/99/29/185219929.db2.gz GLUOZBVVFAXVHX-UHFFFAOYSA-N 1 2 305.378 2.090 20 10 DECDLO CCC[N@H+](CC(=O)NC)Cc1cc(Cl)cc(C(C)=O)c1O ZINC000050151298 402025925 /nfs/dbraw/zinc/02/59/25/402025925.db2.gz PGZFMQCXJMPSQD-UHFFFAOYSA-N 1 2 312.797 2.206 20 10 DECDLO CCC[N@@H+](CC(=O)NC)Cc1cc(Cl)cc(C(C)=O)c1O ZINC000050151298 402025927 /nfs/dbraw/zinc/02/59/27/402025927.db2.gz PGZFMQCXJMPSQD-UHFFFAOYSA-N 1 2 312.797 2.206 20 10 DECDLO COC(=O)C[N@H+](CCSC)Cc1cc(Cl)ccc1O ZINC000178859566 402547872 /nfs/dbraw/zinc/54/78/72/402547872.db2.gz KTINJNOFOJLIHC-UHFFFAOYSA-N 1 2 303.811 2.384 20 10 DECDLO COC(=O)C[N@@H+](CCSC)Cc1cc(Cl)ccc1O ZINC000178859566 402547874 /nfs/dbraw/zinc/54/78/74/402547874.db2.gz KTINJNOFOJLIHC-UHFFFAOYSA-N 1 2 303.811 2.384 20 10 DECDLO Cc1occc1C[N@@H+](C)CC(=O)NCc1ccc(N(C)C)cc1 ZINC000178725839 402531040 /nfs/dbraw/zinc/53/10/40/402531040.db2.gz STEKMASUMNVLAB-UHFFFAOYSA-N 1 2 315.417 2.402 20 10 DECDLO Cc1occc1C[N@H+](C)CC(=O)NCc1ccc(N(C)C)cc1 ZINC000178725839 402531041 /nfs/dbraw/zinc/53/10/41/402531041.db2.gz STEKMASUMNVLAB-UHFFFAOYSA-N 1 2 315.417 2.402 20 10 DECDLO Oc1c(Cl)cccc1C[N@@H+]1CCC[C@@H]1CN1CCOCC1 ZINC000179803080 402601065 /nfs/dbraw/zinc/60/10/65/402601065.db2.gz UCQBWGVTXCNPDN-CQSZACIVSA-N 1 2 310.825 2.342 20 10 DECDLO Oc1c(Cl)cccc1C[N@H+]1CCC[C@@H]1CN1CCOCC1 ZINC000179803080 402601067 /nfs/dbraw/zinc/60/10/67/402601067.db2.gz UCQBWGVTXCNPDN-CQSZACIVSA-N 1 2 310.825 2.342 20 10 DECDLO CC[C@@H]1C[N@H+](Cc2ccc([N+](=O)[O-])c(OC)c2O)C[C@@H](C)O1 ZINC000278164000 402861409 /nfs/dbraw/zinc/86/14/09/402861409.db2.gz DVZNREHSCGEPMS-ZYHUDNBSSA-N 1 2 310.350 2.308 20 10 DECDLO CC[C@@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])c(OC)c2O)C[C@@H](C)O1 ZINC000278164000 402861410 /nfs/dbraw/zinc/86/14/10/402861410.db2.gz DVZNREHSCGEPMS-ZYHUDNBSSA-N 1 2 310.350 2.308 20 10 DECDLO CC[C@]1(C)C[N@@H+](Cc2ccc([N+](=O)[O-])c(OC)c2O)CCO1 ZINC000278373925 402863653 /nfs/dbraw/zinc/86/36/53/402863653.db2.gz KYKZSFDXZNLQKY-OAHLLOKOSA-N 1 2 310.350 2.310 20 10 DECDLO CCCOc1ccc(C[N@@H+]2CCN(C(C)C)C(=O)C2)c(O)c1 ZINC000272494759 402944214 /nfs/dbraw/zinc/94/42/14/402944214.db2.gz FSKJNTBEVKNTRX-UHFFFAOYSA-N 1 2 306.406 2.234 20 10 DECDLO CCCOc1ccc(C[N@H+]2CCN(C(C)C)C(=O)C2)c(O)c1 ZINC000272494759 402944217 /nfs/dbraw/zinc/94/42/17/402944217.db2.gz FSKJNTBEVKNTRX-UHFFFAOYSA-N 1 2 306.406 2.234 20 10 DECDLO COc1cc(Cl)cc(C[N@@H+]2CC[S@](=O)[C@H](C)[C@H]2C)c1O ZINC000273706817 403027379 /nfs/dbraw/zinc/02/73/79/403027379.db2.gz FKTHWRQBMIANPT-ZLMDCXFVSA-N 1 2 317.838 2.396 20 10 DECDLO COc1cc(Cl)cc(C[N@H+]2CC[S@](=O)[C@H](C)[C@H]2C)c1O ZINC000273706817 403027381 /nfs/dbraw/zinc/02/73/81/403027381.db2.gz FKTHWRQBMIANPT-ZLMDCXFVSA-N 1 2 317.838 2.396 20 10 DECDLO CN(C)c1ccc(C[N@H+](CC(N)=O)Cc2ccccc2)cc1F ZINC000271190293 403276434 /nfs/dbraw/zinc/27/64/34/403276434.db2.gz PDRKLICFSXUCKI-UHFFFAOYSA-N 1 2 315.392 2.379 20 10 DECDLO CN(C)c1ccc(C[N@@H+](CC(N)=O)Cc2ccccc2)cc1F ZINC000271190293 403276436 /nfs/dbraw/zinc/27/64/36/403276436.db2.gz PDRKLICFSXUCKI-UHFFFAOYSA-N 1 2 315.392 2.379 20 10 DECDLO COc1cc(Cl)cc(C[NH2+][C@@H]2CCc3cn[nH]c3C2)c1O ZINC000359961432 404810920 /nfs/dbraw/zinc/81/09/20/404810920.db2.gz SEXNZTWFUYURQT-GFCCVEGCSA-N 1 2 307.781 2.424 20 10 DECDLO C[C@H]([NH2+]C[C@H]1COCCN1)c1ccc(Cl)c(Cl)c1O ZINC000530228241 405777034 /nfs/dbraw/zinc/77/70/34/405777034.db2.gz ZFIRQHSEUGJKDI-IUCAKERBSA-N 1 2 305.205 2.338 20 10 DECDLO Cc1ccc(C(=O)N2CCC[C@H](c3[nH+]ccn3C)C2)c(O)c1O ZINC000373117770 227105284 /nfs/dbraw/zinc/10/52/84/227105284.db2.gz KEZMOFJZOAVPLX-LBPRGKRZSA-N 1 2 315.373 2.160 20 10 DECDLO COc1cc(Cl)cc(C[N@@H+]2CCN(C)C(=O)C2(C)C)c1O ZINC000184698331 277378917 /nfs/dbraw/zinc/37/89/17/277378917.db2.gz XLSHFHHPQHATBA-UHFFFAOYSA-N 1 2 312.797 2.107 20 10 DECDLO COc1cc(Cl)cc(C[N@H+]2CCN(C)C(=O)C2(C)C)c1O ZINC000184698331 277378918 /nfs/dbraw/zinc/37/89/18/277378918.db2.gz XLSHFHHPQHATBA-UHFFFAOYSA-N 1 2 312.797 2.107 20 10 DECDLO NC(=O)[C@@H]1[C@@H]2CCC[C@@H]2C[N@@H+]1Cc1c(O)ccc(Cl)c1F ZINC000364586607 303319424 /nfs/dbraw/zinc/31/94/24/303319424.db2.gz ZJRIHFOEHJTRCV-NUPCCRGMSA-N 1 2 312.772 2.271 20 10 DECDLO NC(=O)[C@@H]1[C@@H]2CCC[C@@H]2C[N@H+]1Cc1c(O)ccc(Cl)c1F ZINC000364586607 303319426 /nfs/dbraw/zinc/31/94/26/303319426.db2.gz ZJRIHFOEHJTRCV-NUPCCRGMSA-N 1 2 312.772 2.271 20 10 DECDLO CN(C)c1ccc(/C=C\C[NH+]2CCN(C(=O)C3CC3)CC2)cc1 ZINC000835025743 649867963 /nfs/dbraw/zinc/86/79/63/649867963.db2.gz MNSGLCHMBZJWBI-ARJAWSKDSA-N 1 2 313.445 2.320 20 10 DECDLO CCOc1ccc(O)c(C[N@@H+]2CCN(CC(C)C)C(=O)C2)c1 ZINC000190102438 521144721 /nfs/dbraw/zinc/14/47/21/521144721.db2.gz OOBVDHWKRMCOMB-UHFFFAOYSA-N 1 2 306.406 2.091 20 10 DECDLO CCOc1ccc(O)c(C[N@H+]2CCN(CC(C)C)C(=O)C2)c1 ZINC000190102438 521144730 /nfs/dbraw/zinc/14/47/30/521144730.db2.gz OOBVDHWKRMCOMB-UHFFFAOYSA-N 1 2 306.406 2.091 20 10 DECDLO C[C@@](O)(C[NH2+]Cc1cc([N+](=O)[O-])ccc1O)c1cccs1 ZINC000265829271 525774079 /nfs/dbraw/zinc/77/40/79/525774079.db2.gz ZXTQKKRJAYNIRC-CQSZACIVSA-N 1 2 308.359 2.359 20 10 DECDLO COc1ccc(O)c([C@@H](C)NC(=O)CCCn2cc[nH+]c2)c1 ZINC000735858659 633545354 /nfs/dbraw/zinc/54/53/54/633545354.db2.gz XLSSMVVAMPIVSD-GFCCVEGCSA-N 1 2 303.362 2.255 20 10 DECDLO c1ccc(-n2nnnc2C[NH2+]Cc2ccc3c(c2)CCCO3)cc1 ZINC000921612861 633746430 /nfs/dbraw/zinc/74/64/30/633746430.db2.gz XQACEYWCUVXVSR-UHFFFAOYSA-N 1 2 321.384 2.277 20 10 DECDLO CNC(=O)NC1CC[NH+](Cc2cc(Cl)c(F)cc2O)CC1 ZINC000840974218 635977111 /nfs/dbraw/zinc/97/71/11/635977111.db2.gz AXMWLXYGLOYDKL-UHFFFAOYSA-N 1 2 315.776 2.078 20 10 DECDLO COc1cc(C)cc(CNc2ccc(N(C)CCO)c[nH+]2)c1O ZINC000894347056 636911627 /nfs/dbraw/zinc/91/16/27/636911627.db2.gz YODUKXDQHOQCPQ-UHFFFAOYSA-N 1 2 317.389 2.145 20 10 DECDLO COc1ccc(N2CC[C@H](Nc3cc(N(C)C)nc[nH+]3)C2)cc1 ZINC000894484401 637065521 /nfs/dbraw/zinc/06/55/21/637065521.db2.gz GNRYRCKSQAXRIG-ZDUSSCGKSA-N 1 2 313.405 2.242 20 10 DECDLO COc1ccc(N2CC[C@H](Nc3cc(N(C)C)[nH+]cn3)C2)cc1 ZINC000894484401 637065527 /nfs/dbraw/zinc/06/55/27/637065527.db2.gz GNRYRCKSQAXRIG-ZDUSSCGKSA-N 1 2 313.405 2.242 20 10 DECDLO Cc1cc(O)c(C[N@H+](C)C[C@@H]2CCS(=O)(=O)C2)c(Cl)c1 ZINC000840918624 650382084 /nfs/dbraw/zinc/38/20/84/650382084.db2.gz WUDHMHQNCGZBNQ-NSHDSACASA-N 1 2 317.838 2.221 20 10 DECDLO Cc1cc(O)c(C[N@@H+](C)C[C@@H]2CCS(=O)(=O)C2)c(Cl)c1 ZINC000840918624 650382085 /nfs/dbraw/zinc/38/20/85/650382085.db2.gz WUDHMHQNCGZBNQ-NSHDSACASA-N 1 2 317.838 2.221 20 10 DECDLO Cc1cc(=O)[nH]c(C(C)(C)[NH2+]Cc2cc(F)cc(F)c2O)n1 ZINC000895389980 637993853 /nfs/dbraw/zinc/99/38/53/637993853.db2.gz UFLZPCNFYKQJLM-UHFFFAOYSA-N 1 2 309.316 2.499 20 10 DECDLO OC[C@@]1(C(F)(F)F)CC[N@H+](Cc2ccc(F)c(F)c2O)C1 ZINC000895838415 638219544 /nfs/dbraw/zinc/21/95/44/638219544.db2.gz YQNNGQVQLSZJAJ-GFCCVEGCSA-N 1 2 311.250 2.417 20 10 DECDLO OC[C@@]1(C(F)(F)F)CC[N@@H+](Cc2ccc(F)c(F)c2O)C1 ZINC000895838415 638219548 /nfs/dbraw/zinc/21/95/48/638219548.db2.gz YQNNGQVQLSZJAJ-GFCCVEGCSA-N 1 2 311.250 2.417 20 10 DECDLO C[NH+]1CCN(c2ccc(C[NH2+]C[C@@H]([NH3+])c3ccccc3)cc2)CC1 ZINC000841036901 650410760 /nfs/dbraw/zinc/41/07/60/650410760.db2.gz NVASARVDWMYTBJ-HXUWFJFHSA-N 1 2 324.472 2.228 20 10 DECDLO CCN1CCC[C@@H]([NH2+]Cc2cc(Cl)cc(F)c2O)C1=O ZINC000896733672 638656673 /nfs/dbraw/zinc/65/66/73/638656673.db2.gz MSRIPHQSCWNBBP-GFCCVEGCSA-N 1 2 300.761 2.285 20 10 DECDLO C[C@@H]([NH2+][C@@H](C)CC(N)=O)c1cc(Br)cc(F)c1O ZINC000756662161 639683218 /nfs/dbraw/zinc/68/32/18/639683218.db2.gz WSXYSRBDRKVDOA-NKWVEPMBSA-N 1 2 319.174 2.208 20 10 DECDLO CC[NH+](CC)C[C@H](C)NCc1ccc([N+](=O)[O-])c(OC)c1O ZINC000775014882 641993779 /nfs/dbraw/zinc/99/37/79/641993779.db2.gz VKFLIMUGIAVDFV-NSHDSACASA-N 1 2 311.382 2.129 20 10 DECDLO CN(Cc1ccccc1O)C(=O)c1cc(-n2cc[nH+]c2)ccn1 ZINC000777797430 642307652 /nfs/dbraw/zinc/30/76/52/642307652.db2.gz SGRKTCMIKXMOFU-UHFFFAOYSA-N 1 2 308.341 2.245 20 10 DECDLO Oc1c(Br)cccc1C[NH2+][C@H]1CCn2ccnc2C1 ZINC000778188525 642349962 /nfs/dbraw/zinc/34/99/62/642349962.db2.gz HMQOJLXRQFMZRM-NSHDSACASA-N 1 2 322.206 2.456 20 10 DECDLO C[C@H](C(=O)OCC(=O)c1ccc(O)c(O)c1)[NH+]1CCCCCC1 ZINC000783785464 643052983 /nfs/dbraw/zinc/05/29/83/643052983.db2.gz RGXUWBWAFPVHLQ-GFCCVEGCSA-N 1 2 321.373 2.088 20 10 DECDLO O=C1CCCN1[C@@H]1CC[N@@H+](Cc2c(O)ccc(Cl)c2F)C1 ZINC000792186541 644086673 /nfs/dbraw/zinc/08/66/73/644086673.db2.gz OXKWQVPVJFDIFD-SNVBAGLBSA-N 1 2 312.772 2.381 20 10 DECDLO O=C1CCCN1[C@@H]1CC[N@H+](Cc2c(O)ccc(Cl)c2F)C1 ZINC000792186541 644086674 /nfs/dbraw/zinc/08/66/74/644086674.db2.gz OXKWQVPVJFDIFD-SNVBAGLBSA-N 1 2 312.772 2.381 20 10 DECDLO CC(C)S(=O)(=O)CC[NH2+]Cc1cc(Cl)cc(F)c1O ZINC000809789852 646283336 /nfs/dbraw/zinc/28/33/36/646283336.db2.gz KAMLXYKKZHGFLI-UHFFFAOYSA-N 1 2 309.790 2.098 20 10 DECDLO CSCC[C@H]([NH2+]Cc1cccc(Cl)c1O)C(=O)N(C)C ZINC000809785247 646284128 /nfs/dbraw/zinc/28/41/28/646284128.db2.gz UHDNRBFQFKSNLV-LBPRGKRZSA-N 1 2 316.854 2.345 20 10 DECDLO NC(=O)[C@@H]1CCC[C@H]([NH2+]Cc2cc(Cl)c(F)cc2O)C1 ZINC000816553541 647151785 /nfs/dbraw/zinc/15/17/85/647151785.db2.gz ZBBRFAQJFQYOAD-SCZZXKLOSA-N 1 2 300.761 2.318 20 10 DECDLO COC(=O)C1(C)C[NH+](Cc2cc(Br)ccc2O)C1 ZINC000822534764 648227487 /nfs/dbraw/zinc/22/74/87/648227487.db2.gz WKWPNIQQVHBUNV-UHFFFAOYSA-N 1 2 314.179 2.150 20 10 DECDLO OCCCN1CCC[C@@H]1C[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000824565411 648611510 /nfs/dbraw/zinc/61/15/10/648611510.db2.gz UGVUYNWEXRSSRL-GFCCVEGCSA-N 1 2 316.804 2.121 20 10 DECDLO Cc1cc(O)c(C[NH+]2CCN([C@H]3CCOC3)CC2)cc1Cl ZINC000827125828 648976119 /nfs/dbraw/zinc/97/61/19/648976119.db2.gz RYWVMGXAFKANKQ-AWEZNQCLSA-N 1 2 310.825 2.261 20 10 DECDLO C[C@H](NC(=O)[C@@H]1COCC[N@@H+]1C1CCCC1)c1ccccc1O ZINC000827970188 649114148 /nfs/dbraw/zinc/11/41/48/649114148.db2.gz ZAELRDAGLPYFPF-BBRMVZONSA-N 1 2 318.417 2.213 20 10 DECDLO C[C@H](NC(=O)[C@@H]1COCC[N@H+]1C1CCCC1)c1ccccc1O ZINC000827970188 649114149 /nfs/dbraw/zinc/11/41/49/649114149.db2.gz ZAELRDAGLPYFPF-BBRMVZONSA-N 1 2 318.417 2.213 20 10 DECDLO O=C(c1cccc(O)c1O)N1CC[NH+](Cc2ccccc2)CC1 ZINC000184770425 649370820 /nfs/dbraw/zinc/37/08/20/649370820.db2.gz MPQNKJSXMYRUQW-UHFFFAOYSA-N 1 2 312.369 2.056 20 10 DECDLO COC(=O)[C@@H]1C[N@H+](Cc2cc(Cl)cc(C)c2O)C[C@H](C)O1 ZINC000846060501 651305098 /nfs/dbraw/zinc/30/50/98/651305098.db2.gz NNVDMVAQNHIKJF-GWCFXTLKSA-N 1 2 313.781 2.116 20 10 DECDLO COC(=O)[C@@H]1C[N@@H+](Cc2cc(Cl)cc(C)c2O)C[C@H](C)O1 ZINC000846060501 651305100 /nfs/dbraw/zinc/30/51/00/651305100.db2.gz NNVDMVAQNHIKJF-GWCFXTLKSA-N 1 2 313.781 2.116 20 10 DECDLO CCn1ccnc1C[N@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000106381816 651334433 /nfs/dbraw/zinc/33/44/33/651334433.db2.gz KZTRDXTWKRWDAA-UHFFFAOYSA-N 1 2 314.433 2.372 20 10 DECDLO CCn1ccnc1C[N@@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000106381816 651334434 /nfs/dbraw/zinc/33/44/34/651334434.db2.gz KZTRDXTWKRWDAA-UHFFFAOYSA-N 1 2 314.433 2.372 20 10 DECDLO COC[C@@H](C)NC(=[NH2+])NCc1cc(Cl)cc(Cl)c1O ZINC000849028510 651587840 /nfs/dbraw/zinc/58/78/40/651587840.db2.gz LMTDKZWAIMBIMP-SSDOTTSWSA-N 1 2 306.193 2.348 20 10 DECDLO O=C(NC[C@H]1CC[N@@H+]1Cc1ccccc1)C1=CC(=O)CS1 ZINC000856357601 651906461 /nfs/dbraw/zinc/90/64/61/651906461.db2.gz MPCWJXGNOZLURN-CYBMUJFWSA-N 1 2 302.399 2.458 20 10 DECDLO O=C(NC[C@H]1CC[N@H+]1Cc1ccccc1)C1=CC(=O)CS1 ZINC000856357601 651906466 /nfs/dbraw/zinc/90/64/66/651906466.db2.gz MPCWJXGNOZLURN-CYBMUJFWSA-N 1 2 302.399 2.458 20 10 DECDLO COCc1n[nH]c(C[NH2+][C@H](C)c2cc3c(cc2O)CCCC3)n1 ZINC000850513981 651942989 /nfs/dbraw/zinc/94/29/89/651942989.db2.gz KBWTTXODJVLXGW-LLVKDONJSA-N 1 2 316.405 2.386 20 10 DECDLO COCc1n[nH]c(C[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3F)n1 ZINC000850514565 651943048 /nfs/dbraw/zinc/94/30/48/651943048.db2.gz NNYBTKSAAPAVNU-WCBMZHEXSA-N 1 2 306.341 2.134 20 10 DECDLO COC(=O)Cc1cc[nH+]c(NCc2cccc(OC)c2O)c1 ZINC000853258732 652530688 /nfs/dbraw/zinc/53/06/88/652530688.db2.gz AZNDEDJQXJTEJC-UHFFFAOYSA-N 1 2 302.330 2.123 20 10 DECDLO CC[C@@H]([NH2+]CCCS(=O)(=O)NC)c1cccc(Cl)c1O ZINC000866458353 687579127 /nfs/dbraw/zinc/57/91/27/687579127.db2.gz HUKDEYGPHJFSEQ-GFCCVEGCSA-N 1 2 320.842 2.026 20 10 DECDLO C[N@H+](Cc1cnc[nH]1)Cc1ccc(N2CCC(O)CC2)cc1 ZINC000877619473 690170067 /nfs/dbraw/zinc/17/00/67/690170067.db2.gz AGNFDUPMFQXQOW-UHFFFAOYSA-N 1 2 300.406 2.003 20 10 DECDLO C[N@@H+](Cc1cnc[nH]1)Cc1ccc(N2CCC(O)CC2)cc1 ZINC000877619473 690170070 /nfs/dbraw/zinc/17/00/70/690170070.db2.gz AGNFDUPMFQXQOW-UHFFFAOYSA-N 1 2 300.406 2.003 20 10 DECDLO OCCC1(CCO)CC[NH+](Cc2cccc(Cl)c2O)CC1 ZINC000877690455 690192082 /nfs/dbraw/zinc/19/20/82/690192082.db2.gz FQEDPNAERYMESM-UHFFFAOYSA-N 1 2 313.825 2.393 20 10 DECDLO CCOC(=O)[C@@]1(C)C[N@H+](Cc2cc(Cl)ccc2O)CCO1 ZINC000877704919 690197350 /nfs/dbraw/zinc/19/73/50/690197350.db2.gz XMQCRKJKKZELSQ-OAHLLOKOSA-N 1 2 313.781 2.200 20 10 DECDLO CCOC(=O)[C@@]1(C)C[N@@H+](Cc2cc(Cl)ccc2O)CCO1 ZINC000877704919 690197353 /nfs/dbraw/zinc/19/73/53/690197353.db2.gz XMQCRKJKKZELSQ-OAHLLOKOSA-N 1 2 313.781 2.200 20 10 DECDLO C[C@]1(NC(=O)C(F)(F)F)CC[N@H+](Cc2ccccc2O)C1 ZINC000877775362 690223282 /nfs/dbraw/zinc/22/32/82/690223282.db2.gz LIBKUUPVRBNTAN-ZDUSSCGKSA-N 1 2 302.296 2.035 20 10 DECDLO C[C@]1(NC(=O)C(F)(F)F)CC[N@@H+](Cc2ccccc2O)C1 ZINC000877775362 690223283 /nfs/dbraw/zinc/22/32/83/690223283.db2.gz LIBKUUPVRBNTAN-ZDUSSCGKSA-N 1 2 302.296 2.035 20 10 DECDLO CCOc1ccc(C[NH2+]Cc2nc(CSC)n[nH]2)c(O)c1 ZINC000886327586 692057402 /nfs/dbraw/zinc/05/74/02/692057402.db2.gz MWLHPPDTPICAEY-UHFFFAOYSA-N 1 2 308.407 2.062 20 10 DECDLO CC(C)[C@@H](C[NH2+][C@H](C)c1c([O-])cccc1F)N1CC[NH+](C)CC1 ZINC000886500212 692094439 /nfs/dbraw/zinc/09/44/39/692094439.db2.gz LHMVSWZOSYMLMN-GDBMZVCRSA-N 1 2 323.456 2.454 20 10 DECDLO COC(=O)c1cc2[nH+]c[nH]c2c(NCc2ccc(O)c(O)c2)c1 ZINC001169994762 785828670 /nfs/dbraw/zinc/82/86/70/785828670.db2.gz GZXPVBOYHMMMSD-UHFFFAOYSA-N 1 2 313.313 2.373 20 10 DECDLO Cn1cc(C[NH2+]Cc2cc(Br)cc(F)c2O)cn1 ZINC000715795976 792512764 /nfs/dbraw/zinc/51/27/64/792512764.db2.gz LFRBLNMIZGZAFU-UHFFFAOYSA-N 1 2 314.158 2.317 20 10 DECDLO O=C(c1ccco1)N1CCC[N@@H+](Cc2c(O)cccc2F)CC1 ZINC001137838660 796144371 /nfs/dbraw/zinc/14/43/71/796144371.db2.gz GIVNSEHLTYWSKV-UHFFFAOYSA-N 1 2 318.348 2.472 20 10 DECDLO O=C(c1ccco1)N1CCC[N@H+](Cc2c(O)cccc2F)CC1 ZINC001137838660 796144372 /nfs/dbraw/zinc/14/43/72/796144372.db2.gz GIVNSEHLTYWSKV-UHFFFAOYSA-N 1 2 318.348 2.472 20 10 DECDLO COc1cc(N2CC[NH+](Cc3cccc(F)c3O)CC2)ccn1 ZINC001138131280 796168675 /nfs/dbraw/zinc/16/86/75/796168675.db2.gz VACJVQIOGZYOOF-UHFFFAOYSA-N 1 2 317.364 2.257 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[NH+]1CC2(C1)CCOCC2 ZINC001139126899 796327280 /nfs/dbraw/zinc/32/72/80/796327280.db2.gz AXFLVIYWWHOMQS-UHFFFAOYSA-N 1 2 315.369 2.419 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CC[C@@H](O)[C@@H](C)C1 ZINC001139127364 796328978 /nfs/dbraw/zinc/32/89/78/796328978.db2.gz UGFVGNPYFUQELW-SMDDNHRTSA-N 1 2 303.358 2.010 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CC[C@@H](O)[C@@H](C)C1 ZINC001139127364 796328985 /nfs/dbraw/zinc/32/89/85/796328985.db2.gz UGFVGNPYFUQELW-SMDDNHRTSA-N 1 2 303.358 2.010 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CC[C@H]2COC[C@@H]2C1 ZINC001139130925 796331081 /nfs/dbraw/zinc/33/10/81/796331081.db2.gz JXMYOLDVJKFOOZ-STQMWFEESA-N 1 2 315.369 2.275 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CC[C@H]2COC[C@@H]2C1 ZINC001139130925 796331084 /nfs/dbraw/zinc/33/10/84/796331084.db2.gz JXMYOLDVJKFOOZ-STQMWFEESA-N 1 2 315.369 2.275 20 10 DECDLO CCOC(=O)C1C[NH+](Cc2c(O)cccc2Br)C1 ZINC001140100835 796476728 /nfs/dbraw/zinc/47/67/28/796476728.db2.gz CVOOXBJGSVUTFI-UHFFFAOYSA-N 1 2 314.179 2.150 20 10 DECDLO CCn1cc2c(n1)C[N@@H+](Cc1cc(F)ccc1O)C[C@H]2COC ZINC001140063059 796471792 /nfs/dbraw/zinc/47/17/92/796471792.db2.gz JIZAJVMOQKNHRN-ZDUSSCGKSA-N 1 2 319.380 2.494 20 10 DECDLO CCn1cc2c(n1)C[N@H+](Cc1cc(F)ccc1O)C[C@H]2COC ZINC001140063059 796471797 /nfs/dbraw/zinc/47/17/97/796471797.db2.gz JIZAJVMOQKNHRN-ZDUSSCGKSA-N 1 2 319.380 2.494 20 10 DECDLO Cc1ccc(C)c(C[N@@H+]2CCN(c3ccccn3)C(=O)C2)c1O ZINC001140184856 796487211 /nfs/dbraw/zinc/48/72/11/796487211.db2.gz IMHCGYSGMJDJCV-UHFFFAOYSA-N 1 2 311.385 2.253 20 10 DECDLO Cc1ccc(C)c(C[N@H+]2CCN(c3ccccn3)C(=O)C2)c1O ZINC001140184856 796487213 /nfs/dbraw/zinc/48/72/13/796487213.db2.gz IMHCGYSGMJDJCV-UHFFFAOYSA-N 1 2 311.385 2.253 20 10 DECDLO CC(C)(C(N)=O)C1CC[NH+](Cc2c(O)cc(F)cc2F)CC1 ZINC001140583697 796541931 /nfs/dbraw/zinc/54/19/31/796541931.db2.gz RBXALAOJEWMYNV-UHFFFAOYSA-N 1 2 312.360 2.394 20 10 DECDLO Oc1cc(F)cc(F)c1C[NH+]1CCC(N2CC(F)C2)CC1 ZINC001140583865 796541976 /nfs/dbraw/zinc/54/19/76/796541976.db2.gz WOLVQPSRZLTKLK-UHFFFAOYSA-N 1 2 300.324 2.289 20 10 DECDLO C[C@@H]1CN(C2C[NH+](Cc3cc(Cl)ccc3O)C2)C[C@H](C)O1 ZINC001203665601 796559947 /nfs/dbraw/zinc/55/99/47/796559947.db2.gz PAKKJVDPJMKHKG-TXEJJXNPSA-N 1 2 310.825 2.339 20 10 DECDLO CCC[N@H+](CC(=O)OCC)Cc1c(O)cc(OC)cc1OC ZINC001141028828 796620482 /nfs/dbraw/zinc/62/04/82/796620482.db2.gz BDLZETLNPYVODK-UHFFFAOYSA-N 1 2 311.378 2.185 20 10 DECDLO CCC[N@@H+](CC(=O)OCC)Cc1c(O)cc(OC)cc1OC ZINC001141028828 796620485 /nfs/dbraw/zinc/62/04/85/796620485.db2.gz BDLZETLNPYVODK-UHFFFAOYSA-N 1 2 311.378 2.185 20 10 DECDLO COc1cccc(CN2CC([NH+]3CCC(F)(F)CC3)C2)c1O ZINC001203597302 800086908 /nfs/dbraw/zinc/08/69/08/800086908.db2.gz YWPQDUYSGAEPJO-UHFFFAOYSA-N 1 2 312.360 2.316 20 10 DECDLO CCN1C[C@@H](C)[N@H+](Cc2ccc(N3CCCC3)cc2)CC1=O ZINC001204328898 800205664 /nfs/dbraw/zinc/20/56/64/800205664.db2.gz RXURXQZKXLSAFK-OAHLLOKOSA-N 1 2 301.434 2.339 20 10 DECDLO CCN1C[C@@H](C)[N@@H+](Cc2ccc(N3CCCC3)cc2)CC1=O ZINC001204328898 800205668 /nfs/dbraw/zinc/20/56/68/800205668.db2.gz RXURXQZKXLSAFK-OAHLLOKOSA-N 1 2 301.434 2.339 20 10 DECDLO CCOC(=O)C[N@H+](Cc1cc(O)c(O)c(OC)c1)C1CCCC1 ZINC001204350821 800207899 /nfs/dbraw/zinc/20/78/99/800207899.db2.gz JWBYLAJYVDAQCK-UHFFFAOYSA-N 1 2 323.389 2.414 20 10 DECDLO CCOC(=O)C[N@@H+](Cc1cc(O)c(O)c(OC)c1)C1CCCC1 ZINC001204350821 800207903 /nfs/dbraw/zinc/20/79/03/800207903.db2.gz JWBYLAJYVDAQCK-UHFFFAOYSA-N 1 2 323.389 2.414 20 10 DECDLO CC1=NC2(CC[NH+](Cc3cccc(Cl)c3O)CC2)C(=O)N1C ZINC001231912981 801749828 /nfs/dbraw/zinc/74/98/28/801749828.db2.gz BRTSAVISBOVQLV-UHFFFAOYSA-N 1 2 321.808 2.271 20 10 DECDLO Oc1c(Cl)cccc1C[N@@H+]1CC[C@@H](Oc2ncccn2)C1 ZINC001231913520 801749973 /nfs/dbraw/zinc/74/99/73/801749973.db2.gz LGMSFDOLPRRFMJ-GFCCVEGCSA-N 1 2 305.765 2.489 20 10 DECDLO C[N@H+](Cc1cc(O)c(O)c(O)c1)Cc1cccc2c1OCO2 ZINC001233016250 802002678 /nfs/dbraw/zinc/00/26/78/802002678.db2.gz QJMGDNJIUHXNQX-UHFFFAOYSA-N 1 2 303.314 2.164 20 10 DECDLO C[N@@H+](Cc1cc(O)c(O)c(O)c1)Cc1cccc2c1OCO2 ZINC001233016250 802002683 /nfs/dbraw/zinc/00/26/83/802002683.db2.gz QJMGDNJIUHXNQX-UHFFFAOYSA-N 1 2 303.314 2.164 20 10 DECDLO OCC1CC[NH+](Cc2c(O)cc(Br)cc2F)CC1 ZINC001233027928 802006442 /nfs/dbraw/zinc/00/64/42/802006442.db2.gz GMPJAQZJPQKOGK-UHFFFAOYSA-N 1 2 318.186 2.498 20 10 DECDLO C[C@]1(CO)CC[N@H+](Cc2c(O)cc(Br)cc2F)C1 ZINC001233028927 802007809 /nfs/dbraw/zinc/00/78/09/802007809.db2.gz VWUXBXRJSAINPO-ZDUSSCGKSA-N 1 2 318.186 2.498 20 10 DECDLO C[C@]1(CO)CC[N@@H+](Cc2c(O)cc(Br)cc2F)C1 ZINC001233028927 802007814 /nfs/dbraw/zinc/00/78/14/802007814.db2.gz VWUXBXRJSAINPO-ZDUSSCGKSA-N 1 2 318.186 2.498 20 10 DECDLO C[C@@H]1CC[N@H+](Cc2c(O)cc(Br)cc2F)C[C@H]1O ZINC001233029066 802007875 /nfs/dbraw/zinc/00/78/75/802007875.db2.gz YWCBEKWHKLDRQE-AMIZOPFISA-N 1 2 318.186 2.497 20 10 DECDLO C[C@@H]1CC[N@@H+](Cc2c(O)cc(Br)cc2F)C[C@H]1O ZINC001233029066 802007884 /nfs/dbraw/zinc/00/78/84/802007884.db2.gz YWCBEKWHKLDRQE-AMIZOPFISA-N 1 2 318.186 2.497 20 10 DECDLO CC[N@H+](Cc1cc(Cl)cc(OC)c1O)[C@@H](C)C(=O)OC ZINC001233291109 802067062 /nfs/dbraw/zinc/06/70/62/802067062.db2.gz MOHNYQGGGMLIOB-VIFPVBQESA-N 1 2 301.770 2.438 20 10 DECDLO CC[N@@H+](Cc1cc(Cl)cc(OC)c1O)[C@@H](C)C(=O)OC ZINC001233291109 802067070 /nfs/dbraw/zinc/06/70/70/802067070.db2.gz MOHNYQGGGMLIOB-VIFPVBQESA-N 1 2 301.770 2.438 20 10 DECDLO CCO[C@@H]1C[N@H+](Cc2c(O)ccc(F)c2F)[C@@H]2CCCO[C@H]12 ZINC001233332994 802080935 /nfs/dbraw/zinc/08/09/35/802080935.db2.gz FUJYZGVKWLMCNC-XPKDYRNWSA-N 1 2 313.344 2.439 20 10 DECDLO CCO[C@@H]1C[N@@H+](Cc2c(O)ccc(F)c2F)[C@@H]2CCCO[C@H]12 ZINC001233332994 802080942 /nfs/dbraw/zinc/08/09/42/802080942.db2.gz FUJYZGVKWLMCNC-XPKDYRNWSA-N 1 2 313.344 2.439 20 10 DECDLO CC1(C)C(=O)NCC[N@H+]1Cc1cccc(OC(F)(F)F)c1O ZINC001233754308 802197230 /nfs/dbraw/zinc/19/72/30/802197230.db2.gz CYZAYTABLDPJLI-UHFFFAOYSA-N 1 2 318.295 2.001 20 10 DECDLO CC1(C)C(=O)NCC[N@@H+]1Cc1cccc(OC(F)(F)F)c1O ZINC001233754308 802197235 /nfs/dbraw/zinc/19/72/35/802197235.db2.gz CYZAYTABLDPJLI-UHFFFAOYSA-N 1 2 318.295 2.001 20 10 DECDLO C[C@H](C[NH2+][C@@H](C)c1cccc(-c2nn[nH]n2)c1O)c1ccccn1 ZINC001603552234 1069987310 /nfs/dbraw/zinc/98/73/10/1069987310.db2.gz UUIGQCYOKRQVPL-NEPJUHHUSA-N 1 2 324.388 2.422 20 10 DECDLO CCN(CC)c1ccc(C[NH2+]Cc2nnc3n2CCC3)cc1F ZINC001473923680 1060773510 /nfs/dbraw/zinc/77/35/10/1060773510.db2.gz YGVSBMXDUFDXDE-UHFFFAOYSA-N 1 2 317.412 2.499 20 10 DECDLO O=C1N[C@@H]2C[N@H+](Cc3cc(Cl)c(F)cc3O)CC[C@H]2CO1 ZINC001621425344 1078173985 /nfs/dbraw/zinc/17/39/85/1078173985.db2.gz UQMQQCHIWXEVJK-QPUJVOFHSA-N 1 2 314.744 2.115 20 10 DECDLO O=C1N[C@@H]2C[N@@H+](Cc3cc(Cl)c(F)cc3O)CC[C@H]2CO1 ZINC001621425344 1078173987 /nfs/dbraw/zinc/17/39/87/1078173987.db2.gz UQMQQCHIWXEVJK-QPUJVOFHSA-N 1 2 314.744 2.115 20 10 DECDLO CS(=O)(=O)CC[N@H+](Cc1ccc(Cl)cc1O)C1CC1 ZINC001560643150 1075144060 /nfs/dbraw/zinc/14/40/60/1075144060.db2.gz BUUWOTTYRKRMPX-UHFFFAOYSA-N 1 2 303.811 2.055 20 10 DECDLO CS(=O)(=O)CC[N@@H+](Cc1ccc(Cl)cc1O)C1CC1 ZINC001560643150 1075144062 /nfs/dbraw/zinc/14/40/62/1075144062.db2.gz BUUWOTTYRKRMPX-UHFFFAOYSA-N 1 2 303.811 2.055 20 10 DECDLO CC[C@H]([NH2+]C[C@@H](C)C[C@@H](C)O)c1cccc(-c2nn[nH]n2)c1O ZINC001590464899 1076633248 /nfs/dbraw/zinc/63/32/48/1076633248.db2.gz RCXLMTUNNOAHGC-WDMOLILDSA-N 1 2 319.409 2.020 20 10 DECDLO Oc1cccc(F)c1C[NH2+]Cc1csc(-c2nn[nH]n2)c1 ZINC001593540366 1077020239 /nfs/dbraw/zinc/02/02/39/1077020239.db2.gz SXHQHUFMDMKUIM-UHFFFAOYSA-N 1 2 305.338 2.063 20 10 DECDLO Oc1c(F)cc(Cl)cc1C[NH2+]CCOC[C@H]1CCOC1 ZINC001657097709 1080155900 /nfs/dbraw/zinc/15/59/00/1080155900.db2.gz IIYBFXHKMNJUOD-JTQLQIEISA-N 1 2 303.761 2.327 20 10 DECDLO C[C@@H]1C[N@H+](Cc2cc(F)cc(Br)c2O)CC[C@H]1O ZINC001235297487 1084377221 /nfs/dbraw/zinc/37/72/21/1084377221.db2.gz MMZYKLXOVUBRNP-PRHODGIISA-N 1 2 318.186 2.497 20 10 DECDLO C[C@@H]1C[N@@H+](Cc2cc(F)cc(Br)c2O)CC[C@H]1O ZINC001235297487 1084377231 /nfs/dbraw/zinc/37/72/31/1084377231.db2.gz MMZYKLXOVUBRNP-PRHODGIISA-N 1 2 318.186 2.497 20 10 DECDLO C[N@@H+]1CCC12CN(Cc1cc(F)cc(Br)c1O)C2 ZINC001276193695 1091676641 /nfs/dbraw/zinc/67/66/41/1091676641.db2.gz GDQVUUSWHCSTOV-UHFFFAOYSA-N 1 2 315.186 2.184 20 10 DECDLO C[N@H+]1CCC12CN(Cc1cc(F)cc(Br)c1O)C2 ZINC001276193695 1091676646 /nfs/dbraw/zinc/67/66/46/1091676646.db2.gz GDQVUUSWHCSTOV-UHFFFAOYSA-N 1 2 315.186 2.184 20 10 DECDLO CCOC(=O)[C@@H]1CSCC[N@@H+]1Cc1ccc(CC)cc1O ZINC001236791754 1138429519 /nfs/dbraw/zinc/42/95/19/1138429519.db2.gz KBPMNISQHPFAFD-AWEZNQCLSA-N 1 2 309.431 2.435 20 10 DECDLO CCOC(=O)[C@@H]1CSCC[N@H+]1Cc1ccc(CC)cc1O ZINC001236791754 1138429525 /nfs/dbraw/zinc/42/95/25/1138429525.db2.gz KBPMNISQHPFAFD-AWEZNQCLSA-N 1 2 309.431 2.435 20 10 DECDLO Cc1cc(F)cc(C[NH+]2CCN(C(=O)C3CCC3)CC2)c1O ZINC001238069190 1138819873 /nfs/dbraw/zinc/81/98/73/1138819873.db2.gz HVSDCAFHZDOOGH-UHFFFAOYSA-N 1 2 306.381 2.284 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@@H+]2CCCC3(C2)OCCO3)c1O ZINC000090562774 185303719 /nfs/dbraw/zinc/30/37/19/185303719.db2.gz ABTRRQWNWUHDRQ-UHFFFAOYSA-N 1 2 309.337 2.073 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@H+]2CCCC3(C2)OCCO3)c1O ZINC000090562774 185303720 /nfs/dbraw/zinc/30/37/20/185303720.db2.gz ABTRRQWNWUHDRQ-UHFFFAOYSA-N 1 2 309.337 2.073 20 10 DECDLO CN(C)c1ccc(C[N@@H+]2CCOC[C@H]2[C@@H]2CCCO2)cc1F ZINC000377701407 529780423 /nfs/dbraw/zinc/78/04/23/529780423.db2.gz PAVKBOIRVYFCTB-IRXDYDNUSA-N 1 2 308.397 2.272 20 10 DECDLO CN(C)c1ccc(C[N@H+]2CCOC[C@H]2[C@@H]2CCCO2)cc1F ZINC000377701407 529780424 /nfs/dbraw/zinc/78/04/24/529780424.db2.gz PAVKBOIRVYFCTB-IRXDYDNUSA-N 1 2 308.397 2.272 20 10 DECDLO C[C@@H]([NH2+]CCCN1CCOCC1)c1ccc(F)c(F)c1O ZINC000191180717 296124137 /nfs/dbraw/zinc/12/41/37/296124137.db2.gz MDAALESNANMGRA-LLVKDONJSA-N 1 2 300.349 2.043 20 10 DECDLO C[C@@H]([NH2+]C[C@H](C)N1CCOCC1)c1ccc(F)c(F)c1O ZINC000191192901 296131198 /nfs/dbraw/zinc/13/11/98/296131198.db2.gz OAYGNNWRZUUDRQ-WDEREUQCSA-N 1 2 300.349 2.042 20 10 DECDLO COCCN(C)CC[NH2+]Cc1cc(Cl)cc(Cl)c1O ZINC000061375516 184169528 /nfs/dbraw/zinc/16/95/28/184169528.db2.gz MMKJAVGRGDWLCB-UHFFFAOYSA-N 1 2 307.221 2.367 20 10 DECDLO COC(=O)[C@H]1C[C@@H](OC)CC[N@@H+]1Cc1cccc(Cl)c1O ZINC000376821594 533541899 /nfs/dbraw/zinc/54/18/99/533541899.db2.gz FOJCRFNJDZWFJA-WCQYABFASA-N 1 2 313.781 2.198 20 10 DECDLO COC(=O)[C@H]1C[C@@H](OC)CC[N@H+]1Cc1cccc(Cl)c1O ZINC000376821594 533541902 /nfs/dbraw/zinc/54/19/02/533541902.db2.gz FOJCRFNJDZWFJA-WCQYABFASA-N 1 2 313.781 2.198 20 10 DECDLO C[C@@H]([NH2+]CC(F)(F)CO)c1cc(Br)ccc1O ZINC000184694066 402291763 /nfs/dbraw/zinc/29/17/63/402291763.db2.gz DMEIVXUFQHSPSG-SSDOTTSWSA-N 1 2 310.138 2.433 20 10 DECDLO CCCOc1ccc(C[N@@H+]2CCOC[C@]23CCOC3)c(O)c1 ZINC000195017357 402826804 /nfs/dbraw/zinc/82/68/04/402826804.db2.gz DVNJZAMYZPGMTK-QGZVFWFLSA-N 1 2 307.390 2.172 20 10 DECDLO CCCOc1ccc(C[N@H+]2CCOC[C@]23CCOC3)c(O)c1 ZINC000195017357 402826805 /nfs/dbraw/zinc/82/68/05/402826805.db2.gz DVNJZAMYZPGMTK-QGZVFWFLSA-N 1 2 307.390 2.172 20 10 DECDLO COc1c(O)c(C[N@@H+]2CCO[C@H]3CCC[C@@H]32)ccc1[N+](=O)[O-] ZINC000278247131 402862457 /nfs/dbraw/zinc/86/24/57/402862457.db2.gz OTKOAGVQTVOMQI-AAEUAGOBSA-N 1 2 308.334 2.062 20 10 DECDLO COc1c(O)c(C[N@H+]2CCO[C@H]3CCC[C@@H]32)ccc1[N+](=O)[O-] ZINC000278247131 402862459 /nfs/dbraw/zinc/86/24/59/402862459.db2.gz OTKOAGVQTVOMQI-AAEUAGOBSA-N 1 2 308.334 2.062 20 10 DECDLO COC(=O)[C@H]([NH2+]Cc1cc(-c2ccccc2)ccc1O)[C@H](C)O ZINC000276438462 403175165 /nfs/dbraw/zinc/17/51/65/403175165.db2.gz IKHQAAMABVQIHZ-YVEFUNNKSA-N 1 2 315.369 2.071 20 10 DECDLO COC(=O)[C@@H](Cc1ccccc1)[NH2+]Cc1cccc(OC)c1O ZINC000276498812 403181523 /nfs/dbraw/zinc/18/15/23/403181523.db2.gz RJGOLRGDODIHMY-OAHLLOKOSA-N 1 2 315.369 2.275 20 10 DECDLO COCC[C@H]1COCC[N@@H+]1Cc1cc(Cl)c(F)cc1O ZINC000293863737 403585605 /nfs/dbraw/zinc/58/56/05/403585605.db2.gz ILQDONQSCDMPDC-NSHDSACASA-N 1 2 303.761 2.422 20 10 DECDLO COCC[C@H]1COCC[N@H+]1Cc1cc(Cl)c(F)cc1O ZINC000293863737 403585609 /nfs/dbraw/zinc/58/56/09/403585609.db2.gz ILQDONQSCDMPDC-NSHDSACASA-N 1 2 303.761 2.422 20 10 DECDLO C[C@H]([C@@H](C)S(C)(=O)=O)[N@H+](C)Cc1cc(Cl)c(F)cc1O ZINC000295455605 403932984 /nfs/dbraw/zinc/93/29/84/403932984.db2.gz VLXHKJGPZCVLRK-RKDXNWHRSA-N 1 2 323.817 2.438 20 10 DECDLO C[C@H]([C@@H](C)S(C)(=O)=O)[N@@H+](C)Cc1cc(Cl)c(F)cc1O ZINC000295455605 403932992 /nfs/dbraw/zinc/93/29/92/403932992.db2.gz VLXHKJGPZCVLRK-RKDXNWHRSA-N 1 2 323.817 2.438 20 10 DECDLO C[C@@H]1C[C@H](N2CCOCC2)C[N@@H+]1Cc1cccc(Cl)c1O ZINC000377633479 404841233 /nfs/dbraw/zinc/84/12/33/404841233.db2.gz UVVAQXSWAFHJDL-OCCSQVGLSA-N 1 2 310.825 2.341 20 10 DECDLO C[C@@H]1C[C@H](N2CCOCC2)C[N@H+]1Cc1cccc(Cl)c1O ZINC000377633479 404841236 /nfs/dbraw/zinc/84/12/36/404841236.db2.gz UVVAQXSWAFHJDL-OCCSQVGLSA-N 1 2 310.825 2.341 20 10 DECDLO CCOC[C@H]1C[N@H+](Cc2c(O)ccc(Cl)c2F)CCO1 ZINC000529667209 405763538 /nfs/dbraw/zinc/76/35/38/405763538.db2.gz SKZBRJXJXDPCFL-SNVBAGLBSA-N 1 2 303.761 2.422 20 10 DECDLO CCOC[C@H]1C[N@@H+](Cc2c(O)ccc(Cl)c2F)CCO1 ZINC000529667209 405763542 /nfs/dbraw/zinc/76/35/42/405763542.db2.gz SKZBRJXJXDPCFL-SNVBAGLBSA-N 1 2 303.761 2.422 20 10 DECDLO C[C@H]1OCC[C@@]1(O)C[NH2+]Cc1cc(Cl)cc(Cl)c1O ZINC000227970904 225208949 /nfs/dbraw/zinc/20/89/49/225208949.db2.gz ZJTRACSXQLOACR-AMIZOPFISA-N 1 2 306.189 2.329 20 10 DECDLO C[C@H]([NH2+]CCN1C[C@H]2CC[C@@H](C1)O2)c1cc(F)cc(F)c1O ZINC000834891580 649858030 /nfs/dbraw/zinc/85/80/30/649858030.db2.gz OTDLJHANKWHOST-WCFLWFBJSA-N 1 2 312.360 2.184 20 10 DECDLO Cc1c2ccccc2n(C)c1CNc1nc(N(C)C)nc(C)[nH+]1 ZINC000359836650 424834453 /nfs/dbraw/zinc/83/44/53/424834453.db2.gz LQMXAYMQLHIEFG-UHFFFAOYSA-N 1 2 310.405 2.658 20 10 DECDLO Cc1c2ccccc2n(C)c1CNc1nc(C)[nH+]c(N(C)C)n1 ZINC000359836650 424834455 /nfs/dbraw/zinc/83/44/55/424834455.db2.gz LQMXAYMQLHIEFG-UHFFFAOYSA-N 1 2 310.405 2.658 20 10 DECDLO C[C@@H](CS(C)(=O)=O)[N@H+](Cc1cccc(Cl)c1O)C1CC1 ZINC000180245462 524833547 /nfs/dbraw/zinc/83/35/47/524833547.db2.gz NXKLNPMLHDYMAJ-JTQLQIEISA-N 1 2 317.838 2.443 20 10 DECDLO C[C@@H](CS(C)(=O)=O)[N@@H+](Cc1cccc(Cl)c1O)C1CC1 ZINC000180245462 524833554 /nfs/dbraw/zinc/83/35/54/524833554.db2.gz NXKLNPMLHDYMAJ-JTQLQIEISA-N 1 2 317.838 2.443 20 10 DECDLO C[C@@H]([NH2+][C@H]1CNOC1)c1cc(Br)cc(Cl)c1O ZINC000925870650 635976154 /nfs/dbraw/zinc/97/61/54/635976154.db2.gz ZYEKMJPYTVQORI-SVRRBLITSA-N 1 2 321.602 2.362 20 10 DECDLO CCN(CC)c1ccc(C[N@@H+]2CCO[C@@H]([C@@H](C)O)C2)cc1F ZINC000840976569 636005137 /nfs/dbraw/zinc/00/51/37/636005137.db2.gz DQCORGICZKLBTJ-CXAGYDPISA-N 1 2 310.413 2.254 20 10 DECDLO CCN(CC)c1ccc(C[N@H+]2CCO[C@@H]([C@@H](C)O)C2)cc1F ZINC000840976569 636005140 /nfs/dbraw/zinc/00/51/40/636005140.db2.gz DQCORGICZKLBTJ-CXAGYDPISA-N 1 2 310.413 2.254 20 10 DECDLO C[C@@H](O)[C@H]1CC[N@H+](Cc2cc(Br)cc(F)c2O)C1 ZINC000894430633 637034950 /nfs/dbraw/zinc/03/49/50/637034950.db2.gz HOWNZENIYVRVSF-BDAKNGLRSA-N 1 2 318.186 2.497 20 10 DECDLO C[C@@H](O)[C@H]1CC[N@@H+](Cc2cc(Br)cc(F)c2O)C1 ZINC000894430633 637034956 /nfs/dbraw/zinc/03/49/56/637034956.db2.gz HOWNZENIYVRVSF-BDAKNGLRSA-N 1 2 318.186 2.497 20 10 DECDLO Cc1cc(O)c(C[NH+]2CCN(C(=O)N(C)C)CC2)c(Cl)c1 ZINC000840910736 650377839 /nfs/dbraw/zinc/37/78/39/650377839.db2.gz RAIAZNGNQUUGOC-UHFFFAOYSA-N 1 2 311.813 2.153 20 10 DECDLO COc1c(O)c(C[N@@H+]2CCO[C@H](C3CCC3)C2)ccc1[N+](=O)[O-] ZINC000840955785 650394310 /nfs/dbraw/zinc/39/43/10/650394310.db2.gz ZINNBGPQZIHMFX-AWEZNQCLSA-N 1 2 322.361 2.310 20 10 DECDLO COc1c(O)c(C[N@H+]2CCO[C@H](C3CCC3)C2)ccc1[N+](=O)[O-] ZINC000840955785 650394311 /nfs/dbraw/zinc/39/43/11/650394311.db2.gz ZINNBGPQZIHMFX-AWEZNQCLSA-N 1 2 322.361 2.310 20 10 DECDLO OC[C@H](C[C@H]1CCCO1)[NH2+]Cc1cc(Cl)cc(F)c1O ZINC000895746092 638175006 /nfs/dbraw/zinc/17/50/06/638175006.db2.gz BNEGWNZKEAMFLK-NWDGAFQWSA-N 1 2 303.761 2.204 20 10 DECDLO OC[C@]1(C(F)(F)F)CC[N@H+](Cc2ccc(F)c(F)c2O)C1 ZINC000895838416 638219377 /nfs/dbraw/zinc/21/93/77/638219377.db2.gz YQNNGQVQLSZJAJ-LBPRGKRZSA-N 1 2 311.250 2.417 20 10 DECDLO OC[C@]1(C(F)(F)F)CC[N@@H+](Cc2ccc(F)c(F)c2O)C1 ZINC000895838416 638219378 /nfs/dbraw/zinc/21/93/78/638219378.db2.gz YQNNGQVQLSZJAJ-LBPRGKRZSA-N 1 2 311.250 2.417 20 10 DECDLO CN1C[C@H](CC[NH2+]Cc2cc(Cl)c(F)cc2O)CC1=O ZINC000896308074 638460614 /nfs/dbraw/zinc/46/06/14/638460614.db2.gz DEROOYOVQLRSJF-SECBINFHSA-N 1 2 300.761 2.143 20 10 DECDLO C[C@H](CC(N)=O)[NH2+][C@H](C)c1cc(Br)c(F)cc1O ZINC000756661201 639683297 /nfs/dbraw/zinc/68/32/97/639683297.db2.gz PUQOCRMYQQCBBI-RNFRBKRXSA-N 1 2 319.174 2.208 20 10 DECDLO C[C@H](CC(N)=O)[NH2+][C@@H](C)c1cc(Br)cc(F)c1O ZINC000756662163 639683610 /nfs/dbraw/zinc/68/36/10/639683610.db2.gz WSXYSRBDRKVDOA-RQJHMYQMSA-N 1 2 319.174 2.208 20 10 DECDLO Nc1ccc(CCNC(=O)N2CCC[C@@H](c3[nH]cc[nH+]3)C2)cc1 ZINC000841956332 650611956 /nfs/dbraw/zinc/61/19/56/650611956.db2.gz CMPKDGYVMYMYNE-CQSZACIVSA-N 1 2 313.405 2.124 20 10 DECDLO CC[C@H](C(=O)N(C)Cc1ccccc1O)[N@@H+]1CCO[C@@H](CC)C1 ZINC000774043036 641855156 /nfs/dbraw/zinc/85/51/56/641855156.db2.gz IMNVPCMSLIPXNH-JKSUJKDBSA-N 1 2 320.433 2.240 20 10 DECDLO CC[C@H](C(=O)N(C)Cc1ccccc1O)[N@H+]1CCO[C@@H](CC)C1 ZINC000774043036 641855161 /nfs/dbraw/zinc/85/51/61/641855161.db2.gz IMNVPCMSLIPXNH-JKSUJKDBSA-N 1 2 320.433 2.240 20 10 DECDLO COCC[C@]1([NH2+]Cc2cc(Cl)cc(F)c2O)CCOC1 ZINC000775202985 642015694 /nfs/dbraw/zinc/01/56/94/642015694.db2.gz IIUZXXKQVQXBIT-AWEZNQCLSA-N 1 2 303.761 2.470 20 10 DECDLO CC(C)(C)OC(=O)[C@](C)(O)C[NH2+]Cc1cccc(Cl)c1O ZINC000776520700 642180505 /nfs/dbraw/zinc/18/05/05/642180505.db2.gz PFGUJFDOPVWANY-OAHLLOKOSA-N 1 2 315.797 2.228 20 10 DECDLO C[C@@H]([NH2+]CCCON)c1cc(Br)c(F)cc1O ZINC000902426852 643035170 /nfs/dbraw/zinc/03/51/70/643035170.db2.gz XZYKZYKRKSCYEK-SSDOTTSWSA-N 1 2 307.163 2.225 20 10 DECDLO OCC[C@H]1CSCC[N@@H+]1Cc1c(O)ccc(Cl)c1F ZINC000792169955 644083303 /nfs/dbraw/zinc/08/33/03/644083303.db2.gz ODPYILIXPADPGZ-VIFPVBQESA-N 1 2 305.802 2.485 20 10 DECDLO OCC[C@H]1CSCC[N@H+]1Cc1c(O)ccc(Cl)c1F ZINC000792169955 644083308 /nfs/dbraw/zinc/08/33/08/644083308.db2.gz ODPYILIXPADPGZ-VIFPVBQESA-N 1 2 305.802 2.485 20 10 DECDLO CC[C@H]([NH2+]Cc1nnc2n1CCOC2)c1cccc(Cl)c1O ZINC000806161461 645804169 /nfs/dbraw/zinc/80/41/69/645804169.db2.gz KTBJGAVQWSORBJ-LBPRGKRZSA-N 1 2 322.796 2.408 20 10 DECDLO Cn1c[nH+]cc1CC(=O)NCc1ccc(N2CCCCC2)cc1 ZINC000806665803 645860707 /nfs/dbraw/zinc/86/07/07/645860707.db2.gz HDEQMYUMNVNBTG-UHFFFAOYSA-N 1 2 312.417 2.269 20 10 DECDLO C[N@H+](Cc1cc(Cl)c(F)cc1O)CC(C)(C)S(C)(=O)=O ZINC000816516774 647145789 /nfs/dbraw/zinc/14/57/89/647145789.db2.gz QADBAIADBBEASL-UHFFFAOYSA-N 1 2 323.817 2.440 20 10 DECDLO C[N@@H+](Cc1cc(Cl)c(F)cc1O)CC(C)(C)S(C)(=O)=O ZINC000816516774 647145790 /nfs/dbraw/zinc/14/57/90/647145790.db2.gz QADBAIADBBEASL-UHFFFAOYSA-N 1 2 323.817 2.440 20 10 DECDLO CN1CCCc2cc(CNC(=O)[C@@H]3CCc4c[nH+]cn4C3)ccc21 ZINC000816911047 647196489 /nfs/dbraw/zinc/19/64/89/647196489.db2.gz ZRIHXZUFAMGFFK-MRXNPFEDSA-N 1 2 324.428 2.144 20 10 DECDLO COc1ccc(CNC(=O)NCc2cc(C)[nH+]c(C)c2)c(O)c1 ZINC000817171064 647236523 /nfs/dbraw/zinc/23/65/23/647236523.db2.gz QKAWPEBWVMHVDE-UHFFFAOYSA-N 1 2 315.373 2.412 20 10 DECDLO CCOC(=O)C[N@@H+](Cc1ccccc1O)C[C@H]1CCC=CO1 ZINC000822512009 648223039 /nfs/dbraw/zinc/22/30/39/648223039.db2.gz RGSWKCCWHUKRCB-OAHLLOKOSA-N 1 2 305.374 2.450 20 10 DECDLO CCOC(=O)C[N@H+](Cc1ccccc1O)C[C@H]1CCC=CO1 ZINC000822512009 648223042 /nfs/dbraw/zinc/22/30/42/648223042.db2.gz RGSWKCCWHUKRCB-OAHLLOKOSA-N 1 2 305.374 2.450 20 10 DECDLO Cc1cc(O)c(C[NH+]2CCC(S(C)(=O)=O)CC2)cc1Cl ZINC000824856530 648663267 /nfs/dbraw/zinc/66/32/67/648663267.db2.gz ZGOGVVGANUOPTF-UHFFFAOYSA-N 1 2 317.838 2.363 20 10 DECDLO Oc1cc(Br)ccc1CN1CCn2c[nH+]cc2C1 ZINC000825948761 648830373 /nfs/dbraw/zinc/83/03/73/648830373.db2.gz JKUVSXOUZDHFDP-UHFFFAOYSA-N 1 2 308.179 2.367 20 10 DECDLO COc1ccc(O)c([C@@H](C)NC(=O)C[C@H](C)n2cc[nH+]c2)c1 ZINC000845832733 651287584 /nfs/dbraw/zinc/28/75/84/651287584.db2.gz GKQMRDSUDHDDII-NWDGAFQWSA-N 1 2 303.362 2.426 20 10 DECDLO COc1ccc(O)c([C@H](C)[NH2+]Cc2nc([C@H]3CCCO3)n[nH]2)c1 ZINC000848557355 651470785 /nfs/dbraw/zinc/47/07/85/651470785.db2.gz IMVWOMJRTMEZRN-IINYFYTJSA-N 1 2 318.377 2.221 20 10 DECDLO C[C@H](CC[S@@](C)=O)[NH2+]Cc1cccc(Br)c1O ZINC000125428627 684145605 /nfs/dbraw/zinc/14/56/05/684145605.db2.gz PEONSSTWERNOFO-XLFHBGCDSA-N 1 2 320.252 2.401 20 10 DECDLO CS[C@H](CO)[C@@H](C)[NH2+]Cc1cccc(Br)c1O ZINC000219044626 685105708 /nfs/dbraw/zinc/10/57/08/685105708.db2.gz NRWIMIVVOWICAJ-LDYMZIIASA-N 1 2 320.252 2.357 20 10 DECDLO Oc1cccc(Br)c1CN1CCn2c[nH+]cc2C1 ZINC000862370183 686283921 /nfs/dbraw/zinc/28/39/21/686283921.db2.gz JBFDNGTZGRNOOR-UHFFFAOYSA-N 1 2 308.179 2.367 20 10 DECDLO Oc1ccc(Cl)cc1C[NH2+]Cc1nnc(C2CCOCC2)[nH]1 ZINC000865686589 687301904 /nfs/dbraw/zinc/30/19/04/687301904.db2.gz FMESQNKEUNETPP-UHFFFAOYSA-N 1 2 322.796 2.348 20 10 DECDLO Oc1c(C[NH+]2CCC(O[C@@H]3CCOC3)CC2)ccc(F)c1F ZINC000876784174 689935876 /nfs/dbraw/zinc/93/58/76/689935876.db2.gz ZLFGSFCCJHUHON-CYBMUJFWSA-N 1 2 313.344 2.440 20 10 DECDLO COc1ccc(N2CC[NH+](CCOC(F)F)CC2)c(OC)c1 ZINC000879462815 690647140 /nfs/dbraw/zinc/64/71/40/690647140.db2.gz XYTFPQVZUDBTMA-UHFFFAOYSA-N 1 2 316.348 2.065 20 10 DECDLO COc1ccc(O)c([C@@H](C)[NH2+]Cc2nc(CSC)n[nH]2)c1 ZINC000886757333 692183799 /nfs/dbraw/zinc/18/37/99/692183799.db2.gz DENDMNFFHFCFLX-SECBINFHSA-N 1 2 308.407 2.233 20 10 DECDLO O=C(/C=C\c1ccc(O)c(O)c1)NCCCNc1cccc[nH+]1 ZINC000588407151 777084303 /nfs/dbraw/zinc/08/43/03/777084303.db2.gz INGMAGJUYGGGJJ-VURMDHGXSA-N 1 2 313.357 2.124 20 10 DECDLO Oc1cc(F)c(F)cc1C[N@@H+]1CCN2CC(F)(F)C[C@H]2C1 ZINC001142527585 780794658 /nfs/dbraw/zinc/79/46/58/780794658.db2.gz ZWPAVSHVXMSIBX-JTQLQIEISA-N 1 2 304.287 2.196 20 10 DECDLO Oc1cc(F)c(F)cc1C[N@H+]1CCN2CC(F)(F)C[C@H]2C1 ZINC001142527585 780794659 /nfs/dbraw/zinc/79/46/59/780794659.db2.gz ZWPAVSHVXMSIBX-JTQLQIEISA-N 1 2 304.287 2.196 20 10 DECDLO C[NH+]1CCN(Cc2cc(Br)c(F)cc2O)CC1 ZINC001144299489 790848145 /nfs/dbraw/zinc/84/81/45/790848145.db2.gz YDPOXMRVALFSFP-UHFFFAOYSA-N 1 2 303.175 2.041 20 10 DECDLO Oc1cc(O)c(C[N@@H+]2CC[C@H](N3CCCCC3)[C@@H](F)C2)c(O)c1 ZINC001144519926 790939194 /nfs/dbraw/zinc/93/91/94/790939194.db2.gz DRDOKVYDNDIJOS-GJZGRUSLSA-N 1 2 324.396 2.202 20 10 DECDLO Oc1cc(O)c(C[N@H+]2CC[C@H](N3CCCCC3)[C@@H](F)C2)c(O)c1 ZINC001144519926 790939204 /nfs/dbraw/zinc/93/92/04/790939204.db2.gz DRDOKVYDNDIJOS-GJZGRUSLSA-N 1 2 324.396 2.202 20 10 DECDLO OCC1(C[NH2+]Cc2cc(Br)cc(F)c2O)CC1 ZINC000715758253 792511377 /nfs/dbraw/zinc/51/13/77/792511377.db2.gz JPHAUMSNXAHGEU-UHFFFAOYSA-N 1 2 304.159 2.156 20 10 DECDLO CCOC[C@H]1C[N@H+](Cc2c(O)cccc2F)Cc2c1cnn2C ZINC001137832657 796144510 /nfs/dbraw/zinc/14/45/10/796144510.db2.gz CNNGDTLFAFSXQM-GFCCVEGCSA-N 1 2 319.380 2.401 20 10 DECDLO CCOC[C@H]1C[N@@H+](Cc2c(O)cccc2F)Cc2c1cnn2C ZINC001137832657 796144515 /nfs/dbraw/zinc/14/45/15/796144515.db2.gz CNNGDTLFAFSXQM-GFCCVEGCSA-N 1 2 319.380 2.401 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1C[C@H](CO)CC[C@H]1C ZINC001139126687 796327270 /nfs/dbraw/zinc/32/72/70/796327270.db2.gz MSYZVXWFZHMVTH-CHWSQXEVSA-N 1 2 317.385 2.400 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1C[C@H](CO)CC[C@H]1C ZINC001139126687 796327273 /nfs/dbraw/zinc/32/72/73/796327273.db2.gz MSYZVXWFZHMVTH-CHWSQXEVSA-N 1 2 317.385 2.400 20 10 DECDLO CO[C@H]1CCC[N@H+](Cc2c(O)ccc3c(C)cc(=O)oc32)C1 ZINC001139126715 796327375 /nfs/dbraw/zinc/32/73/75/796327375.db2.gz NQDVDMQSWLMXBW-LBPRGKRZSA-N 1 2 303.358 2.418 20 10 DECDLO CO[C@H]1CCC[N@@H+](Cc2c(O)ccc3c(C)cc(=O)oc32)C1 ZINC001139126715 796327378 /nfs/dbraw/zinc/32/73/78/796327378.db2.gz NQDVDMQSWLMXBW-LBPRGKRZSA-N 1 2 303.358 2.418 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+](C)Cc1cncnc1 ZINC001139130179 796329521 /nfs/dbraw/zinc/32/95/21/796329521.db2.gz UIITZHBOQJQVPS-UHFFFAOYSA-N 1 2 311.341 2.229 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+](C)Cc1cncnc1 ZINC001139130179 796329526 /nfs/dbraw/zinc/32/95/26/796329526.db2.gz UIITZHBOQJQVPS-UHFFFAOYSA-N 1 2 311.341 2.229 20 10 DECDLO OC[C@H]1C[C@@H](F)C[N@H+](Cc2c(O)cccc2Br)C1 ZINC001140098859 796477278 /nfs/dbraw/zinc/47/72/78/796477278.db2.gz PLUUDCYGIRJIJG-VHSXEESVSA-N 1 2 318.186 2.307 20 10 DECDLO OC[C@H]1C[C@@H](F)C[N@@H+](Cc2c(O)cccc2Br)C1 ZINC001140098859 796477279 /nfs/dbraw/zinc/47/72/79/796477279.db2.gz PLUUDCYGIRJIJG-VHSXEESVSA-N 1 2 318.186 2.307 20 10 DECDLO CCn1nnc2c1CC[N@H+](Cc1cc(C)ccc1O)[C@H]2COC ZINC001140619454 796547137 /nfs/dbraw/zinc/54/71/37/796547137.db2.gz DNZDPWMWMDLYKV-HNNXBMFYSA-N 1 2 316.405 2.058 20 10 DECDLO CCn1nnc2c1CC[N@@H+](Cc1cc(C)ccc1O)[C@H]2COC ZINC001140619454 796547139 /nfs/dbraw/zinc/54/71/39/796547139.db2.gz DNZDPWMWMDLYKV-HNNXBMFYSA-N 1 2 316.405 2.058 20 10 DECDLO CCN(CC)c1ccc(C[N@@H+]2CCn3nccc3C2)c(O)c1 ZINC001140857583 796584838 /nfs/dbraw/zinc/58/48/38/796584838.db2.gz RUFUFJXGUKSMDN-UHFFFAOYSA-N 1 2 300.406 2.451 20 10 DECDLO CCN(CC)c1ccc(C[N@H+]2CCn3nccc3C2)c(O)c1 ZINC001140857583 796584844 /nfs/dbraw/zinc/58/48/44/796584844.db2.gz RUFUFJXGUKSMDN-UHFFFAOYSA-N 1 2 300.406 2.451 20 10 DECDLO CC(C)C(=O)N[C@@H]1CCC[N@H+](Cc2cc(F)c(F)cc2O)C1 ZINC001142531083 796748576 /nfs/dbraw/zinc/74/85/76/796748576.db2.gz PHYIRVKIHJAQCE-GFCCVEGCSA-N 1 2 312.360 2.407 20 10 DECDLO CC(C)C(=O)N[C@@H]1CCC[N@@H+](Cc2cc(F)c(F)cc2O)C1 ZINC001142531083 796748579 /nfs/dbraw/zinc/74/85/79/796748579.db2.gz PHYIRVKIHJAQCE-GFCCVEGCSA-N 1 2 312.360 2.407 20 10 DECDLO Oc1ccc(CN2CC[C@H]([NH+]3CCCC3)C(F)(F)C2)cc1O ZINC001203884599 800140651 /nfs/dbraw/zinc/14/06/51/800140651.db2.gz VLCRTPHGJYFURO-HNNXBMFYSA-N 1 2 312.360 2.403 20 10 DECDLO Cc1cc(O)c(C[N@@H+]2Cc3ccnn3CC[C@@H]2CO)cc1Cl ZINC001231871205 801742095 /nfs/dbraw/zinc/74/20/95/801742095.db2.gz FLAGUAPFZISAFM-CQSZACIVSA-N 1 2 321.808 2.317 20 10 DECDLO Cc1cc(O)c(C[N@H+]2Cc3ccnn3CC[C@@H]2CO)cc1Cl ZINC001231871205 801742101 /nfs/dbraw/zinc/74/21/01/801742101.db2.gz FLAGUAPFZISAFM-CQSZACIVSA-N 1 2 321.808 2.317 20 10 DECDLO COC(=O)[C@@H]1[C@@H]2CC[C@@H](C2)[N@H+]1Cc1cc(Cl)c(O)cc1O ZINC001232264628 801833701 /nfs/dbraw/zinc/83/37/01/801833701.db2.gz KJEZIIBMCRARHB-YACGNSKGSA-N 1 2 311.765 2.277 20 10 DECDLO COC(=O)CC[N@H+](C)Cc1c(O)cc(Br)cc1F ZINC001233030426 802009197 /nfs/dbraw/zinc/00/91/97/802009197.db2.gz SRJOENJRBMWDKX-UHFFFAOYSA-N 1 2 320.158 2.289 20 10 DECDLO COC(=O)CC[N@@H+](C)Cc1c(O)cc(Br)cc1F ZINC001233030426 802009205 /nfs/dbraw/zinc/00/92/05/802009205.db2.gz SRJOENJRBMWDKX-UHFFFAOYSA-N 1 2 320.158 2.289 20 10 DECDLO CC(C)C(=O)NC1CC[NH+](Cc2c(O)ccc(F)c2F)CC1 ZINC001233334433 802080353 /nfs/dbraw/zinc/08/03/53/802080353.db2.gz GULDURXDKAGUPM-UHFFFAOYSA-N 1 2 312.360 2.407 20 10 DECDLO CC[C@H]([NH2+]C[C@H]1CCCOC1)c1cccc(-c2nn[nH]n2)c1O ZINC001604056253 1070189502 /nfs/dbraw/zinc/18/95/02/1070189502.db2.gz RLNSFKDYIUOPDM-RISCZKNCSA-N 1 2 317.393 2.040 20 10 DECDLO CCC[C@@](C)(O)C[NH2+][C@@H](CC)c1cccc(-c2nn[nH]n2)c1O ZINC001604127750 1070233878 /nfs/dbraw/zinc/23/38/78/1070233878.db2.gz FNSLFNREGQQICC-XJKSGUPXSA-N 1 2 319.409 2.164 20 10 DECDLO CO[C@@H]1CCCC[C@H]1[NH2+][C@@H](C)c1cccc(-c2nn[nH]n2)c1O ZINC001605143893 1070623821 /nfs/dbraw/zinc/62/38/21/1070623821.db2.gz ILBMUEKGBAAFAH-ZLKJLUDKSA-N 1 2 317.393 2.181 20 10 DECDLO [NH3+][C@@H]1CCc2ncc(NCc3cc([N+](=O)[O-])ccc3O)cc2C1 ZINC001580208574 1067525990 /nfs/dbraw/zinc/52/59/90/1067525990.db2.gz UMNGUWIADVESMA-GFCCVEGCSA-N 1 2 314.345 2.124 20 10 DECDLO C[C@H](NC(=O)CCc1[nH+]ccn1C)c1ccc(N(C)C)cc1 ZINC001521334428 1069233384 /nfs/dbraw/zinc/23/33/84/1069233384.db2.gz ANSCGZAQLCCHID-ZDUSSCGKSA-N 1 2 300.406 2.296 20 10 DECDLO Cc1[nH]c([C@H]2CCCN2C(=O)c2cccc(O)c2O)[nH+]c1C ZINC001645370481 1078897663 /nfs/dbraw/zinc/89/76/63/1078897663.db2.gz IPQRQSSEUNIMMQ-GFCCVEGCSA-N 1 2 301.346 2.415 20 10 DECDLO C[C@@H]1CC[N@H+](Cc2cc(F)cc(Br)c2O)C[C@H]1O ZINC001235298700 1079011756 /nfs/dbraw/zinc/01/17/56/1079011756.db2.gz SXFFWHSBAVDZOE-PRHODGIISA-N 1 2 318.186 2.497 20 10 DECDLO C[C@@H]1CC[N@@H+](Cc2cc(F)cc(Br)c2O)C[C@H]1O ZINC001235298700 1079011765 /nfs/dbraw/zinc/01/17/65/1079011765.db2.gz SXFFWHSBAVDZOE-PRHODGIISA-N 1 2 318.186 2.497 20 10 DECDLO O=C(NCc1cccc(Cl)c1O)[C@@H]1[NH2+]CCc2occc21 ZINC001580718750 1075982226 /nfs/dbraw/zinc/98/22/26/1075982226.db2.gz OZGPKGVKIVSAOJ-CYBMUJFWSA-N 1 2 306.749 2.142 20 10 DECDLO NC(=O)C[N@H+](Cc1ccccc1)Cc1cc(F)c(F)cc1O ZINC001658219013 1080201401 /nfs/dbraw/zinc/20/14/01/1080201401.db2.gz QQPSFNWBRGSWAA-UHFFFAOYSA-N 1 2 306.312 2.158 20 10 DECDLO NC(=O)C[N@@H+](Cc1ccccc1)Cc1cc(F)c(F)cc1O ZINC001658219013 1080201409 /nfs/dbraw/zinc/20/14/09/1080201409.db2.gz QQPSFNWBRGSWAA-UHFFFAOYSA-N 1 2 306.312 2.158 20 10 DECDLO Cc1cc(O)c(C[N@@H+]2CC[C@@](F)(CO)C2)cc1Br ZINC001237677375 1080472495 /nfs/dbraw/zinc/47/24/95/1080472495.db2.gz MMLSTWFEKJYVIJ-ZDUSSCGKSA-N 1 2 318.186 2.369 20 10 DECDLO Cc1cc(O)c(C[N@H+]2CC[C@@](F)(CO)C2)cc1Br ZINC001237677375 1080472500 /nfs/dbraw/zinc/47/25/00/1080472500.db2.gz MMLSTWFEKJYVIJ-ZDUSSCGKSA-N 1 2 318.186 2.369 20 10 DECDLO C[N@H+]1C[C@H]2CN(Cc3c(O)ccc(Cl)c3Cl)C[C@@H](C1)O2 ZINC001276818788 1083630297 /nfs/dbraw/zinc/63/02/97/1083630297.db2.gz JBFPUJPSTWYNOE-AOOOYVTPSA-N 1 2 317.216 2.214 20 10 DECDLO Cc1nnc([C@H](C)[NH2+]Cc2ccc(Br)cc2O)[nH]1 ZINC000700974755 1086346037 /nfs/dbraw/zinc/34/60/37/1086346037.db2.gz MQIVPHTUFAPBTM-ZETCQYMHSA-N 1 2 311.183 2.432 20 10 DECDLO C[N@@H+]1C[C@@H]2COC[C@H](C1)N2Cc1cc(Cl)cc(Cl)c1O ZINC001275270263 1091646484 /nfs/dbraw/zinc/64/64/84/1091646484.db2.gz APNZQXKKMADTAS-TXEJJXNPSA-N 1 2 317.216 2.214 20 10 DECDLO C[N@H+]1C[C@@H]2COC[C@H](C1)N2Cc1cc(Cl)cc(Cl)c1O ZINC001275270263 1091646493 /nfs/dbraw/zinc/64/64/93/1091646493.db2.gz APNZQXKKMADTAS-TXEJJXNPSA-N 1 2 317.216 2.214 20 10 DECDLO Oc1ccc(C[N@H+]2C[C@H]3CC[C@@H](C2)N3Cc2ccc[nH]2)cc1O ZINC001275821263 1092181108 /nfs/dbraw/zinc/18/11/08/1092181108.db2.gz MHSMLJBEEVPUDT-IYBDPMFKSA-N 1 2 313.401 2.275 20 10 DECDLO Oc1ccc(C[N@@H+]2C[C@H]3CC[C@@H](C2)N3Cc2ccc[nH]2)cc1O ZINC001275821263 1092181113 /nfs/dbraw/zinc/18/11/13/1092181113.db2.gz MHSMLJBEEVPUDT-IYBDPMFKSA-N 1 2 313.401 2.275 20 10 DECDLO Oc1cc(OCC(F)(F)F)ccc1C[N@@H+]1CCC12COC2 ZINC001237057490 1138492893 /nfs/dbraw/zinc/49/28/93/1138492893.db2.gz SRAVIBJPKKHLOI-UHFFFAOYSA-N 1 2 303.280 2.308 20 10 DECDLO Oc1cc(OCC(F)(F)F)ccc1C[N@H+]1CCC12COC2 ZINC001237057490 1138492899 /nfs/dbraw/zinc/49/28/99/1138492899.db2.gz SRAVIBJPKKHLOI-UHFFFAOYSA-N 1 2 303.280 2.308 20 10 DECDLO CN(C)C(=O)[C@H]1CCC[N@H+](Cc2cc(Cl)cc(F)c2O)C1 ZINC001237621191 1138719765 /nfs/dbraw/zinc/71/97/65/1138719765.db2.gz WLCQFELZOQGZDZ-JTQLQIEISA-N 1 2 314.788 2.485 20 10 DECDLO CN(C)C(=O)[C@H]1CCC[N@@H+](Cc2cc(Cl)cc(F)c2O)C1 ZINC001237621191 1138719769 /nfs/dbraw/zinc/71/97/69/1138719769.db2.gz WLCQFELZOQGZDZ-JTQLQIEISA-N 1 2 314.788 2.485 20 10 DECDLO O=C1NC[C@]2(CCC[N@@H+](Cc3cc(F)c(Cl)cc3O)C2)O1 ZINC001237950703 1138812445 /nfs/dbraw/zinc/81/24/45/1138812445.db2.gz ZFUIYDARUQFDKY-AWEZNQCLSA-N 1 2 314.744 2.259 20 10 DECDLO O=C1NC[C@]2(CCC[N@H+](Cc3cc(F)c(Cl)cc3O)C2)O1 ZINC001237950703 1138812447 /nfs/dbraw/zinc/81/24/47/1138812447.db2.gz ZFUIYDARUQFDKY-AWEZNQCLSA-N 1 2 314.744 2.259 20 10 DECDLO CC[N@H+](CC(=O)OC)Cc1cc(C)c(Br)cc1O ZINC001250136233 1142086298 /nfs/dbraw/zinc/08/62/98/1142086298.db2.gz OSCNNFKPRWAVJO-UHFFFAOYSA-N 1 2 316.195 2.458 20 10 DECDLO CC[N@@H+](CC(=O)OC)Cc1cc(C)c(Br)cc1O ZINC001250136233 1142086306 /nfs/dbraw/zinc/08/63/06/1142086306.db2.gz OSCNNFKPRWAVJO-UHFFFAOYSA-N 1 2 316.195 2.458 20 10 DECDLO COC(=O)[C@H](Cc1ccc(O)c(O)c1)[NH2+][C@@H]1CCC[C@@H](C)C1 ZINC001258806746 1144042884 /nfs/dbraw/zinc/04/28/84/1144042884.db2.gz BKJXDHROJVTYLU-BNOWGMLFSA-N 1 2 307.390 2.350 20 10 DECDLO Oc1c(Cl)cccc1C[N@H+]1C[C@@H](O)CC2(CCOCC2)C1 ZINC001262113568 1144291703 /nfs/dbraw/zinc/29/17/03/1144291703.db2.gz SMPLXELOZXAQQZ-ZDUSSCGKSA-N 1 2 311.809 2.409 20 10 DECDLO Oc1c(Cl)cccc1C[N@@H+]1C[C@@H](O)CC2(CCOCC2)C1 ZINC001262113568 1144291706 /nfs/dbraw/zinc/29/17/06/1144291706.db2.gz SMPLXELOZXAQQZ-ZDUSSCGKSA-N 1 2 311.809 2.409 20 10 DECDLO C[C@H]1CN(C(=O)c2cc3cc(O)c(O)cc3s2)CC[N@@H+]1C ZINC001262154694 1144296430 /nfs/dbraw/zinc/29/64/30/1144296430.db2.gz OINYCPXEZWDASN-VIFPVBQESA-N 1 2 306.387 2.089 20 10 DECDLO C[C@H]1CN(C(=O)c2cc3cc(O)c(O)cc3s2)CC[N@H+]1C ZINC001262154694 1144296433 /nfs/dbraw/zinc/29/64/33/1144296433.db2.gz OINYCPXEZWDASN-VIFPVBQESA-N 1 2 306.387 2.089 20 10 DECDLO CCN(CC)c1ccc(C[NH2+][C@@H](C)c2nnnn2C)cc1F ZINC001308542367 1147479130 /nfs/dbraw/zinc/47/91/30/1147479130.db2.gz GRHGWYVWQCLEFA-NSHDSACASA-N 1 2 306.389 2.046 20 10 DECDLO C[C@H]([NH2+][C@@H]1CCN(c2cnn(C)c2)C1)c1cc(F)cc(F)c1O ZINC001325339243 1147894192 /nfs/dbraw/zinc/89/41/92/1147894192.db2.gz HRMFDIHEHRJEEN-CMPLNLGQSA-N 1 2 322.359 2.333 20 10 DECDLO CNC(=O)[C@@H]1CCCC[N@@H+]1Cc1cc(Cl)cc(C(C)=O)c1O ZINC000194805215 529899587 /nfs/dbraw/zinc/89/95/87/529899587.db2.gz FOZNIIADARKISL-AWEZNQCLSA-N 1 2 324.808 2.349 20 10 DECDLO CNC(=O)[C@@H]1CCCC[N@H+]1Cc1cc(Cl)cc(C(C)=O)c1O ZINC000194805215 529899588 /nfs/dbraw/zinc/89/95/88/529899588.db2.gz FOZNIIADARKISL-AWEZNQCLSA-N 1 2 324.808 2.349 20 10 DECDLO CCN(Cc1ccc(N(C)C)cc1)C(=O)CCn1cc[nH+]c1 ZINC000070899694 354890134 /nfs/dbraw/zinc/89/01/34/354890134.db2.gz BEYVHJCCSKYOKO-UHFFFAOYSA-N 1 2 300.406 2.388 20 10 DECDLO C[C@@H]1C[C@@H]([NH2+][C@H](C(N)=O)c2ccccn2)c2c1c(F)ccc2O ZINC000834828255 649852702 /nfs/dbraw/zinc/85/27/02/649852702.db2.gz QTHCJZATOVUUHI-ULMHFPJVSA-N 1 2 315.348 2.291 20 10 DECDLO CC[N@H+](Cc1cc(Cl)c(F)cc1O)[C@@H](C)CS(C)(=O)=O ZINC000295328658 285095166 /nfs/dbraw/zinc/09/51/66/285095166.db2.gz LUKHPZOCLWVRDK-VIFPVBQESA-N 1 2 323.817 2.440 20 10 DECDLO CC[N@@H+](Cc1cc(Cl)c(F)cc1O)[C@@H](C)CS(C)(=O)=O ZINC000295328658 285095168 /nfs/dbraw/zinc/09/51/68/285095168.db2.gz LUKHPZOCLWVRDK-VIFPVBQESA-N 1 2 323.817 2.440 20 10 DECDLO C[C@@H]([NH2+][C@@H]1CCCN(CCCO)C1)c1ccc(F)c(F)c1O ZINC000297383303 533520354 /nfs/dbraw/zinc/52/03/54/533520354.db2.gz RFOBOAHNYPPJLL-VXGBXAGGSA-N 1 2 314.376 2.168 20 10 DECDLO COC(=O)CC1([NH2+]Cc2cccc(Cl)c2O)CCOCC1 ZINC000271995515 129989399 /nfs/dbraw/zinc/98/93/99/129989399.db2.gz SPSFSYJLRXWSPU-UHFFFAOYSA-N 1 2 313.781 2.248 20 10 DECDLO CC(=O)c1cc(Cl)cc(C[NH2+][C@@H](C)c2nncn2C)c1O ZINC000275202686 130298514 /nfs/dbraw/zinc/29/85/14/130298514.db2.gz QRXSZJNZLPSHAA-QMMMGPOBSA-N 1 2 308.769 2.228 20 10 DECDLO C[C@@H]([NH2+]C[C@H]1CCCS(=O)(=O)C1)c1ccc(F)c(F)c1O ZINC000287136606 131266048 /nfs/dbraw/zinc/26/60/48/131266048.db2.gz RYNGQLIKLSPNIK-NXEZZACHSA-N 1 2 319.373 2.146 20 10 DECDLO COc1ccc(N2CCC[N@H+](Cc3cn[nH]c3C)CC2)cc1 ZINC000092380866 402004586 /nfs/dbraw/zinc/00/45/86/402004586.db2.gz IIIPGJXOIUCEHW-UHFFFAOYSA-N 1 2 300.406 2.439 20 10 DECDLO COc1ccc(N2CCC[N@@H+](Cc3cn[nH]c3C)CC2)cc1 ZINC000092380866 402004588 /nfs/dbraw/zinc/00/45/88/402004588.db2.gz IIIPGJXOIUCEHW-UHFFFAOYSA-N 1 2 300.406 2.439 20 10 DECDLO COc1cc(Cl)cc(C[N@@H+]2CCNC(=O)[C@@H]2C(C)C)c1O ZINC000184688491 402292142 /nfs/dbraw/zinc/29/21/42/402292142.db2.gz DDXUEDAFEAWAGF-ZDUSSCGKSA-N 1 2 312.797 2.011 20 10 DECDLO COc1cc(Cl)cc(C[N@H+]2CCNC(=O)[C@@H]2C(C)C)c1O ZINC000184688491 402292146 /nfs/dbraw/zinc/29/21/46/402292146.db2.gz DDXUEDAFEAWAGF-ZDUSSCGKSA-N 1 2 312.797 2.011 20 10 DECDLO COC(=O)[C@H]1C[N@H+](Cc2cc(Cl)cc(C)c2O)C[C@@H](C)O1 ZINC000180731929 402624664 /nfs/dbraw/zinc/62/46/64/402624664.db2.gz NNVDMVAQNHIKJF-ZWNOBZJWSA-N 1 2 313.781 2.116 20 10 DECDLO COC(=O)[C@H]1C[N@@H+](Cc2cc(Cl)cc(C)c2O)C[C@@H](C)O1 ZINC000180731929 402624666 /nfs/dbraw/zinc/62/46/66/402624666.db2.gz NNVDMVAQNHIKJF-ZWNOBZJWSA-N 1 2 313.781 2.116 20 10 DECDLO Cc1ccc(C(=O)N2CC[C@H](C)[C@H](n3cc[nH+]c3)C2)c(O)c1O ZINC000182606665 402703826 /nfs/dbraw/zinc/70/38/26/402703826.db2.gz ZEQPTTADWROMSR-SMDDNHRTSA-N 1 2 315.373 2.326 20 10 DECDLO COc1cc(Cl)cc(C[N@@H+]2CC[C@H](C)[S@@](=O)CC2)c1O ZINC000277348396 403207975 /nfs/dbraw/zinc/20/79/75/403207975.db2.gz DHRWIFMVHULCFU-FVINQWEUSA-N 1 2 317.838 2.397 20 10 DECDLO COc1cc(Cl)cc(C[N@H+]2CC[C@H](C)[S@@](=O)CC2)c1O ZINC000277348396 403207978 /nfs/dbraw/zinc/20/79/78/403207978.db2.gz DHRWIFMVHULCFU-FVINQWEUSA-N 1 2 317.838 2.397 20 10 DECDLO COC(=O)[C@@H]([NH2+]Cc1cc(Br)ccc1O)C1CC1 ZINC000276467554 403178125 /nfs/dbraw/zinc/17/81/25/403178125.db2.gz MGTDLWMLLDPKSZ-LBPRGKRZSA-N 1 2 314.179 2.196 20 10 DECDLO COc1cc[nH+]cc1CNC(=O)NCc1ccc(N(C)C)cc1 ZINC000292528715 403368734 /nfs/dbraw/zinc/36/87/34/403368734.db2.gz FLKAHNGSUFYBCG-UHFFFAOYSA-N 1 2 314.389 2.156 20 10 DECDLO Cc1cc(N(C)C)ccc1CNc1[nH+]cnc(-n2cccn2)c1N ZINC000301765615 403675808 /nfs/dbraw/zinc/67/58/08/403675808.db2.gz CVLXDISGYULSJI-UHFFFAOYSA-N 1 2 323.404 2.231 20 10 DECDLO COC(=O)c1ccc(O)c([C@@H](C)[NH2+]Cc2nnc(C3CC3)[nH]2)c1 ZINC000296279171 404176043 /nfs/dbraw/zinc/17/60/43/404176043.db2.gz DZEMWBIACJVETF-SECBINFHSA-N 1 2 316.361 2.025 20 10 DECDLO COC(=O)c1ccc(O)c([C@H](C)[NH2+]Cc2nnc(C(C)C)[nH]2)c1 ZINC000296625741 404311046 /nfs/dbraw/zinc/31/10/46/404311046.db2.gz XCFFGPNJEYUQHI-JTQLQIEISA-N 1 2 318.377 2.271 20 10 DECDLO Cn1cc(N2CC[C@H]([NH2+]Cc3cccc(Cl)c3O)C2)cn1 ZINC000364726058 404517560 /nfs/dbraw/zinc/51/75/60/404517560.db2.gz WJDYVSJNTYRBKZ-LBPRGKRZSA-N 1 2 306.797 2.148 20 10 DECDLO C[C@@H]([NH2+][C@@H]1CCCN(CCCO)C1)c1cc(F)cc(F)c1O ZINC000834849555 649854260 /nfs/dbraw/zinc/85/42/60/649854260.db2.gz BYTQORKBYHGXCC-DGCLKSJQSA-N 1 2 314.376 2.168 20 10 DECDLO CCn1ccnc1C[NH2+][C@@H](C)c1cc(C(=O)OC)ccc1O ZINC000834878565 649857179 /nfs/dbraw/zinc/85/71/79/649857179.db2.gz FCXPGUQZCDGWDO-NSHDSACASA-N 1 2 303.362 2.246 20 10 DECDLO Cn1cc[nH+]c1C[C@H]1CCCN(C(=O)C2=CC(=O)CS2)C1 ZINC001330167102 1149057756 /nfs/dbraw/zinc/05/77/56/1149057756.db2.gz BONZGUUNUWSTIX-LLVKDONJSA-N 1 2 305.403 2.282 20 10 DECDLO COCCc1noc(C[N@H+](C)Cc2ccc(N(C)C)c(F)c2)n1 ZINC000129384092 522038365 /nfs/dbraw/zinc/03/83/65/522038365.db2.gz GWAFMULLKKCGPS-UHFFFAOYSA-N 1 2 322.384 2.096 20 10 DECDLO COCCc1noc(C[N@@H+](C)Cc2ccc(N(C)C)c(F)c2)n1 ZINC000129384092 522038374 /nfs/dbraw/zinc/03/83/74/522038374.db2.gz GWAFMULLKKCGPS-UHFFFAOYSA-N 1 2 322.384 2.096 20 10 DECDLO O=C1N[C@H]2C[N@H+](Cc3c(O)ccc(Cl)c3F)CC[C@@H]2CO1 ZINC000369705153 534801187 /nfs/dbraw/zinc/80/11/87/534801187.db2.gz VIKAMSDFCVUQQZ-KCJUWKMLSA-N 1 2 314.744 2.115 20 10 DECDLO O=C1N[C@H]2C[N@@H+](Cc3c(O)ccc(Cl)c3F)CC[C@@H]2CO1 ZINC000369705153 534801199 /nfs/dbraw/zinc/80/11/99/534801199.db2.gz VIKAMSDFCVUQQZ-KCJUWKMLSA-N 1 2 314.744 2.115 20 10 DECDLO COc1ccc(O)c(C[N@@H+]2CCNC(=O)[C@H]2c2ccccc2)c1 ZINC000179921399 524741093 /nfs/dbraw/zinc/74/10/93/524741093.db2.gz QUCRJYNIYQVJDQ-QGZVFWFLSA-N 1 2 312.369 2.074 20 10 DECDLO COc1ccc(O)c(C[N@H+]2CCNC(=O)[C@H]2c2ccccc2)c1 ZINC000179921399 524741102 /nfs/dbraw/zinc/74/11/02/524741102.db2.gz QUCRJYNIYQVJDQ-QGZVFWFLSA-N 1 2 312.369 2.074 20 10 DECDLO Cn1c[nH+]cc1CNC(=O)NCc1c(O)ccc2c1CCCC2 ZINC000291859516 624932164 /nfs/dbraw/zinc/93/21/64/624932164.db2.gz KAQKAXABOOPLBD-UHFFFAOYSA-N 1 2 314.389 2.004 20 10 DECDLO COc1ccc(C[N@@H+]2CCC[C@@H]2c2ncc[nH]2)c(O)c1OC ZINC000893571116 634777839 /nfs/dbraw/zinc/77/78/39/634777839.db2.gz JUYUXPKZMWMICU-GFCCVEGCSA-N 1 2 303.362 2.470 20 10 DECDLO COc1ccc(C[N@H+]2CCC[C@@H]2c2ncc[nH]2)c(O)c1OC ZINC000893571116 634777843 /nfs/dbraw/zinc/77/78/43/634777843.db2.gz JUYUXPKZMWMICU-GFCCVEGCSA-N 1 2 303.362 2.470 20 10 DECDLO COC(=O)c1cnc(C[NH2+]Cc2ccc3c(c2)CCO3)s1 ZINC000894212746 636476345 /nfs/dbraw/zinc/47/63/45/636476345.db2.gz HTPHGMDUOPFQNO-UHFFFAOYSA-N 1 2 304.371 2.154 20 10 DECDLO OC[C@@]12C[C@@H]1C[N@H+](Cc1cc(Br)cc(F)c1O)C2 ZINC000894534889 637094715 /nfs/dbraw/zinc/09/47/15/637094715.db2.gz RILUEPJMCALLTB-RNCFNFMXSA-N 1 2 316.170 2.108 20 10 DECDLO OC[C@@]12C[C@@H]1C[N@@H+](Cc1cc(Br)cc(F)c1O)C2 ZINC000894534889 637094718 /nfs/dbraw/zinc/09/47/18/637094718.db2.gz RILUEPJMCALLTB-RNCFNFMXSA-N 1 2 316.170 2.108 20 10 DECDLO Cc1n[nH]c([C@H]2CC[N@@H+](Cc3cc(F)c(N(C)C)cc3F)C2)n1 ZINC000895011859 637374767 /nfs/dbraw/zinc/37/47/67/637374767.db2.gz MCGBJTRNKRXOEB-NSHDSACASA-N 1 2 321.375 2.447 20 10 DECDLO Cc1n[nH]c([C@H]2CC[N@H+](Cc3cc(F)c(N(C)C)cc3F)C2)n1 ZINC000895011859 637374773 /nfs/dbraw/zinc/37/47/73/637374773.db2.gz MCGBJTRNKRXOEB-NSHDSACASA-N 1 2 321.375 2.447 20 10 DECDLO Cc1nc([C@H]2CC[N@@H+](Cc3cc(F)c(N(C)C)cc3F)C2)n[nH]1 ZINC000895011859 637374778 /nfs/dbraw/zinc/37/47/78/637374778.db2.gz MCGBJTRNKRXOEB-NSHDSACASA-N 1 2 321.375 2.447 20 10 DECDLO Cc1nc([C@H]2CC[N@H+](Cc3cc(F)c(N(C)C)cc3F)C2)n[nH]1 ZINC000895011859 637374786 /nfs/dbraw/zinc/37/47/86/637374786.db2.gz MCGBJTRNKRXOEB-NSHDSACASA-N 1 2 321.375 2.447 20 10 DECDLO OC[C@@H]1C[N@H+](Cc2cc(F)cc(F)c2O)C[C@H]1C(F)(F)F ZINC000895443169 638021361 /nfs/dbraw/zinc/02/13/61/638021361.db2.gz CIYMZWXEQGBQBQ-WCBMZHEXSA-N 1 2 311.250 2.273 20 10 DECDLO OC[C@@H]1C[N@@H+](Cc2cc(F)cc(F)c2O)C[C@H]1C(F)(F)F ZINC000895443169 638021362 /nfs/dbraw/zinc/02/13/62/638021362.db2.gz CIYMZWXEQGBQBQ-WCBMZHEXSA-N 1 2 311.250 2.273 20 10 DECDLO CN1C[C@H](CC[NH2+]Cc2cc(Cl)cc(F)c2O)CC1=O ZINC000896308411 638460320 /nfs/dbraw/zinc/46/03/20/638460320.db2.gz JECBNEQJIGUGNW-SECBINFHSA-N 1 2 300.761 2.143 20 10 DECDLO COCCCN(C)CC[NH2+][C@@H](C)c1cc(F)cc(F)c1O ZINC000756613810 639679735 /nfs/dbraw/zinc/67/97/35/639679735.db2.gz RALHZJXOQOMDGE-NSHDSACASA-N 1 2 302.365 2.289 20 10 DECDLO COc1ccc(O)c([C@@H](C)NC(=O)N[C@@H](C)Cn2cc[nH+]c2)c1 ZINC000103512874 639767403 /nfs/dbraw/zinc/76/74/03/639767403.db2.gz BENRHXDEIVLSPI-NWDGAFQWSA-N 1 2 318.377 2.046 20 10 DECDLO Cc1cc(Br)cc(C[N@@H+]2CC[C@H](O)[C@H](F)C2)c1O ZINC000898188858 641054802 /nfs/dbraw/zinc/05/48/02/641054802.db2.gz VBCNJKUEAVIFMC-NEPJUHHUSA-N 1 2 318.186 2.368 20 10 DECDLO Cc1cc(Br)cc(C[N@H+]2CC[C@H](O)[C@H](F)C2)c1O ZINC000898188858 641054803 /nfs/dbraw/zinc/05/48/03/641054803.db2.gz VBCNJKUEAVIFMC-NEPJUHHUSA-N 1 2 318.186 2.368 20 10 DECDLO CCN(CC)c1ccc(C[N@@H+]2C[C@H](CO)OC[C@H]2C)cc1F ZINC000770353751 641358502 /nfs/dbraw/zinc/35/85/02/641358502.db2.gz TUGHIMSCBSKUPX-UKRRQHHQSA-N 1 2 310.413 2.254 20 10 DECDLO CCN(CC)c1ccc(C[N@H+]2C[C@H](CO)OC[C@H]2C)cc1F ZINC000770353751 641358504 /nfs/dbraw/zinc/35/85/04/641358504.db2.gz TUGHIMSCBSKUPX-UKRRQHHQSA-N 1 2 310.413 2.254 20 10 DECDLO CCOC1CC(O)(C[NH2+][C@H](C)c2cc(F)cc(F)c2O)C1 ZINC000774487086 641909494 /nfs/dbraw/zinc/90/94/94/641909494.db2.gz KQRRKYBGXVHIMC-IWPPJYEWSA-N 1 2 301.333 2.251 20 10 DECDLO CCO[C@@H]1C[C@H]([NH2+]Cc2cc(Cl)cc(F)c2O)[C@@H]1OC ZINC000775979541 642118555 /nfs/dbraw/zinc/11/85/55/642118555.db2.gz VUNXCHQPZNWQSW-SCRDCRAPSA-N 1 2 303.761 2.467 20 10 DECDLO CC[N@H+](CC(=O)OC)Cc1cc(C)cc(Br)c1O ZINC000781913563 642797782 /nfs/dbraw/zinc/79/77/82/642797782.db2.gz RDONTZZHOQMHHP-UHFFFAOYSA-N 1 2 316.195 2.458 20 10 DECDLO CC[N@@H+](CC(=O)OC)Cc1cc(C)cc(Br)c1O ZINC000781913563 642797787 /nfs/dbraw/zinc/79/77/87/642797787.db2.gz RDONTZZHOQMHHP-UHFFFAOYSA-N 1 2 316.195 2.458 20 10 DECDLO CCOc1ccc(C[N@@H+]2CCN(CC(C)(C)O)[C@@H](C)C2)c(O)c1 ZINC000783722559 643042652 /nfs/dbraw/zinc/04/26/52/643042652.db2.gz FSXORHKPLLQWHK-AWEZNQCLSA-N 1 2 322.449 2.068 20 10 DECDLO CCOc1ccc(C[N@H+]2CCN(CC(C)(C)O)[C@@H](C)C2)c(O)c1 ZINC000783722559 643042657 /nfs/dbraw/zinc/04/26/57/643042657.db2.gz FSXORHKPLLQWHK-AWEZNQCLSA-N 1 2 322.449 2.068 20 10 DECDLO C[C@@H]1CN(C)C(=O)C[N@@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC000783735201 643045051 /nfs/dbraw/zinc/04/50/51/643045051.db2.gz ZUTWDVILMIKIOL-OAHLLOKOSA-N 1 2 301.434 2.339 20 10 DECDLO C[C@@H]1CN(C)C(=O)C[N@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC000783735201 643045056 /nfs/dbraw/zinc/04/50/56/643045056.db2.gz ZUTWDVILMIKIOL-OAHLLOKOSA-N 1 2 301.434 2.339 20 10 DECDLO CCOC(=O)[C@@H]([NH2+]Cc1cccc(C)c1O)[C@H]1CCCOC1 ZINC000789579024 643750504 /nfs/dbraw/zinc/75/05/04/643750504.db2.gz DSKGNPLVUVCZCE-GJZGRUSLSA-N 1 2 307.390 2.149 20 10 DECDLO COC[C@@H]([NH2+]Cc1cc(Cl)cc(F)c1O)[C@@H]1CCCO1 ZINC000789777590 643775434 /nfs/dbraw/zinc/77/54/34/643775434.db2.gz YULLWYMMKPSLNZ-OLZOCXBDSA-N 1 2 303.761 2.468 20 10 DECDLO CCC[N@H+](Cc1cc(F)ccc1O)[C@@H](COC)C(=O)OCC ZINC000792184555 644086635 /nfs/dbraw/zinc/08/66/35/644086635.db2.gz HEBXNRSVDHXUTA-AWEZNQCLSA-N 1 2 313.369 2.321 20 10 DECDLO CCC[N@@H+](Cc1cc(F)ccc1O)[C@@H](COC)C(=O)OCC ZINC000792184555 644086638 /nfs/dbraw/zinc/08/66/38/644086638.db2.gz HEBXNRSVDHXUTA-AWEZNQCLSA-N 1 2 313.369 2.321 20 10 DECDLO COc1cc(C[N@H+]2CC(=O)N[C@H](C)C2)c(O)c(C(C)(C)C)c1 ZINC000840134272 646071581 /nfs/dbraw/zinc/07/15/81/646071581.db2.gz RKDNAPXEPKZSJQ-LLVKDONJSA-N 1 2 306.406 2.019 20 10 DECDLO COc1cc(C[N@@H+]2CC(=O)N[C@H](C)C2)c(O)c(C(C)(C)C)c1 ZINC000840134272 646071584 /nfs/dbraw/zinc/07/15/84/646071584.db2.gz RKDNAPXEPKZSJQ-LLVKDONJSA-N 1 2 306.406 2.019 20 10 DECDLO CCN(CC)c1ccc(CNC(=O)Cc2[nH]cc[nH+]2)cc1F ZINC000816921985 647197911 /nfs/dbraw/zinc/19/79/11/647197911.db2.gz NNBZCLJMHZKZBW-UHFFFAOYSA-N 1 2 304.369 2.254 20 10 DECDLO C[C@@H]([NH2+]C[C@H]1C[NH2+]CCO1)c1ccc(Cl)c(Cl)c1[O-] ZINC000817984160 647400839 /nfs/dbraw/zinc/40/08/39/647400839.db2.gz VMGVCGPQSBAFRY-RKDXNWHRSA-N 1 2 305.205 2.338 20 10 DECDLO CCOCc1cc(C[NH2+]Cc2nn(CC)nc2C)ccc1OC ZINC000818222016 647435755 /nfs/dbraw/zinc/43/57/55/647435755.db2.gz URVDVNDFCITGNN-UHFFFAOYSA-N 1 2 318.421 2.441 20 10 DECDLO CC[C@@H]([NH2+][C@H]1CCC(=O)N(C)C1=O)c1cccc(Cl)c1O ZINC000818362302 647458067 /nfs/dbraw/zinc/45/80/67/647458067.db2.gz UUGYTOVRYNCMTD-NEPJUHHUSA-N 1 2 310.781 2.234 20 10 DECDLO CN1C(=O)NCC12CC[NH+](Cc1cccc(Cl)c1O)CC2 ZINC000822529529 648226259 /nfs/dbraw/zinc/22/62/59/648226259.db2.gz FCOBAEOMIPLOAB-UHFFFAOYSA-N 1 2 309.797 2.035 20 10 DECDLO C[N@@H+](Cc1ccc(N2CCOCC2)cc1)CN1CCSC1=O ZINC000068367288 648451285 /nfs/dbraw/zinc/45/12/85/648451285.db2.gz MOWHAFVATJZGHF-UHFFFAOYSA-N 1 2 321.446 2.081 20 10 DECDLO C[N@H+](Cc1ccc(N2CCOCC2)cc1)CN1CCSC1=O ZINC000068367288 648451288 /nfs/dbraw/zinc/45/12/88/648451288.db2.gz MOWHAFVATJZGHF-UHFFFAOYSA-N 1 2 321.446 2.081 20 10 DECDLO C[C@@H]1CN(Cc2cc(Cl)c(F)cc2O)C[C@H](C)[N@H+]1CCO ZINC000824926147 648673249 /nfs/dbraw/zinc/67/32/49/648673249.db2.gz KRKRLOSOAVXHSO-PHIMTYICSA-N 1 2 316.804 2.072 20 10 DECDLO C[C@@H]1CN(Cc2cc(Cl)c(F)cc2O)C[C@H](C)[N@@H+]1CCO ZINC000824926147 648673254 /nfs/dbraw/zinc/67/32/54/648673254.db2.gz KRKRLOSOAVXHSO-PHIMTYICSA-N 1 2 316.804 2.072 20 10 DECDLO COc1cc(C[N@@H+]2CCN(C)C(=O)[C@@H]2C)c(O)c(C(C)(C)C)c1 ZINC000825568202 648782135 /nfs/dbraw/zinc/78/21/35/648782135.db2.gz UCEBDQLATSPSDA-LBPRGKRZSA-N 1 2 320.433 2.361 20 10 DECDLO COc1cc(C[N@H+]2CCN(C)C(=O)[C@@H]2C)c(O)c(C(C)(C)C)c1 ZINC000825568202 648782138 /nfs/dbraw/zinc/78/21/38/648782138.db2.gz UCEBDQLATSPSDA-LBPRGKRZSA-N 1 2 320.433 2.361 20 10 DECDLO CN(C)C(=O)N(C)[C@H]1CC[N@H+](Cc2cccc(Cl)c2O)C1 ZINC000827545224 649049399 /nfs/dbraw/zinc/04/93/99/649049399.db2.gz XJAGGODUPJCVRN-LBPRGKRZSA-N 1 2 311.813 2.233 20 10 DECDLO CN(C)C(=O)N(C)[C@H]1CC[N@@H+](Cc2cccc(Cl)c2O)C1 ZINC000827545224 649049402 /nfs/dbraw/zinc/04/94/02/649049402.db2.gz XJAGGODUPJCVRN-LBPRGKRZSA-N 1 2 311.813 2.233 20 10 DECDLO Cc1cc(N(C)C)ccc1CNC(=O)[C@@H]1C[C@H]1c1c[nH+]cn1C ZINC000827962649 649112099 /nfs/dbraw/zinc/11/20/99/649112099.db2.gz PNBFMXCBEDAHIM-HZPDHXFCSA-N 1 2 312.417 2.214 20 10 DECDLO COc1ccc(O)c([C@H](C)NC(=O)C[C@@H](C)n2cc[nH+]c2)c1 ZINC000845832730 651287713 /nfs/dbraw/zinc/28/77/13/651287713.db2.gz GKQMRDSUDHDDII-NEPJUHHUSA-N 1 2 303.362 2.426 20 10 DECDLO O=C(NCc1cc(Cl)ccc1O)[C@@H]1CCc2[nH+]ccn2C1 ZINC000846472172 651332304 /nfs/dbraw/zinc/33/23/04/651332304.db2.gz HZBNCWVYXFBKPK-SNVBAGLBSA-N 1 2 305.765 2.121 20 10 DECDLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N(C)Cc1ccc(N(C)C)cc1 ZINC000847304603 651387685 /nfs/dbraw/zinc/38/76/85/651387685.db2.gz WTWUKIDNIUQSIK-CYBMUJFWSA-N 1 2 300.406 2.313 20 10 DECDLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N(C)Cc1ccc(N(C)C)cc1 ZINC000847304603 651387687 /nfs/dbraw/zinc/38/76/87/651387687.db2.gz WTWUKIDNIUQSIK-CYBMUJFWSA-N 1 2 300.406 2.313 20 10 DECDLO COc1ccc(C[NH2+]Cc2nc([C@@H]3CCCO3)n[nH]2)cc1C ZINC000848562479 651471244 /nfs/dbraw/zinc/47/12/44/651471244.db2.gz KIUUSKATTNRXLK-AWEZNQCLSA-N 1 2 302.378 2.263 20 10 DECDLO C[C@H]([NH2+]C[C@H]1CN(C2CC2)C(=O)O1)c1cc(F)cc(F)c1O ZINC000848572808 651472914 /nfs/dbraw/zinc/47/29/14/651472914.db2.gz VYPYPIUOSHSVJN-KWQFWETISA-N 1 2 312.316 2.304 20 10 DECDLO CCc1cccc(C[NH2+]Cc2nc([C@H]3CCCO3)n[nH]2)c1O ZINC000848923590 651563586 /nfs/dbraw/zinc/56/35/86/651563586.db2.gz GSLQLXWSWXLVPX-CYBMUJFWSA-N 1 2 302.378 2.214 20 10 DECDLO CO[C@H](C[NH2+][C@H](C)c1cc(F)cc(F)c1O)[C@@H]1CCOC1 ZINC000850484920 651937064 /nfs/dbraw/zinc/93/70/64/651937064.db2.gz ULDMSLVZKDBLKC-GPCCPHFNSA-N 1 2 301.333 2.373 20 10 DECDLO COCc1n[nH]c(C[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3F)n1 ZINC000850514564 651942303 /nfs/dbraw/zinc/94/23/03/651942303.db2.gz NNYBTKSAAPAVNU-SCZZXKLOSA-N 1 2 306.341 2.134 20 10 DECDLO C[C@@H]([NH2+]Cc1ncccn1)c1ccc(N2CCOCC2)c(F)c1 ZINC000850552326 651951974 /nfs/dbraw/zinc/95/19/74/651951974.db2.gz MGIRVVKSZDDZMS-CYBMUJFWSA-N 1 2 316.380 2.303 20 10 DECDLO CN(C)c1ccc(CN(C)C(=O)[C@@H]2C[C@H]2c2c[nH+]cn2C)cc1 ZINC000854324506 652678597 /nfs/dbraw/zinc/67/85/97/652678597.db2.gz MBGYNEGLQYGZEC-HZPDHXFCSA-N 1 2 312.417 2.248 20 10 DECDLO OC[C@@H]1C[C@@H](F)C[N@@H+]1Cc1c(O)cccc1Br ZINC000862337554 686278951 /nfs/dbraw/zinc/27/89/51/686278951.db2.gz XAKLPRFAMADKPE-BDAKNGLRSA-N 1 2 304.159 2.059 20 10 DECDLO OC[C@@H]1C[C@@H](F)C[N@H+]1Cc1c(O)cccc1Br ZINC000862337554 686278952 /nfs/dbraw/zinc/27/89/52/686278952.db2.gz XAKLPRFAMADKPE-BDAKNGLRSA-N 1 2 304.159 2.059 20 10 DECDLO CN(C)c1cc(F)c(C[N@@H+]2CC[C@@](O)(C(F)F)C2)cc1F ZINC000862384380 686288615 /nfs/dbraw/zinc/28/86/15/686288615.db2.gz XQNTZDAWDHYTFF-AWEZNQCLSA-N 1 2 306.303 2.233 20 10 DECDLO CN(C)c1cc(F)c(C[N@H+]2CC[C@@](O)(C(F)F)C2)cc1F ZINC000862384380 686288619 /nfs/dbraw/zinc/28/86/19/686288619.db2.gz XQNTZDAWDHYTFF-AWEZNQCLSA-N 1 2 306.303 2.233 20 10 DECDLO Cc1ccc(C[N@@H+]2CCNC(=O)[C@@H]2c2cccs2)c(O)c1 ZINC000876765363 689930259 /nfs/dbraw/zinc/93/02/59/689930259.db2.gz UIBWQRPDZSFVKH-HNNXBMFYSA-N 1 2 302.399 2.435 20 10 DECDLO Cc1ccc(C[N@H+]2CCNC(=O)[C@@H]2c2cccs2)c(O)c1 ZINC000876765363 689930262 /nfs/dbraw/zinc/93/02/62/689930262.db2.gz UIBWQRPDZSFVKH-HNNXBMFYSA-N 1 2 302.399 2.435 20 10 DECDLO Cc1nnc(C[NH2+]Cc2ccc(N3CCOCC3)c(F)c2)s1 ZINC000892622433 692963840 /nfs/dbraw/zinc/96/38/40/692963840.db2.gz PLVIQKFTDLZBDC-UHFFFAOYSA-N 1 2 322.409 2.112 20 10 DECDLO OC[C@@H]1CCC[N@@H+]1Cc1cc(Br)c(F)cc1O ZINC001144292470 790844578 /nfs/dbraw/zinc/84/45/78/790844578.db2.gz CZZLQHBCXVSIQQ-VIFPVBQESA-N 1 2 304.159 2.251 20 10 DECDLO OC[C@@H]1CCC[N@H+]1Cc1cc(Br)c(F)cc1O ZINC001144292470 790844589 /nfs/dbraw/zinc/84/45/89/790844589.db2.gz CZZLQHBCXVSIQQ-VIFPVBQESA-N 1 2 304.159 2.251 20 10 DECDLO C[C@@H](CN(C)C)[NH2+]Cc1cc(Br)cc(F)c1O ZINC000715776693 792511294 /nfs/dbraw/zinc/51/12/94/792511294.db2.gz CJORHYXFZSUSTL-QMMMGPOBSA-N 1 2 305.191 2.334 20 10 DECDLO CC[C@@H]1CC[C@@H]([NH2+][C@@H](Cc2ccc(O)c(O)c2)C(=O)OC)C1 ZINC001173259418 793650836 /nfs/dbraw/zinc/65/08/36/793650836.db2.gz DQUWTTOONPQMCR-BNOWGMLFSA-N 1 2 307.390 2.350 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CC[C@@H](O)[C@H](F)CC1 ZINC001139126773 796328281 /nfs/dbraw/zinc/32/82/81/796328281.db2.gz PTMZGFKENHJGBM-UKRRQHHQSA-N 1 2 321.348 2.102 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CC[C@@H](O)[C@H](F)CC1 ZINC001139126773 796328285 /nfs/dbraw/zinc/32/82/85/796328285.db2.gz PTMZGFKENHJGBM-UKRRQHHQSA-N 1 2 321.348 2.102 20 10 DECDLO C[C@@H]1CN(C2C[NH+](Cc3c(O)cccc3Cl)C2)C[C@H](C)O1 ZINC001140342603 796510235 /nfs/dbraw/zinc/51/02/35/796510235.db2.gz QOAUWLNZXBUUGD-TXEJJXNPSA-N 1 2 310.825 2.339 20 10 DECDLO Cc1cnc(O[C@@H]2CC[N@H+](Cc3c(O)cc(F)cc3F)C2)nc1 ZINC001140585972 796541786 /nfs/dbraw/zinc/54/17/86/796541786.db2.gz XVQHAIPMEXPRJM-GFCCVEGCSA-N 1 2 321.327 2.422 20 10 DECDLO Cc1cnc(O[C@@H]2CC[N@@H+](Cc3c(O)cc(F)cc3F)C2)nc1 ZINC001140585972 796541789 /nfs/dbraw/zinc/54/17/89/796541789.db2.gz XVQHAIPMEXPRJM-GFCCVEGCSA-N 1 2 321.327 2.422 20 10 DECDLO C[C@@H]1C[NH+](Cc2ccc(N3CCOCC3)cc2F)C[C@@H](C)O1 ZINC001140662333 796552456 /nfs/dbraw/zinc/55/24/56/796552456.db2.gz ONZJFWGAFIEJRE-ZIAGYGMSSA-N 1 2 308.397 2.272 20 10 DECDLO CC[C@@H]1COCC[N@@H+]1Cc1ccc(N2CCOCC2)cc1F ZINC001140663569 796552870 /nfs/dbraw/zinc/55/28/70/796552870.db2.gz JGYCDFCYXVUITN-OAHLLOKOSA-N 1 2 308.397 2.273 20 10 DECDLO CC[C@@H]1COCC[N@H+]1Cc1ccc(N2CCOCC2)cc1F ZINC001140663569 796552872 /nfs/dbraw/zinc/55/28/72/796552872.db2.gz JGYCDFCYXVUITN-OAHLLOKOSA-N 1 2 308.397 2.273 20 10 DECDLO Cc1c(O)ccc(C[N@@H+]2C[C@@H]3C[C@H]2[C@@H](C(F)(F)F)O3)c1O ZINC001140748452 796567845 /nfs/dbraw/zinc/56/78/45/796567845.db2.gz GVQFTYYNMNRYFN-KWBADKCTSA-N 1 2 303.280 2.310 20 10 DECDLO Cc1c(O)ccc(C[N@H+]2C[C@@H]3C[C@H]2[C@@H](C(F)(F)F)O3)c1O ZINC001140748452 796567846 /nfs/dbraw/zinc/56/78/46/796567846.db2.gz GVQFTYYNMNRYFN-KWBADKCTSA-N 1 2 303.280 2.310 20 10 DECDLO COc1ccc(N2CC[NH+](Cc3cnco3)CC2)c(OC)c1 ZINC001140933274 796600254 /nfs/dbraw/zinc/60/02/54/796600254.db2.gz POOLGTOXSAZJDC-UHFFFAOYSA-N 1 2 303.362 2.014 20 10 DECDLO CCOC(=O)[C@H]1C[N@H+](Cc2cccc(C(C)(C)C)c2O)CCO1 ZINC001143111076 796803114 /nfs/dbraw/zinc/80/31/14/796803114.db2.gz WPUNCVGOLNPIMC-OAHLLOKOSA-N 1 2 321.417 2.454 20 10 DECDLO CCOC(=O)[C@H]1C[N@@H+](Cc2cccc(C(C)(C)C)c2O)CCO1 ZINC001143111076 796803117 /nfs/dbraw/zinc/80/31/17/796803117.db2.gz WPUNCVGOLNPIMC-OAHLLOKOSA-N 1 2 321.417 2.454 20 10 DECDLO NC(=[NH2+])N(C(=O)c1ccc(O)c(O)c1Cl)c1ccccc1F ZINC001193237165 797529068 /nfs/dbraw/zinc/52/90/68/797529068.db2.gz ZDJVRVMXLLKPIV-UHFFFAOYSA-N 1 2 323.711 2.431 20 10 DECDLO COC(=O)CCC[N@@H+]1CCc2c(c3cc(OC)ccc3n2C)C1 ZINC001202240231 798851860 /nfs/dbraw/zinc/85/18/60/798851860.db2.gz SGZNVLRRZRITRP-UHFFFAOYSA-N 1 2 316.401 2.498 20 10 DECDLO COC(=O)CCC[N@H+]1CCc2c(c3cc(OC)ccc3n2C)C1 ZINC001202240231 798851867 /nfs/dbraw/zinc/85/18/67/798851867.db2.gz SGZNVLRRZRITRP-UHFFFAOYSA-N 1 2 316.401 2.498 20 10 DECDLO CN(C(=O)OC(C)(C)C)C1C[NH+](Cc2ccc(O)cc2O)C1 ZINC001204272570 800198339 /nfs/dbraw/zinc/19/83/39/800198339.db2.gz QLUZTPJAUVUXRK-UHFFFAOYSA-N 1 2 308.378 2.149 20 10 DECDLO Oc1cc(C(F)(F)F)ccc1CN1CC[NH2+]CC(F)(F)C1 ZINC001211347979 801550742 /nfs/dbraw/zinc/55/07/42/801550742.db2.gz VCMUVUNNSZMIEG-UHFFFAOYSA-N 1 2 310.266 2.452 20 10 DECDLO O=C([O-])c1ccc(C[NH+]2CC3(C2)CC[N@H+](CC2CC2)C3)c(O)c1 ZINC001231450680 801668697 /nfs/dbraw/zinc/66/86/97/801668697.db2.gz RXQVYPDWWDJOEG-UHFFFAOYSA-N 1 2 316.401 2.008 20 10 DECDLO O=C([O-])c1ccc(C[NH+]2CC3(C2)CC[N@@H+](CC2CC2)C3)c(O)c1 ZINC001231450680 801668702 /nfs/dbraw/zinc/66/87/02/801668702.db2.gz RXQVYPDWWDJOEG-UHFFFAOYSA-N 1 2 316.401 2.008 20 10 DECDLO COC(=O)[C@@H]1[C@@H]2CC[C@@H](C2)[N@@H+]1Cc1ccc(N(C)C)cc1OC ZINC001231857145 801738323 /nfs/dbraw/zinc/73/83/23/801738323.db2.gz WOVUIRJEKNGWPM-PVUWLOKVSA-N 1 2 318.417 2.287 20 10 DECDLO COC(=O)[C@@H]1[C@@H]2CC[C@@H](C2)[N@H+]1Cc1ccc(N(C)C)cc1OC ZINC001231857145 801738326 /nfs/dbraw/zinc/73/83/26/801738326.db2.gz WOVUIRJEKNGWPM-PVUWLOKVSA-N 1 2 318.417 2.287 20 10 DECDLO CCOC(=O)C[N@@H+](CC)Cc1cc(Cl)c(OC)cc1O ZINC001232267911 801832818 /nfs/dbraw/zinc/83/28/18/801832818.db2.gz JSWXWYJDGIFADL-UHFFFAOYSA-N 1 2 301.770 2.439 20 10 DECDLO Cc1cnc(O[C@H]2CC[N@H+](Cc3ccc(F)c(F)c3O)C2)nc1 ZINC001233079805 802022645 /nfs/dbraw/zinc/02/26/45/802022645.db2.gz LBGQMRNDHVRUQZ-LBPRGKRZSA-N 1 2 321.327 2.422 20 10 DECDLO C[N@@H+]1CC[C@@H](Oc2cccc3c2C(=O)c2c(O)cccc2C3=O)C1 ZINC001226380146 803101618 /nfs/dbraw/zinc/10/16/18/803101618.db2.gz OCCSMRUBGPBKDN-LLVKDONJSA-N 1 2 323.348 2.251 20 10 DECDLO C[N@H+]1CC[C@@H](Oc2cccc3c2C(=O)c2c(O)cccc2C3=O)C1 ZINC001226380146 803101623 /nfs/dbraw/zinc/10/16/23/803101623.db2.gz OCCSMRUBGPBKDN-LLVKDONJSA-N 1 2 323.348 2.251 20 10 DECDLO C[C@H]1[C@H]([NH2+]C[C@@H]([NH3+])c2ccc(N(C)C)cc2)CC[C@H]1CC(=O)[O-] ZINC001594182457 998701035 /nfs/dbraw/zinc/70/10/35/998701035.db2.gz BEKOXEHTHWGNIJ-JWZBEHFJSA-N 1 2 319.449 2.231 20 10 DECDLO CC[C@H]([NH2+]CC1CCOCC1)c1cccc(-c2nn[nH]n2)c1O ZINC001604056739 1070190880 /nfs/dbraw/zinc/19/08/80/1070190880.db2.gz VOVUGBINFKOADZ-AWEZNQCLSA-N 1 2 317.393 2.040 20 10 DECDLO CO[C@@H]1CCCC[C@H]1[NH2+][C@H](C)c1cccc(-c2nn[nH]n2)c1O ZINC001605143892 1070624349 /nfs/dbraw/zinc/62/43/49/1070624349.db2.gz ILBMUEKGBAAFAH-LERXQTSPSA-N 1 2 317.393 2.181 20 10 DECDLO CS(=O)(=O)CC1CC[NH+](Cc2ccc(Cl)cc2O)CC1 ZINC001462271206 1058791667 /nfs/dbraw/zinc/79/16/67/1058791667.db2.gz LKWZSLVVMDLIRI-UHFFFAOYSA-N 1 2 317.838 2.302 20 10 DECDLO COc1ccccc1[C@H]([NH3+])C(=O)NCc1cccc(Cl)c1O ZINC001579302431 1067297640 /nfs/dbraw/zinc/29/76/40/1067297640.db2.gz WSCBJLBHJBWIOV-AWEZNQCLSA-N 1 2 320.776 2.370 20 10 DECDLO NC(=O)N=Nc1ccc(C(=O)NCCNc2cccc[nH+]2)cc1 ZINC001641118861 1078693901 /nfs/dbraw/zinc/69/39/01/1078693901.db2.gz IZUJCUJIPUBKMP-UHFFFAOYSA-N 1 2 312.333 2.086 20 10 DECDLO Cc1[nH]c([C@@H]2CCCN2C(=O)c2cccc(O)c2O)[nH+]c1C ZINC001645370482 1078897267 /nfs/dbraw/zinc/89/72/67/1078897267.db2.gz IPQRQSSEUNIMMQ-LBPRGKRZSA-N 1 2 301.346 2.415 20 10 DECDLO Cc1[nH]c([C@@H]2CCCN2C(=O)Cc2ccc(O)c(O)c2)[nH+]c1C ZINC001649369335 1079115049 /nfs/dbraw/zinc/11/50/49/1079115049.db2.gz GCBZREHRPAYZRN-ZDUSSCGKSA-N 1 2 315.373 2.344 20 10 DECDLO C[C@@H]([NH2+]CC[C@H]1CCCCO1)c1cccc(-c2nn[nH]n2)c1O ZINC001589963761 1076537931 /nfs/dbraw/zinc/53/79/31/1076537931.db2.gz YDPZHFILSQUEQW-VXGBXAGGSA-N 1 2 317.393 2.182 20 10 DECDLO C[C@H]([NH2+]C1C[C@@H](C)O[C@H](C)C1)c1cccc(-c2nn[nH]n2)c1O ZINC001590203870 1076583182 /nfs/dbraw/zinc/58/31/82/1076583182.db2.gz XEEXSDBEPCTWQQ-MXWKQRLJSA-N 1 2 317.393 2.179 20 10 DECDLO CC[C@H](C)[C@H](C[NH2+][C@@H](C)c1cccc(-c2nn[nH]n2)c1O)OC ZINC001590401744 1076621215 /nfs/dbraw/zinc/62/12/15/1076621215.db2.gz XAAGWLUGFVXTKC-MJVIPROJSA-N 1 2 319.409 2.284 20 10 DECDLO CC[C@H]([NH2+][C@H](C)c1cccc(-c2nn[nH]n2)c1O)[C@H](O)C(C)C ZINC001590462103 1076631026 /nfs/dbraw/zinc/63/10/26/1076631026.db2.gz NFCHKRLKXZQAFB-DDTOSNHZSA-N 1 2 319.409 2.018 20 10 DECDLO CC[C@H]([NH2+][C@H](C)c1cccc(-c2nn[nH]n2)c1O)[C@@H](O)C(C)C ZINC001590462105 1076631651 /nfs/dbraw/zinc/63/16/51/1076631651.db2.gz NFCHKRLKXZQAFB-SWHYSGLUSA-N 1 2 319.409 2.018 20 10 DECDLO CC[C@H]([NH2+]C[C@]1(C)CCOC1)c1cccc(-c2nn[nH]n2)c1O ZINC001590462068 1076631728 /nfs/dbraw/zinc/63/17/28/1076631728.db2.gz ALNILPOQXTVSFD-BBRMVZONSA-N 1 2 317.393 2.040 20 10 DECDLO CC[C@@H]([NH2+]CC(C)(C)COC)c1cccc(-c2nn[nH]n2)c1O ZINC001590466600 1076633417 /nfs/dbraw/zinc/63/34/17/1076633417.db2.gz ZHRUIJUOXPMNQC-CYBMUJFWSA-N 1 2 319.409 2.286 20 10 DECDLO CC[C@@H]1C[C@@H]([NH2+][C@@H](C)c2cccc(-c3nn[nH]n3)c2O)CCO1 ZINC001590504775 1076642644 /nfs/dbraw/zinc/64/26/44/1076642644.db2.gz KZNLOWHIUDYQSG-SDDRHHMPSA-N 1 2 317.393 2.181 20 10 DECDLO Cc1cccc(C[NH2+][C@H](C)c2cccc(-c3nn[nH]n3)c2O)n1 ZINC001592230709 1076879723 /nfs/dbraw/zinc/87/97/23/1076879723.db2.gz FUIFDWQSVZAFPU-LLVKDONJSA-N 1 2 310.361 2.127 20 10 DECDLO O=[N+]([O-])c1cnn(CC[NH2+]Cc2cc(Cl)cc(F)c2O)c1 ZINC001657478739 1080175754 /nfs/dbraw/zinc/17/57/54/1080175754.db2.gz CIWDHPMXDFYBMZ-UHFFFAOYSA-N 1 2 314.704 2.079 20 10 DECDLO CCOC(=O)C1C[NH+](Cc2cc(C(F)(F)F)ccc2O)C1 ZINC001237140996 1080444319 /nfs/dbraw/zinc/44/43/19/1080444319.db2.gz QMBQOBIYHIOXTN-UHFFFAOYSA-N 1 2 303.280 2.406 20 10 DECDLO CCC[N@H+](Cc1cc(F)c(F)cc1O)[C@@H]1CCS(=O)(=O)C1 ZINC001664152304 1080866583 /nfs/dbraw/zinc/86/65/83/1080866583.db2.gz UXQWNUSKVLDGLY-LLVKDONJSA-N 1 2 319.373 2.070 20 10 DECDLO CCC[N@@H+](Cc1cc(F)c(F)cc1O)[C@@H]1CCS(=O)(=O)C1 ZINC001664152304 1080866585 /nfs/dbraw/zinc/86/65/85/1080866585.db2.gz UXQWNUSKVLDGLY-LLVKDONJSA-N 1 2 319.373 2.070 20 10 DECDLO O=S1(=O)CCCC[C@@H]1C[NH2+]Cc1cccc(Cl)c1O ZINC000710681406 1086688467 /nfs/dbraw/zinc/68/84/67/1086688467.db2.gz MUGVGNDABHZIFV-LLVKDONJSA-N 1 2 303.811 2.103 20 10 DECDLO O=S1(=O)CCCC[C@H]1C[NH2+]Cc1cccc(Cl)c1O ZINC000710681409 1086688634 /nfs/dbraw/zinc/68/86/34/1086688634.db2.gz MUGVGNDABHZIFV-NSHDSACASA-N 1 2 303.811 2.103 20 10 DECDLO O=C(NCC[NH2+]Cc1cc(F)cc(F)c1O)c1cccs1 ZINC001649155411 1091794881 /nfs/dbraw/zinc/79/48/81/1091794881.db2.gz HMQXECJWOUXDEH-UHFFFAOYSA-N 1 2 312.341 2.252 20 10 DECDLO CCOC(=O)[C@H]1CSCC[N@@H+]1Cc1ccc(CC)cc1O ZINC001236791755 1138430130 /nfs/dbraw/zinc/43/01/30/1138430130.db2.gz KBPMNISQHPFAFD-CQSZACIVSA-N 1 2 309.431 2.435 20 10 DECDLO CCOC(=O)[C@H]1CSCC[N@H+]1Cc1ccc(CC)cc1O ZINC001236791755 1138430134 /nfs/dbraw/zinc/43/01/34/1138430134.db2.gz KBPMNISQHPFAFD-CQSZACIVSA-N 1 2 309.431 2.435 20 10 DECDLO COc1cc(C)c(C[N@@H+]2CCN(C3CCCC3)C(=O)C2)c(O)c1 ZINC001236812885 1138437238 /nfs/dbraw/zinc/43/72/38/1138437238.db2.gz GYCGBFOTSQCRGM-UHFFFAOYSA-N 1 2 318.417 2.296 20 10 DECDLO COc1cc(C)c(C[N@H+]2CCN(C3CCCC3)C(=O)C2)c(O)c1 ZINC001236812885 1138437244 /nfs/dbraw/zinc/43/72/44/1138437244.db2.gz GYCGBFOTSQCRGM-UHFFFAOYSA-N 1 2 318.417 2.296 20 10 DECDLO CC[NH+]1C[C@H]2C[NH+](Cc3ccc(OC)c(Cl)c3[O-])C[C@@H]2C1 ZINC001236817003 1138437736 /nfs/dbraw/zinc/43/77/36/1138437736.db2.gz AWHXHTGRFOVEBR-STQMWFEESA-N 1 2 310.825 2.438 20 10 DECDLO CC[NH+]1C[C@H]2CN(Cc3ccc(OC)c(Cl)c3O)C[C@@H]2C1 ZINC001236817003 1138437742 /nfs/dbraw/zinc/43/77/42/1138437742.db2.gz AWHXHTGRFOVEBR-STQMWFEESA-N 1 2 310.825 2.438 20 10 DECDLO Oc1c(F)cc(Cl)cc1C[NH+]1CCC2(C[C@H](O)CO2)CC1 ZINC001237617476 1138718804 /nfs/dbraw/zinc/71/88/04/1138718804.db2.gz RGMSRGUHFHRJPG-LBPRGKRZSA-N 1 2 315.772 2.301 20 10 DECDLO O=C1CC[N@@H+](Cc2cc(Cl)cc(F)c2O)C[C@H]2CCCN12 ZINC001237624271 1138720807 /nfs/dbraw/zinc/72/08/07/1138720807.db2.gz ROSXBBMHICSQIQ-GFCCVEGCSA-N 1 2 312.772 2.381 20 10 DECDLO O=C1CC[N@H+](Cc2cc(Cl)cc(F)c2O)C[C@H]2CCCN12 ZINC001237624271 1138720818 /nfs/dbraw/zinc/72/08/18/1138720818.db2.gz ROSXBBMHICSQIQ-GFCCVEGCSA-N 1 2 312.772 2.381 20 10 DECDLO CC(=O)C[N@@H+](C)Cc1cccc(I)c1O ZINC001237776515 1138786968 /nfs/dbraw/zinc/78/69/68/1138786968.db2.gz KHSGSCIVGPXDMK-UHFFFAOYSA-N 1 2 319.142 2.018 20 10 DECDLO CC(=O)C[N@H+](C)Cc1cccc(I)c1O ZINC001237776515 1138786977 /nfs/dbraw/zinc/78/69/77/1138786977.db2.gz KHSGSCIVGPXDMK-UHFFFAOYSA-N 1 2 319.142 2.018 20 10 DECDLO Oc1c(I)cccc1C[NH+]1CC=CC1 ZINC001237778477 1138787023 /nfs/dbraw/zinc/78/70/23/1138787023.db2.gz WKIWOGJTXVYSRD-UHFFFAOYSA-N 1 2 301.127 2.369 20 10 DECDLO CC(=O)N[C@H]1CCC[N@H+](Cc2cc(F)c(Cl)cc2O)C1 ZINC001237936065 1138811533 /nfs/dbraw/zinc/81/15/33/1138811533.db2.gz IUFILABZQQOIAX-NSHDSACASA-N 1 2 300.761 2.285 20 10 DECDLO CC(=O)N[C@H]1CCC[N@@H+](Cc2cc(F)c(Cl)cc2O)C1 ZINC001237936065 1138811535 /nfs/dbraw/zinc/81/15/35/1138811535.db2.gz IUFILABZQQOIAX-NSHDSACASA-N 1 2 300.761 2.285 20 10 DECDLO COc1ccc(N2CC[NH+](C[C@@H](O)C(F)(F)F)CC2)c(C)c1 ZINC001250975118 1142359986 /nfs/dbraw/zinc/35/99/86/1142359986.db2.gz RWYMIXLUFDDDNT-CQSZACIVSA-N 1 2 318.339 2.049 20 10 DECDLO COC(=O)C[C@@H]1COCC[N@@H+]1Cc1ccc(N2CCCC2)cc1 ZINC001261184420 1144225095 /nfs/dbraw/zinc/22/50/95/1144225095.db2.gz OGBUAOYWVIGJAN-QGZVFWFLSA-N 1 2 318.417 2.051 20 10 DECDLO COC(=O)C[C@@H]1COCC[N@H+]1Cc1ccc(N2CCCC2)cc1 ZINC001261184420 1144225098 /nfs/dbraw/zinc/22/50/98/1144225098.db2.gz OGBUAOYWVIGJAN-QGZVFWFLSA-N 1 2 318.417 2.051 20 10 DECDLO Oc1c(F)cc(Cl)cc1C[NH2+]CCCO[C@@H]1CCOC1 ZINC001308327224 1147467362 /nfs/dbraw/zinc/46/73/62/1147467362.db2.gz CUFUXXSXBZPPCN-GFCCVEGCSA-N 1 2 303.761 2.470 20 10 DECDLO CC(C)c1ccc(O)c(C[NH+]2CCN(CC[S@@](C)=O)CC2)c1 ZINC001308569442 1147480513 /nfs/dbraw/zinc/48/05/13/1147480513.db2.gz IOAHFQOOLWMBAU-JOCHJYFZSA-N 1 2 324.490 2.012 20 10 DECDLO CNC(=O)[C@@H]1Cc2ccccc2C[N@@H+]1Cc1cc(F)ccc1O ZINC000374877049 529910994 /nfs/dbraw/zinc/91/09/94/529910994.db2.gz PDBFUUXVXUUVGD-INIZCTEOSA-N 1 2 314.360 2.204 20 10 DECDLO CNC(=O)[C@@H]1Cc2ccccc2C[N@H+]1Cc1cc(F)ccc1O ZINC000374877049 529910996 /nfs/dbraw/zinc/91/09/96/529910996.db2.gz PDBFUUXVXUUVGD-INIZCTEOSA-N 1 2 314.360 2.204 20 10 DECDLO CN1CC[N@H+](C)C[C@@H]1C[NH2+]Cc1cc(Cl)cc(Cl)c1[O-] ZINC000225322209 539729906 /nfs/dbraw/zinc/72/99/06/539729906.db2.gz KBRLJZUHLRFRRW-LBPRGKRZSA-N 1 2 318.248 2.034 20 10 DECDLO CN1CC[N@@H+](C)C[C@@H]1C[NH2+]Cc1cc(Cl)cc(Cl)c1[O-] ZINC000225322209 539729910 /nfs/dbraw/zinc/72/99/10/539729910.db2.gz KBRLJZUHLRFRRW-LBPRGKRZSA-N 1 2 318.248 2.034 20 10 DECDLO C[C@H]([NH2+][C@@H](CO)C[C@@H](O)C(C)(C)C)c1ccc(F)c(F)c1O ZINC000284368465 299349834 /nfs/dbraw/zinc/34/98/34/299349834.db2.gz ODAHKPFYKBXNIV-OPQQBVKSSA-N 1 2 317.376 2.479 20 10 DECDLO C[C@@H]([NH2+][C@@H](C)c1ccc(F)c(F)c1O)[C@@H](C)N1CCOCC1 ZINC000187703368 296150304 /nfs/dbraw/zinc/15/03/04/296150304.db2.gz FEDLMSHRYQFHPY-GRYCIOLGSA-N 1 2 314.376 2.430 20 10 DECDLO C[C@@H]([NH2+]C[C@](C)(O)C(F)(F)F)c1cc([N+](=O)[O-])ccc1O ZINC000273546775 130135703 /nfs/dbraw/zinc/13/57/03/130135703.db2.gz ZOAPDUGXTKRXKN-HQJQHLMTSA-N 1 2 308.256 2.264 20 10 DECDLO Cc1nnc(C[N@@H+](Cc2ccccc2O)C[C@H]2CCCO2)n1C ZINC000111232906 401702298 /nfs/dbraw/zinc/70/22/98/401702298.db2.gz RBOJDQKRYWWDAW-OAHLLOKOSA-N 1 2 316.405 2.010 20 10 DECDLO Cc1nnc(C[N@H+](Cc2ccccc2O)C[C@H]2CCCO2)n1C ZINC000111232906 401702301 /nfs/dbraw/zinc/70/23/01/401702301.db2.gz RBOJDQKRYWWDAW-OAHLLOKOSA-N 1 2 316.405 2.010 20 10 DECDLO COc1ccc(N2CCC[N@H+](Cc3noc(C)n3)CC2)cc1 ZINC000052466851 402043103 /nfs/dbraw/zinc/04/31/03/402043103.db2.gz DVCQTAWDWPJGMS-UHFFFAOYSA-N 1 2 302.378 2.099 20 10 DECDLO COc1ccc(N2CCC[N@@H+](Cc3noc(C)n3)CC2)cc1 ZINC000052466851 402043107 /nfs/dbraw/zinc/04/31/07/402043107.db2.gz DVCQTAWDWPJGMS-UHFFFAOYSA-N 1 2 302.378 2.099 20 10 DECDLO COCC[NH+](CCOC)Cc1cc(Cl)cc(C(C)=O)c1O ZINC000048895551 402009229 /nfs/dbraw/zinc/00/92/29/402009229.db2.gz DLRSPDKIWZLTOG-UHFFFAOYSA-N 1 2 315.797 2.343 20 10 DECDLO Cc1noc(C[N@@H+](Cc2ccccc2O)C[C@@H]2CCCO2)n1 ZINC000109761478 402275725 /nfs/dbraw/zinc/27/57/25/402275725.db2.gz LOQZYQTVGTUHSP-AWEZNQCLSA-N 1 2 303.362 2.265 20 10 DECDLO Cc1noc(C[N@H+](Cc2ccccc2O)C[C@@H]2CCCO2)n1 ZINC000109761478 402275730 /nfs/dbraw/zinc/27/57/30/402275730.db2.gz LOQZYQTVGTUHSP-AWEZNQCLSA-N 1 2 303.362 2.265 20 10 DECDLO COc1c(O)c(C[N@H+]2CCOC3(CCCC3)C2)ccc1[N+](=O)[O-] ZINC000278151293 402860151 /nfs/dbraw/zinc/86/01/51/402860151.db2.gz CHTAFJGPRQKPJI-UHFFFAOYSA-N 1 2 322.361 2.454 20 10 DECDLO CC[N@H+](Cc1cnn(C)c1)Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000278328583 402862872 /nfs/dbraw/zinc/86/28/72/402862872.db2.gz ZCRIAAJUCROKEN-UHFFFAOYSA-N 1 2 320.349 2.065 20 10 DECDLO CC[N@@H+](Cc1cnn(C)c1)Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000278328583 402862873 /nfs/dbraw/zinc/86/28/73/402862873.db2.gz ZCRIAAJUCROKEN-UHFFFAOYSA-N 1 2 320.349 2.065 20 10 DECDLO CS(=O)(=O)[C@@H]1CCC[N@H+](Cc2c(O)cccc2Cl)C1 ZINC000274140829 403030396 /nfs/dbraw/zinc/03/03/96/403030396.db2.gz QTZIPMLHWPKHJQ-SNVBAGLBSA-N 1 2 303.811 2.055 20 10 DECDLO CS(=O)(=O)[C@@H]1CCC[N@@H+](Cc2c(O)cccc2Cl)C1 ZINC000274140829 403030398 /nfs/dbraw/zinc/03/03/98/403030398.db2.gz QTZIPMLHWPKHJQ-SNVBAGLBSA-N 1 2 303.811 2.055 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@H+]2C[C@@H](C)O[C@]3(CCOC3)C2)c1O ZINC000280606789 403018147 /nfs/dbraw/zinc/01/81/47/403018147.db2.gz VQIJFZYPXUFCJM-PIGZYNQJSA-N 1 2 323.364 2.114 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@@H+]2C[C@@H](C)O[C@]3(CCOC3)C2)c1O ZINC000280606789 403018150 /nfs/dbraw/zinc/01/81/50/403018150.db2.gz VQIJFZYPXUFCJM-PIGZYNQJSA-N 1 2 323.364 2.114 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@H+](CCO)Cc2cccnc2)c1O ZINC000268698225 403107717 /nfs/dbraw/zinc/10/77/17/403107717.db2.gz QRNQLDJZSUTSEM-UHFFFAOYSA-N 1 2 318.348 2.123 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@@H+](CCO)Cc2cccnc2)c1O ZINC000268698225 403107718 /nfs/dbraw/zinc/10/77/18/403107718.db2.gz QRNQLDJZSUTSEM-UHFFFAOYSA-N 1 2 318.348 2.123 20 10 DECDLO COC(=O)[C@@H]([NH2+]Cc1cc(-c2ccccc2)ccc1O)[C@H](C)O ZINC000276438453 403175161 /nfs/dbraw/zinc/17/51/61/403175161.db2.gz IKHQAAMABVQIHZ-SJCJKPOMSA-N 1 2 315.369 2.071 20 10 DECDLO CS(=O)(=O)C[C@@H]1CCC[N@H+](Cc2cccc(Cl)c2O)C1 ZINC000293848133 403579573 /nfs/dbraw/zinc/57/95/73/403579573.db2.gz HNMXWIXHNMEHSY-LLVKDONJSA-N 1 2 317.838 2.302 20 10 DECDLO CS(=O)(=O)C[C@@H]1CCC[N@@H+](Cc2cccc(Cl)c2O)C1 ZINC000293848133 403579574 /nfs/dbraw/zinc/57/95/74/403579574.db2.gz HNMXWIXHNMEHSY-LLVKDONJSA-N 1 2 317.838 2.302 20 10 DECDLO CS(=O)(=O)C[C@H]1CCC[N@H+](Cc2cccc(Cl)c2O)C1 ZINC000293848137 403579615 /nfs/dbraw/zinc/57/96/15/403579615.db2.gz HNMXWIXHNMEHSY-NSHDSACASA-N 1 2 317.838 2.302 20 10 DECDLO CS(=O)(=O)C[C@H]1CCC[N@@H+](Cc2cccc(Cl)c2O)C1 ZINC000293848137 403579616 /nfs/dbraw/zinc/57/96/16/403579616.db2.gz HNMXWIXHNMEHSY-NSHDSACASA-N 1 2 317.838 2.302 20 10 DECDLO CCOC(=O)[C@@H](F)C1C[NH+](Cc2c(O)cccc2Cl)C1 ZINC000294023045 403626149 /nfs/dbraw/zinc/62/61/49/403626149.db2.gz VAJRDFOPIBODJS-ZDUSSCGKSA-N 1 2 301.745 2.379 20 10 DECDLO C[C@H]1C[N@H+](Cc2cc(Cl)c(F)cc2O)CC[S@@](=O)C1 ZINC000294799638 403734510 /nfs/dbraw/zinc/73/45/10/403734510.db2.gz VVSINTNZVWENJS-ZRNGKTOUSA-N 1 2 305.802 2.385 20 10 DECDLO C[C@H]1C[N@@H+](Cc2cc(Cl)c(F)cc2O)CC[S@@](=O)C1 ZINC000294799638 403734514 /nfs/dbraw/zinc/73/45/14/403734514.db2.gz VVSINTNZVWENJS-ZRNGKTOUSA-N 1 2 305.802 2.385 20 10 DECDLO C[C@@H]([NH2+][C@@H](C)[C@@H](C)N1CCOCC1)c1ccc(F)c(F)c1O ZINC000187703348 287049919 /nfs/dbraw/zinc/04/99/19/287049919.db2.gz FEDLMSHRYQFHPY-QJPTWQEYSA-N 1 2 314.376 2.430 20 10 DECDLO C[C@H](C[NH2+][C@@H](C)c1ccc(F)c(F)c1O)CN1CCOCC1 ZINC000187728737 298778952 /nfs/dbraw/zinc/77/89/52/298778952.db2.gz NEFHIGQEZMVFBO-NEPJUHHUSA-N 1 2 314.376 2.289 20 10 DECDLO Cn1cc[nH+]c1[C@@H]1N(C(=O)c2cccc(O)c2O)CC1(C)C ZINC000295824371 303000913 /nfs/dbraw/zinc/00/09/13/303000913.db2.gz HYNOBYHZMUHGCX-ZDUSSCGKSA-N 1 2 301.346 2.055 20 10 DECDLO NC(=O)[C@@H]1[C@H]2CCC[C@H]2C[N@@H+]1Cc1c(O)ccc(Cl)c1F ZINC000364586605 303321046 /nfs/dbraw/zinc/32/10/46/303321046.db2.gz ZJRIHFOEHJTRCV-FZNYLWTLSA-N 1 2 312.772 2.271 20 10 DECDLO NC(=O)[C@@H]1[C@H]2CCC[C@H]2C[N@H+]1Cc1c(O)ccc(Cl)c1F ZINC000364586605 303321049 /nfs/dbraw/zinc/32/10/49/303321049.db2.gz ZJRIHFOEHJTRCV-FZNYLWTLSA-N 1 2 312.772 2.271 20 10 DECDLO CN(C)C(=O)N1CC[NH+](C/C=C/c2ccc(N(C)C)cc2)CC1 ZINC000835025960 649868308 /nfs/dbraw/zinc/86/83/08/649868308.db2.gz PCDXHLJPSNMDJO-AATRIKPKSA-N 1 2 316.449 2.065 20 10 DECDLO CC[N@@H+](C/C=C\c1ccc(N(C)C)cc1)CCS(C)(=O)=O ZINC000835028182 649868600 /nfs/dbraw/zinc/86/86/00/649868600.db2.gz JSNZOSDGSJKVKU-SREVYHEPSA-N 1 2 310.463 2.132 20 10 DECDLO CC[N@H+](C/C=C\c1ccc(N(C)C)cc1)CCS(C)(=O)=O ZINC000835028182 649868603 /nfs/dbraw/zinc/86/86/03/649868603.db2.gz JSNZOSDGSJKVKU-SREVYHEPSA-N 1 2 310.463 2.132 20 10 DECDLO COc1ccc(O)c(C[N@@H+]2CCOC[C@@H]2c2c(C)n[nH]c2C)c1 ZINC000375016657 534200119 /nfs/dbraw/zinc/20/01/19/534200119.db2.gz FROYBDXPGDQYHJ-OAHLLOKOSA-N 1 2 317.389 2.314 20 10 DECDLO COc1ccc(O)c(C[N@H+]2CCOC[C@@H]2c2c(C)n[nH]c2C)c1 ZINC000375016657 534200128 /nfs/dbraw/zinc/20/01/28/534200128.db2.gz FROYBDXPGDQYHJ-OAHLLOKOSA-N 1 2 317.389 2.314 20 10 DECDLO NC(=O)C[C@H]1CC[N@H+](Cc2cc(Cl)cc(Cl)c2O)C1 ZINC000368135219 534360307 /nfs/dbraw/zinc/36/03/07/534360307.db2.gz OZKAFFDDQKYTDS-MRVPVSSYSA-N 1 2 303.189 2.396 20 10 DECDLO NC(=O)C[C@H]1CC[N@@H+](Cc2cc(Cl)cc(Cl)c2O)C1 ZINC000368135219 534360318 /nfs/dbraw/zinc/36/03/18/534360318.db2.gz OZKAFFDDQKYTDS-MRVPVSSYSA-N 1 2 303.189 2.396 20 10 DECDLO C[NH+](C)C[C@@H]1CN(Cc2cc(Cl)cc(Cl)c2O)CCO1 ZINC000128152549 521852484 /nfs/dbraw/zinc/85/24/84/521852484.db2.gz ZHPYVJFWCCFOJN-GFCCVEGCSA-N 1 2 319.232 2.461 20 10 DECDLO C[C@@H]([NH2+]CCNC(=O)c1ccco1)c1ccc(F)c(F)c1O ZINC000191191024 525451040 /nfs/dbraw/zinc/45/10/40/525451040.db2.gz HNMKWVHJJHZHAF-SECBINFHSA-N 1 2 310.300 2.344 20 10 DECDLO CC(C)[N@H+](Cc1nnnn1C1CC1)Cc1ccc(N(C)C)cc1 ZINC000298705185 535122459 /nfs/dbraw/zinc/12/24/59/535122459.db2.gz IOHQHSPPXMMBPG-UHFFFAOYSA-N 1 2 314.437 2.485 20 10 DECDLO CC(C)[N@@H+](Cc1nnnn1C1CC1)Cc1ccc(N(C)C)cc1 ZINC000298705185 535122464 /nfs/dbraw/zinc/12/24/64/535122464.db2.gz IOHQHSPPXMMBPG-UHFFFAOYSA-N 1 2 314.437 2.485 20 10 DECDLO C[C@@H]1C[N@H+](C/C=C\c2ccc(N(C)C)cc2)CC[S@@](=O)C1 ZINC000835048362 649871564 /nfs/dbraw/zinc/87/15/64/649871564.db2.gz HMBPBIGYIGDQPP-CXAIIMIESA-N 1 2 306.475 2.466 20 10 DECDLO C[C@@H]1C[N@@H+](C/C=C\c2ccc(N(C)C)cc2)CC[S@@](=O)C1 ZINC000835048362 649871567 /nfs/dbraw/zinc/87/15/67/649871567.db2.gz HMBPBIGYIGDQPP-CXAIIMIESA-N 1 2 306.475 2.466 20 10 DECDLO CCOc1ccc(N2CC[NH+](Cc3cc(OC)no3)CC2)cc1 ZINC001327871088 1148663759 /nfs/dbraw/zinc/66/37/59/1148663759.db2.gz WNRPUTJMQFOALY-UHFFFAOYSA-N 1 2 317.389 2.404 20 10 DECDLO O=C(Cc1cn2c([nH+]1)CCCC2)NCc1cccc(Cl)c1O ZINC000890761523 623200069 /nfs/dbraw/zinc/20/00/69/623200069.db2.gz UVQPIIFTTKTVKN-UHFFFAOYSA-N 1 2 319.792 2.437 20 10 DECDLO COc1ccc(C[N@H+](C)CC(=O)OC(C)(C)C)c(O)c1OC ZINC000891861423 624632808 /nfs/dbraw/zinc/63/28/08/624632808.db2.gz NRYHMSMJFGYWNN-UHFFFAOYSA-N 1 2 311.378 2.183 20 10 DECDLO COc1ccc(C[N@@H+](C)CC(=O)OC(C)(C)C)c(O)c1OC ZINC000891861423 624632809 /nfs/dbraw/zinc/63/28/09/624632809.db2.gz NRYHMSMJFGYWNN-UHFFFAOYSA-N 1 2 311.378 2.183 20 10 DECDLO Cc1cc(N(C)C)ccc1CNC(=O)N[C@H](C)Cn1cc[nH+]c1 ZINC000734524867 633387300 /nfs/dbraw/zinc/38/73/00/633387300.db2.gz DOEAQRDKGBZADZ-CQSZACIVSA-N 1 2 315.421 2.145 20 10 DECDLO COC(=O)[C@@H]1C[C@@H](C)CC[N@@H+]1Cc1ccc(OC)c(OC)c1O ZINC000893677659 635757033 /nfs/dbraw/zinc/75/70/33/635757033.db2.gz XDKNCSJHBSCHRQ-AAEUAGOBSA-N 1 2 323.389 2.183 20 10 DECDLO COC(=O)[C@@H]1C[C@@H](C)CC[N@H+]1Cc1ccc(OC)c(OC)c1O ZINC000893677659 635757034 /nfs/dbraw/zinc/75/70/34/635757034.db2.gz XDKNCSJHBSCHRQ-AAEUAGOBSA-N 1 2 323.389 2.183 20 10 DECDLO COc1ccc(C[N@H+](C)[C@H](C)c2nc(C)no2)c(O)c1OC ZINC000895221668 637805365 /nfs/dbraw/zinc/80/53/65/637805365.db2.gz SZNZCSUTNIUKPR-SECBINFHSA-N 1 2 307.350 2.294 20 10 DECDLO COc1ccc(C[N@@H+](C)[C@H](C)c2nc(C)no2)c(O)c1OC ZINC000895221668 637805370 /nfs/dbraw/zinc/80/53/70/637805370.db2.gz SZNZCSUTNIUKPR-SECBINFHSA-N 1 2 307.350 2.294 20 10 DECDLO C[C@H]([NH2+]CC1CCS(=O)(=O)CC1)c1cc(F)cc(F)c1O ZINC000756774902 639693748 /nfs/dbraw/zinc/69/37/48/639693748.db2.gz DXKCBPOGEDHQKO-VIFPVBQESA-N 1 2 319.373 2.146 20 10 DECDLO CC[C@]1(C)CC(=O)N(C[N@H+](C)Cc2ccc(N(C)C)cc2)C1=O ZINC000767961429 641036507 /nfs/dbraw/zinc/03/65/07/641036507.db2.gz CCXPHDCWTBTKDH-GOSISDBHSA-N 1 2 317.433 2.317 20 10 DECDLO CC[C@]1(C)CC(=O)N(C[N@@H+](C)Cc2ccc(N(C)C)cc2)C1=O ZINC000767961429 641036512 /nfs/dbraw/zinc/03/65/12/641036512.db2.gz CCXPHDCWTBTKDH-GOSISDBHSA-N 1 2 317.433 2.317 20 10 DECDLO Oc1c(Br)cccc1C[NH2+]CC[C@@H](O)C1CC1 ZINC000898206243 641046718 /nfs/dbraw/zinc/04/67/18/641046718.db2.gz MUZQCZMCTXWQMW-GFCCVEGCSA-N 1 2 300.196 2.405 20 10 DECDLO Cc1cc(Cl)cc(C[NH+]2CCC(S(C)(=O)=O)CC2)c1O ZINC000775717212 642084262 /nfs/dbraw/zinc/08/42/62/642084262.db2.gz NSLKRRBYWLLBQZ-UHFFFAOYSA-N 1 2 317.838 2.363 20 10 DECDLO COCCc1noc(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)n1 ZINC000775837404 642104039 /nfs/dbraw/zinc/10/40/39/642104039.db2.gz SGLGVAHFFCDWBS-GFCCVEGCSA-N 1 2 304.394 2.175 20 10 DECDLO Cc1cc(N(C)C)ccc1CNC(=O)[C@H]1CCc2[nH+]ccn2C1 ZINC000786988556 643438178 /nfs/dbraw/zinc/43/81/78/643438178.db2.gz MNKJZOWWFBMMSU-HNNXBMFYSA-N 1 2 312.417 2.136 20 10 DECDLO NC(=O)CC1([NH2+]Cc2cccc(Br)c2O)CCC1 ZINC000788436265 643608380 /nfs/dbraw/zinc/60/83/80/643608380.db2.gz UQAWURDWWFMGTL-UHFFFAOYSA-N 1 2 313.195 2.042 20 10 DECDLO CCOC(=O)[C@@H]([NH2+]Cc1cc(C)c(C)cc1O)[C@H]1CCCOC1 ZINC000789581728 643751655 /nfs/dbraw/zinc/75/16/55/643751655.db2.gz SYGJGDJYDNWLHY-YOEHRIQHSA-N 1 2 321.417 2.457 20 10 DECDLO COc1cccc(O)c1C[N@H+](CCO)Cc1cccnc1Cl ZINC000793364431 644239791 /nfs/dbraw/zinc/23/97/91/644239791.db2.gz QOUWOCAXLRARCS-UHFFFAOYSA-N 1 2 322.792 2.444 20 10 DECDLO COc1cccc(O)c1C[N@@H+](CCO)Cc1cccnc1Cl ZINC000793364431 644239792 /nfs/dbraw/zinc/23/97/92/644239792.db2.gz QOUWOCAXLRARCS-UHFFFAOYSA-N 1 2 322.792 2.444 20 10 DECDLO CC[C@@H]([NH2+]Cc1nnn(C)n1)c1ccc(C(F)(F)F)cc1O ZINC000810237694 646342924 /nfs/dbraw/zinc/34/29/24/646342924.db2.gz JVEPOQKJMHIIRU-SNVBAGLBSA-N 1 2 315.299 2.175 20 10 DECDLO C[C@H](O)[C@@H]1CCN(c2cc(NCc3ccccc3O)[nH+]cn2)C1 ZINC000840253573 646653242 /nfs/dbraw/zinc/65/32/42/646653242.db2.gz LZLAKQCJTCODAY-GXTWGEPZSA-N 1 2 314.389 2.001 20 10 DECDLO C[C@H](O)[C@@H]1CCN(c2cc(NCc3ccccc3O)nc[nH+]2)C1 ZINC000840253573 646653246 /nfs/dbraw/zinc/65/32/46/646653246.db2.gz LZLAKQCJTCODAY-GXTWGEPZSA-N 1 2 314.389 2.001 20 10 DECDLO C[C@@H]([NH2+]Cc1ncn(C)n1)c1cccc(C(F)(F)F)c1O ZINC000815600353 647034787 /nfs/dbraw/zinc/03/47/87/647034787.db2.gz QZLFWTFYFPMXEM-MRVPVSSYSA-N 1 2 300.284 2.390 20 10 DECDLO COCC1([NH2+]Cc2cc(Cl)cc(F)c2O)CCOCC1 ZINC000816625757 647160480 /nfs/dbraw/zinc/16/04/80/647160480.db2.gz MRQJFENKDBQWHB-UHFFFAOYSA-N 1 2 303.761 2.470 20 10 DECDLO CCOC(=O)C[N@@H+](Cc1ccccc1O)CC1=CCCOC1 ZINC000822511575 648222419 /nfs/dbraw/zinc/22/24/19/648222419.db2.gz JDJULEHWKCYSNN-UHFFFAOYSA-N 1 2 305.374 2.104 20 10 DECDLO CCOC(=O)C[N@H+](Cc1ccccc1O)CC1=CCCOC1 ZINC000822511575 648222424 /nfs/dbraw/zinc/22/24/24/648222424.db2.gz JDJULEHWKCYSNN-UHFFFAOYSA-N 1 2 305.374 2.104 20 10 DECDLO CN(C)C(=O)O[C@@H]1CC[N@H+](Cc2cc(Cl)cc(F)c2O)C1 ZINC000824576934 648614531 /nfs/dbraw/zinc/61/45/31/648614531.db2.gz VSEMNVXQCYANSD-LLVKDONJSA-N 1 2 316.760 2.457 20 10 DECDLO CN(C)C(=O)O[C@@H]1CC[N@@H+](Cc2cc(Cl)cc(F)c2O)C1 ZINC000824576934 648614533 /nfs/dbraw/zinc/61/45/33/648614533.db2.gz VSEMNVXQCYANSD-LLVKDONJSA-N 1 2 316.760 2.457 20 10 DECDLO COc1ccc(O)c([C@@H](C)[NH2+]Cc2nc([C@@H](C)OC)no2)c1 ZINC000182348269 648886619 /nfs/dbraw/zinc/88/66/19/648886619.db2.gz CTOSMNTUOJGHBM-NXEZZACHSA-N 1 2 307.350 2.342 20 10 DECDLO Cc1cc(C[N@@H+]2CC(=O)N[C@@H](C)C2)ccc1N1CCCCC1 ZINC000831768652 649640578 /nfs/dbraw/zinc/64/05/78/649640578.db2.gz ABPPNZSNWLNOBQ-HNNXBMFYSA-N 1 2 301.434 2.306 20 10 DECDLO Cc1cc(C[N@H+]2CC(=O)N[C@@H](C)C2)ccc1N1CCCCC1 ZINC000831768652 649640581 /nfs/dbraw/zinc/64/05/81/649640581.db2.gz ABPPNZSNWLNOBQ-HNNXBMFYSA-N 1 2 301.434 2.306 20 10 DECDLO COc1cccc([C@@H](C)Nc2ccc(N(C)CCO)c[nH+]2)c1O ZINC000846160877 651312221 /nfs/dbraw/zinc/31/22/21/651312221.db2.gz ULUJSNDFNOSODR-GFCCVEGCSA-N 1 2 317.389 2.397 20 10 DECDLO Oc1cccc(Br)c1C[N@@H+]1CCC2(C1)OCCO2 ZINC000862238731 686262785 /nfs/dbraw/zinc/26/27/85/686262785.db2.gz HMTPLQZEFDCLNE-UHFFFAOYSA-N 1 2 314.179 2.104 20 10 DECDLO Oc1cccc(Br)c1C[N@H+]1CCC2(C1)OCCO2 ZINC000862238731 686262789 /nfs/dbraw/zinc/26/27/89/686262789.db2.gz HMTPLQZEFDCLNE-UHFFFAOYSA-N 1 2 314.179 2.104 20 10 DECDLO CC(C)N1CC[NH+](Cc2ccc(N3CCC(O)CC3)cc2)CC1 ZINC000876565664 689859176 /nfs/dbraw/zinc/85/91/76/689859176.db2.gz YNWIVZJQLDUMOL-UHFFFAOYSA-N 1 2 317.477 2.174 20 10 DECDLO CN(C)C(=O)OC1CC[NH+](Cc2ccc(F)c(F)c2O)CC1 ZINC000877553165 690149737 /nfs/dbraw/zinc/14/97/37/690149737.db2.gz KOZRLBMUPLTXBB-UHFFFAOYSA-N 1 2 314.332 2.333 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@H+]2CC[C@@H]3[C@@H]2CCCN3C)c1O ZINC000880129749 690808983 /nfs/dbraw/zinc/80/89/83/690808983.db2.gz AIEZMPPJDNQSQT-CVEARBPZSA-N 1 2 306.381 2.402 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@@H+]2CC[C@@H]3[C@@H]2CCCN3C)c1O ZINC000880129749 690808988 /nfs/dbraw/zinc/80/89/88/690808988.db2.gz AIEZMPPJDNQSQT-CVEARBPZSA-N 1 2 306.381 2.402 20 10 DECDLO OCc1cc[nH+]c(NCc2ccc(N3CCC(O)CC3)cc2)c1 ZINC000882634543 691331719 /nfs/dbraw/zinc/33/17/19/691331719.db2.gz DEMMHNWDZVXBRB-UHFFFAOYSA-N 1 2 313.401 2.147 20 10 DECDLO C[C@@H]([NH2+][C@H]1CC(=O)N(CC2CC2)C1)c1cc(F)cc(F)c1O ZINC000883395190 691496333 /nfs/dbraw/zinc/49/63/33/691496333.db2.gz PBQOPFJKXCNJIN-SKDRFNHKSA-N 1 2 310.344 2.332 20 10 DECDLO O=C(NCCc1[nH]cc[nH+]1)c1cc2cc(O)c(O)cc2s1 ZINC001444202318 1183313763 /nfs/dbraw/zinc/31/37/63/1183313763.db2.gz VNIUUKMLEOPZET-UHFFFAOYSA-N 1 2 303.343 2.008 20 10 DECDLO CN(C(=O)OC(C)(C)C)[C@@H]1CC[N@@H+]1Cc1c(O)cc(O)cc1O ZINC001144515471 790941996 /nfs/dbraw/zinc/94/19/96/790941996.db2.gz PVIHJGLHRSTQAO-AWEZNQCLSA-N 1 2 324.377 2.202 20 10 DECDLO CN(C(=O)OC(C)(C)C)[C@@H]1CC[N@H+]1Cc1c(O)cc(O)cc1O ZINC001144515471 790942004 /nfs/dbraw/zinc/94/20/04/790942004.db2.gz PVIHJGLHRSTQAO-AWEZNQCLSA-N 1 2 324.377 2.202 20 10 DECDLO CCc1nnc(C[NH2+]Cc2ccc(Br)cc2O)[nH]1 ZINC000691487880 786084577 /nfs/dbraw/zinc/08/45/77/786084577.db2.gz LWXZLQNXMYBVGE-UHFFFAOYSA-N 1 2 311.183 2.125 20 10 DECDLO CCOC[C@@H]1Cn2nccc2C[N@H+](Cc2cccc(F)c2O)C1 ZINC001138127176 796166980 /nfs/dbraw/zinc/16/69/80/796166980.db2.gz RGNFYVZQSCTSFS-ZDUSSCGKSA-N 1 2 319.380 2.396 20 10 DECDLO CCOC[C@@H]1Cn2nccc2C[N@@H+](Cc2cccc(F)c2O)C1 ZINC001138127176 796166982 /nfs/dbraw/zinc/16/69/82/796166982.db2.gz RGNFYVZQSCTSFS-ZDUSSCGKSA-N 1 2 319.380 2.396 20 10 DECDLO COc1ncnc2c1CC[N@H+](Cc1ccc3c(c1)CCCN3C)C2 ZINC001138358128 796205033 /nfs/dbraw/zinc/20/50/33/796205033.db2.gz MWWBTDFFIDSFIT-UHFFFAOYSA-N 1 2 324.428 2.426 20 10 DECDLO COc1ncnc2c1CC[N@@H+](Cc1ccc3c(c1)CCCN3C)C2 ZINC001138358128 796205038 /nfs/dbraw/zinc/20/50/38/796205038.db2.gz MWWBTDFFIDSFIT-UHFFFAOYSA-N 1 2 324.428 2.426 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2CN1CCC[C@H]([NH+](C)C)C1 ZINC001139127660 796329266 /nfs/dbraw/zinc/32/92/66/796329266.db2.gz MVUBKFVQQFLTTP-ZDUSSCGKSA-N 1 2 316.401 2.333 20 10 DECDLO Cn1cc2c(n1)CC[N@@H+](Cc1cc(Br)ccc1O)C2 ZINC001203643515 796430106 /nfs/dbraw/zinc/43/01/06/796430106.db2.gz WUWPDEWLLMLBEY-UHFFFAOYSA-N 1 2 322.206 2.447 20 10 DECDLO Cn1cc2c(n1)CC[N@H+](Cc1cc(Br)ccc1O)C2 ZINC001203643515 796430108 /nfs/dbraw/zinc/43/01/08/796430108.db2.gz WUWPDEWLLMLBEY-UHFFFAOYSA-N 1 2 322.206 2.447 20 10 DECDLO Cc1nccnc1O[C@@H]1CC[N@H+](Cc2c(O)cc(F)cc2F)C1 ZINC001140585485 796541613 /nfs/dbraw/zinc/54/16/13/796541613.db2.gz KHNPRSXXZGVPCS-GFCCVEGCSA-N 1 2 321.327 2.422 20 10 DECDLO Cc1nccnc1O[C@@H]1CC[N@@H+](Cc2c(O)cc(F)cc2F)C1 ZINC001140585485 796541617 /nfs/dbraw/zinc/54/16/17/796541617.db2.gz KHNPRSXXZGVPCS-GFCCVEGCSA-N 1 2 321.327 2.422 20 10 DECDLO O=C(NCc1[nH+]cn2ccccc12)c1ccc(O)c(O)c1Cl ZINC001193247134 797529564 /nfs/dbraw/zinc/52/95/64/797529564.db2.gz MFQIXEAYDFCQLJ-UHFFFAOYSA-N 1 2 317.732 2.329 20 10 DECDLO COc1cccnc1C[N@@H+]1CCCc2cc(O)c(O)cc2C1 ZINC001206656833 797810209 /nfs/dbraw/zinc/81/02/09/797810209.db2.gz QEPYBCZVINHAMT-UHFFFAOYSA-N 1 2 300.358 2.450 20 10 DECDLO COc1cccnc1C[N@H+]1CCCc2cc(O)c(O)cc2C1 ZINC001206656833 797810218 /nfs/dbraw/zinc/81/02/18/797810218.db2.gz QEPYBCZVINHAMT-UHFFFAOYSA-N 1 2 300.358 2.450 20 10 DECDLO C[C@@H]([NH2+]Cc1ccc(Br)cc1O)c1ncn(C)n1 ZINC000691395267 799508366 /nfs/dbraw/zinc/50/83/66/799508366.db2.gz LQKXKDUUQJVXFP-MRVPVSSYSA-N 1 2 311.183 2.134 20 10 DECDLO OC[C@H]1CCn2nccc2C[N@@H+]1Cc1cc(Cl)ccc1O ZINC001203664693 800101835 /nfs/dbraw/zinc/10/18/35/800101835.db2.gz QEIWMZGRRFLQDB-CQSZACIVSA-N 1 2 307.781 2.009 20 10 DECDLO OC[C@H]1CCn2nccc2C[N@H+]1Cc1cc(Cl)ccc1O ZINC001203664693 800101836 /nfs/dbraw/zinc/10/18/36/800101836.db2.gz QEIWMZGRRFLQDB-CQSZACIVSA-N 1 2 307.781 2.009 20 10 DECDLO Cc1cc(C)c(C[N@@H+]2CCN(c3ccccn3)C(=O)C2)c(O)c1 ZINC001231850479 801736816 /nfs/dbraw/zinc/73/68/16/801736816.db2.gz QIMRMHHYPGQGOY-UHFFFAOYSA-N 1 2 311.385 2.253 20 10 DECDLO Cc1cc(C)c(C[N@H+]2CCN(c3ccccn3)C(=O)C2)c(O)c1 ZINC001231850479 801736823 /nfs/dbraw/zinc/73/68/23/801736823.db2.gz QIMRMHHYPGQGOY-UHFFFAOYSA-N 1 2 311.385 2.253 20 10 DECDLO C[C@H]1C[N@H+](Cc2c(O)cc(Br)cc2F)CC[C@H]1O ZINC001233028319 802007237 /nfs/dbraw/zinc/00/72/37/802007237.db2.gz NFYFIOKQUPMYKQ-QPUJVOFHSA-N 1 2 318.186 2.497 20 10 DECDLO C[C@H]1C[N@@H+](Cc2c(O)cc(Br)cc2F)CC[C@H]1O ZINC001233028319 802007242 /nfs/dbraw/zinc/00/72/42/802007242.db2.gz NFYFIOKQUPMYKQ-QPUJVOFHSA-N 1 2 318.186 2.497 20 10 DECDLO C[NH+]1CCN(C2C[NH+](Cc3cc(C(C)(C)C)ccc3O)C2)CC1 ZINC001233286768 802065063 /nfs/dbraw/zinc/06/50/63/802065063.db2.gz IGPNGTNGSHNIDK-UHFFFAOYSA-N 1 2 317.477 2.121 20 10 DECDLO Oc1c(C[NH+]2CCN(CCF)CC2)cccc1C(F)(F)F ZINC001233418747 802111250 /nfs/dbraw/zinc/11/12/50/802111250.db2.gz UHVJAVFQBWDXSX-UHFFFAOYSA-N 1 2 306.303 2.498 20 10 DECDLO CCCCOCCC[NH2+][C@H](C)c1cccc(-c2nn[nH]n2)c1O ZINC001604188208 1070270892 /nfs/dbraw/zinc/27/08/92/1070270892.db2.gz KYOALHRDIXLNDP-GFCCVEGCSA-N 1 2 319.409 2.430 20 10 DECDLO Cc1ncccc1CC[NH2+][C@@H](C)c1cccc(-c2nn[nH]n2)c1O ZINC001606098490 1071041421 /nfs/dbraw/zinc/04/14/21/1071041421.db2.gz YEHDJLUIDHJELI-LBPRGKRZSA-N 1 2 324.388 2.169 20 10 DECDLO CC[C@@H](C)N1C[C@@]2(F)C[N@H+](Cc3ccccc3O)C[C@@]2(F)C1=O ZINC001272619830 1079017014 /nfs/dbraw/zinc/01/70/14/1079017014.db2.gz ZVLGFTZXLRHVLL-OAUYIBNBSA-N 1 2 324.371 2.265 20 10 DECDLO CC[C@@H](C)N1C[C@@]2(F)C[N@@H+](Cc3ccccc3O)C[C@@]2(F)C1=O ZINC001272619830 1079017023 /nfs/dbraw/zinc/01/70/23/1079017023.db2.gz ZVLGFTZXLRHVLL-OAUYIBNBSA-N 1 2 324.371 2.265 20 10 DECDLO CCNC(=O)N1CC[C@@H]([NH2+]Cc2cc(Cl)cc(F)c2O)C1 ZINC001620832147 1076393606 /nfs/dbraw/zinc/39/36/06/1076393606.db2.gz RTIDPNNWEVIERF-LLVKDONJSA-N 1 2 315.776 2.078 20 10 DECDLO CO[C@H]1CCCC[C@@H]1[NH2+][C@H](C)c1cccc(-c2nn[nH]n2)c1O ZINC001591474399 1076747761 /nfs/dbraw/zinc/74/77/61/1076747761.db2.gz ILBMUEKGBAAFAH-SWHYSGLUSA-N 1 2 317.393 2.181 20 10 DECDLO CC[C@H]([NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1)C1(C(=O)[O-])CCC1 ZINC001609938281 1077953967 /nfs/dbraw/zinc/95/39/67/1077953967.db2.gz WUCXMOVSQCCXMJ-HOTGVXAUSA-N 1 2 319.449 2.376 20 10 DECDLO O=S1(=O)CC[C@@H]([N@H+](Cc2ccc(Cl)cc2O)C2CC2)C1 ZINC001651877927 1079838916 /nfs/dbraw/zinc/83/89/16/1079838916.db2.gz PWPHGTUFSMPOJM-CYBMUJFWSA-N 1 2 315.822 2.197 20 10 DECDLO O=S1(=O)CC[C@@H]([N@@H+](Cc2ccc(Cl)cc2O)C2CC2)C1 ZINC001651877927 1079838917 /nfs/dbraw/zinc/83/89/17/1079838917.db2.gz PWPHGTUFSMPOJM-CYBMUJFWSA-N 1 2 315.822 2.197 20 10 DECDLO COc1c(O)c(C[NH2+][C@@H](C)c2csnn2)ccc1[N+](=O)[O-] ZINC001660049595 1080260292 /nfs/dbraw/zinc/26/02/92/1080260292.db2.gz JRVWFJZKKMKCQK-ZETCQYMHSA-N 1 2 310.335 2.011 20 10 DECDLO C[C@@]1(CO)C[N@@H+](Cc2c(O)ccc(Cl)c2Cl)CC[C@H]1O ZINC001237077304 1080441378 /nfs/dbraw/zinc/44/13/78/1080441378.db2.gz FJDRKJULCWHFGR-OCCSQVGLSA-N 1 2 320.216 2.264 20 10 DECDLO CC(=O)N(C)[C@@H]1CC[N@H+](Cc2cc(F)c(Cl)cc2O)C1 ZINC001237940869 1080501288 /nfs/dbraw/zinc/50/12/88/1080501288.db2.gz OQVOSWAOUXWMSP-LLVKDONJSA-N 1 2 300.761 2.237 20 10 DECDLO CC(=O)N(C)[C@@H]1CC[N@@H+](Cc2cc(F)c(Cl)cc2O)C1 ZINC001237940869 1080501296 /nfs/dbraw/zinc/50/12/96/1080501296.db2.gz OQVOSWAOUXWMSP-LLVKDONJSA-N 1 2 300.761 2.237 20 10 DECDLO CCOC(=O)N[C@@H]1CCC[N@H+](Cc2cc(F)c(F)cc2O)C1 ZINC001663600984 1080785290 /nfs/dbraw/zinc/78/52/90/1080785290.db2.gz UWQQOXCOZBVGDY-LLVKDONJSA-N 1 2 314.332 2.381 20 10 DECDLO CCOC(=O)N[C@@H]1CCC[N@@H+](Cc2cc(F)c(F)cc2O)C1 ZINC001663600984 1080785298 /nfs/dbraw/zinc/78/52/98/1080785298.db2.gz UWQQOXCOZBVGDY-LLVKDONJSA-N 1 2 314.332 2.381 20 10 DECDLO C[C@@H]1CC[N@H+](Cc2cc(Br)cc(F)c2O)C[C@H]1O ZINC001235058186 1084292791 /nfs/dbraw/zinc/29/27/91/1084292791.db2.gz YQXRKKWWIUOLKW-PRHODGIISA-N 1 2 318.186 2.497 20 10 DECDLO C[C@@H]1CC[N@@H+](Cc2cc(Br)cc(F)c2O)C[C@H]1O ZINC001235058186 1084292802 /nfs/dbraw/zinc/29/28/02/1084292802.db2.gz YQXRKKWWIUOLKW-PRHODGIISA-N 1 2 318.186 2.497 20 10 DECDLO Oc1cccc(F)c1CN1CC[NH+](CCc2ccccn2)CC1 ZINC001137837420 1086614448 /nfs/dbraw/zinc/61/44/48/1086614448.db2.gz GGEIWUSFECMRCY-UHFFFAOYSA-N 1 2 315.392 2.287 20 10 DECDLO Oc1cccc(F)c1C[NH+]1CCN(CCc2ccccn2)CC1 ZINC001137837420 1086614455 /nfs/dbraw/zinc/61/44/55/1086614455.db2.gz GGEIWUSFECMRCY-UHFFFAOYSA-N 1 2 315.392 2.287 20 10 DECDLO COc1ccc(C[N@@H+]2CCC[C@@H](NC(C)=O)C2)c(O)c1Cl ZINC001236806520 1138433161 /nfs/dbraw/zinc/43/31/61/1138433161.db2.gz AYDOXYVAXPPDNQ-GFCCVEGCSA-N 1 2 312.797 2.155 20 10 DECDLO COc1ccc(C[N@H+]2CCC[C@@H](NC(C)=O)C2)c(O)c1Cl ZINC001236806520 1138433164 /nfs/dbraw/zinc/43/31/64/1138433164.db2.gz AYDOXYVAXPPDNQ-GFCCVEGCSA-N 1 2 312.797 2.155 20 10 DECDLO CO[C@H]1C[NH2+]C[C@@H]1N(C)Cc1cc(Cl)cc(Cl)c1O ZINC001237161165 1138510417 /nfs/dbraw/zinc/51/04/17/1138510417.db2.gz YPKYLHLJRSJQIE-RYUDHWBXSA-N 1 2 305.205 2.118 20 10 DECDLO CCOc1ccc(N2CC[NH+](C/C=C(/C)C(=O)OC)CC2)cc1 ZINC001319613250 1140625001 /nfs/dbraw/zinc/62/50/01/1140625001.db2.gz ZPLHXCXGMAGUMJ-DHDCSXOGSA-N 1 2 318.417 2.327 20 10 DECDLO CCOc1ccc(N2CC[NH+](C[C@@H](O)C(F)(F)F)CC2)cc1 ZINC001250972881 1142359160 /nfs/dbraw/zinc/35/91/60/1142359160.db2.gz AKEOSXXREAPEIF-CQSZACIVSA-N 1 2 318.339 2.131 20 10 DECDLO CC(=O)c1cc(F)cc(C[NH+]2CCC(c3nc[nH]n3)CC2)c1O ZINC000083444302 355466798 /nfs/dbraw/zinc/46/67/98/355466798.db2.gz MHPYQXPGJLDRKF-UHFFFAOYSA-N 1 2 318.352 2.232 20 10 DECDLO C[C@@H]([NH2+][C@@H](C)CN1CCOCC1)c1ccc(F)c(F)c1O ZINC000191204635 296147295 /nfs/dbraw/zinc/14/72/95/296147295.db2.gz MXADZURULGTLJZ-WDEREUQCSA-N 1 2 300.349 2.042 20 10 DECDLO O=C1CCCN1[C@@H]1CC[N@@H+](Cc2cc(Cl)c(F)cc2O)C1 ZINC000294706452 224181725 /nfs/dbraw/zinc/18/17/25/224181725.db2.gz OMINXADSLJTKFB-LLVKDONJSA-N 1 2 312.772 2.381 20 10 DECDLO O=C1CCCN1[C@@H]1CC[N@H+](Cc2cc(Cl)c(F)cc2O)C1 ZINC000294706452 224181726 /nfs/dbraw/zinc/18/17/26/224181726.db2.gz OMINXADSLJTKFB-LLVKDONJSA-N 1 2 312.772 2.381 20 10 DECDLO C[C@H](CO[C@@H]1CCOC1)[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1O ZINC000273612515 130145922 /nfs/dbraw/zinc/14/59/22/130145922.db2.gz WNOMRYQSVSTJCQ-NTZNESFSSA-N 1 2 310.350 2.145 20 10 DECDLO COc1cc(Cl)cc(C[N@@H+]2CCN(C(C)=O)C[C@H]2C)c1O ZINC000273712684 130157132 /nfs/dbraw/zinc/15/71/32/130157132.db2.gz GKXVNPZVHJFYFG-SNVBAGLBSA-N 1 2 312.797 2.107 20 10 DECDLO COc1cc(Cl)cc(C[N@H+]2CCN(C(C)=O)C[C@H]2C)c1O ZINC000273712684 130157133 /nfs/dbraw/zinc/15/71/33/130157133.db2.gz GKXVNPZVHJFYFG-SNVBAGLBSA-N 1 2 312.797 2.107 20 10 DECDLO CCNC(=O)N1CC[C@H]([NH2+][C@H](C)c2ccc(F)c(F)c2O)C1 ZINC000187795828 285525017 /nfs/dbraw/zinc/52/50/17/285525017.db2.gz GMGZNCRWMJYBJK-ZJUUUORDSA-N 1 2 313.348 2.125 20 10 DECDLO CCN(CCO)CC[NH2+]Cc1cc(Cl)cc(Cl)c1O ZINC000184542948 402273123 /nfs/dbraw/zinc/27/31/23/402273123.db2.gz YTEVZAZALHJDKI-UHFFFAOYSA-N 1 2 307.221 2.103 20 10 DECDLO C[C@@H]([NH2+]CCN1CCOCC1(C)C)c1ccc(F)c(F)c1O ZINC000187695899 402508484 /nfs/dbraw/zinc/50/84/84/402508484.db2.gz DXNYISYVHYLDBM-LLVKDONJSA-N 1 2 314.376 2.432 20 10 DECDLO C[C@@H]1CCN(C(=O)c2cccc(O)c2O)C[C@H]1n1cc[nH+]c1 ZINC000193133470 402766829 /nfs/dbraw/zinc/76/68/29/402766829.db2.gz KTFGTUYHCNTHGR-DGCLKSJQSA-N 1 2 301.346 2.018 20 10 DECDLO COc1ccc(N2CCN(c3nc[nH+]c(N)c3Cl)CC2)cc1 ZINC000278480828 402866913 /nfs/dbraw/zinc/86/69/13/402866913.db2.gz XTZVKIJUCSRSMC-UHFFFAOYSA-N 1 2 319.796 2.047 20 10 DECDLO COc1ccc(N2CCN(c3[nH+]cnc(N)c3Cl)CC2)cc1 ZINC000278480828 402866914 /nfs/dbraw/zinc/86/69/14/402866914.db2.gz XTZVKIJUCSRSMC-UHFFFAOYSA-N 1 2 319.796 2.047 20 10 DECDLO O=C(c1ccccc1)N1CC[NH+](Cc2cccc(F)c2O)CC1 ZINC000272336360 402924952 /nfs/dbraw/zinc/92/49/52/402924952.db2.gz XQCRLEUNFQMICT-UHFFFAOYSA-N 1 2 314.360 2.489 20 10 DECDLO COc1cc(Cl)cc(C[N@@H+]2CC[C@H](C)[S@](=O)CC2)c1O ZINC000277348398 403207698 /nfs/dbraw/zinc/20/76/98/403207698.db2.gz DHRWIFMVHULCFU-WVDJIFEKSA-N 1 2 317.838 2.397 20 10 DECDLO COc1cc(Cl)cc(C[N@H+]2CC[C@H](C)[S@](=O)CC2)c1O ZINC000277348398 403207699 /nfs/dbraw/zinc/20/76/99/403207699.db2.gz DHRWIFMVHULCFU-WVDJIFEKSA-N 1 2 317.838 2.397 20 10 DECDLO CCC[NH+](CCC)c1ccc(CN[C@@H](C(=O)OC)[C@H](C)O)cc1 ZINC000276507252 403182188 /nfs/dbraw/zinc/18/21/88/403182188.db2.gz SQPLVKDTRUTGHR-WMLDXEAASA-N 1 2 322.449 2.325 20 10 DECDLO CCN(Cc1ccc(N(C)C)cc1)C(=O)CCc1c[nH+]cn1C ZINC000276524720 403183608 /nfs/dbraw/zinc/18/36/08/403183608.db2.gz DCJNEOADUWQSIA-UHFFFAOYSA-N 1 2 314.433 2.467 20 10 DECDLO O=[N+]([O-])c1ccc(O)c(C[NH2+][C@@H](CO)Cc2ccc(F)cc2)c1 ZINC000271243424 403282742 /nfs/dbraw/zinc/28/27/42/403282742.db2.gz VATGYEAVRCAIHO-CQSZACIVSA-N 1 2 320.320 2.133 20 10 DECDLO CS(=O)(=O)[C@H]1CCC[N@H+](Cc2cc(Cl)c(F)cc2O)C1 ZINC000293628653 403523260 /nfs/dbraw/zinc/52/32/60/403523260.db2.gz MZDYZRDQOLQYFH-JTQLQIEISA-N 1 2 321.801 2.194 20 10 DECDLO CS(=O)(=O)[C@H]1CCC[N@@H+](Cc2cc(Cl)c(F)cc2O)C1 ZINC000293628653 403523266 /nfs/dbraw/zinc/52/32/66/403523266.db2.gz MZDYZRDQOLQYFH-JTQLQIEISA-N 1 2 321.801 2.194 20 10 DECDLO COc1ccc(N2CCN(c3cc(C)[nH+]cn3)CC2)cc1F ZINC000301555672 403647513 /nfs/dbraw/zinc/64/75/13/403647513.db2.gz IKLWFDSMKFVWFG-UHFFFAOYSA-N 1 2 302.353 2.259 20 10 DECDLO C[C@H]1C[N@H+](Cc2cc(Cl)c(F)cc2O)CC[S@](=O)C1 ZINC000294799629 403734179 /nfs/dbraw/zinc/73/41/79/403734179.db2.gz VVSINTNZVWENJS-UGZDLDLSSA-N 1 2 305.802 2.385 20 10 DECDLO C[C@H]1C[N@@H+](Cc2cc(Cl)c(F)cc2O)CC[S@](=O)C1 ZINC000294799629 403734181 /nfs/dbraw/zinc/73/41/81/403734181.db2.gz VVSINTNZVWENJS-UGZDLDLSSA-N 1 2 305.802 2.385 20 10 DECDLO Cc1nc([C@H](C)[N@H+](C)Cc2ccc(N3CCOCC3)cc2)no1 ZINC000289741453 403995091 /nfs/dbraw/zinc/99/50/91/403995091.db2.gz IEWVOPIBGRAUQC-ZDUSSCGKSA-N 1 2 316.405 2.408 20 10 DECDLO Cc1nc([C@H](C)[N@@H+](C)Cc2ccc(N3CCOCC3)cc2)no1 ZINC000289741453 403995094 /nfs/dbraw/zinc/99/50/94/403995094.db2.gz IEWVOPIBGRAUQC-ZDUSSCGKSA-N 1 2 316.405 2.408 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@@H+]2CCO[C@]3(CCO[C@@H]3C)C2)c1O ZINC000365562496 404691531 /nfs/dbraw/zinc/69/15/31/404691531.db2.gz YJJVVLVIRSAJLC-SJKOYZFVSA-N 1 2 323.364 2.114 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@H+]2CCO[C@]3(CCO[C@@H]3C)C2)c1O ZINC000365562496 404691533 /nfs/dbraw/zinc/69/15/33/404691533.db2.gz YJJVVLVIRSAJLC-SJKOYZFVSA-N 1 2 323.364 2.114 20 10 DECDLO COCCN1CC[C@@H]([NH2+][C@H](C)c2ccc(F)c(F)c2O)C1 ZINC000276930455 292541810 /nfs/dbraw/zinc/54/18/10/292541810.db2.gz ODXATXYGWRYRFT-GHMZBOCLSA-N 1 2 300.349 2.042 20 10 DECDLO COc1ccc(O)c(C[N@@H+]2CCNC(=O)[C@H]2c2cccs2)c1 ZINC000373214651 534202029 /nfs/dbraw/zinc/20/20/29/534202029.db2.gz FNIVQQWPYRFNKY-OAHLLOKOSA-N 1 2 318.398 2.135 20 10 DECDLO COc1ccc(O)c(C[N@H+]2CCNC(=O)[C@H]2c2cccs2)c1 ZINC000373214651 534202035 /nfs/dbraw/zinc/20/20/35/534202035.db2.gz FNIVQQWPYRFNKY-OAHLLOKOSA-N 1 2 318.398 2.135 20 10 DECDLO CN(C)c1ccc(C[NH+]2CCN(C(=O)c3ccco3)CC2)cc1 ZINC000158448659 522182665 /nfs/dbraw/zinc/18/26/65/522182665.db2.gz FMKQLVOTEPZIAN-UHFFFAOYSA-N 1 2 313.401 2.304 20 10 DECDLO C[C@H]([NH2+]Cc1cccc(Cl)c1O)C(=O)NCc1ccco1 ZINC000181197766 525457125 /nfs/dbraw/zinc/45/71/25/525457125.db2.gz HTLMRZVEXUAFIS-JTQLQIEISA-N 1 2 308.765 2.433 20 10 DECDLO COC(=O)[C@H](C)[NH2+]Cc1cc(Br)cc(C)c1O ZINC000272394928 536636574 /nfs/dbraw/zinc/63/65/74/536636574.db2.gz HXKCTLQZUKNMJX-QMMMGPOBSA-N 1 2 302.168 2.114 20 10 DECDLO COC(=O)C[C@@H]1COCC[N@@H+]1C/C=C\c1ccc(N(C)C)cc1 ZINC000835053630 649872339 /nfs/dbraw/zinc/87/23/39/649872339.db2.gz ONGGLPGNOZCIHG-VGOKWCNXSA-N 1 2 318.417 2.030 20 10 DECDLO COC(=O)C[C@@H]1COCC[N@H+]1C/C=C\c1ccc(N(C)C)cc1 ZINC000835053630 649872341 /nfs/dbraw/zinc/87/23/41/649872341.db2.gz ONGGLPGNOZCIHG-VGOKWCNXSA-N 1 2 318.417 2.030 20 10 DECDLO CN(C)c1ccc(/C=C\C[N@@H+]2CCOC[C@]23CCOC3)cc1 ZINC000835052084 649872430 /nfs/dbraw/zinc/87/24/30/649872430.db2.gz NTJVSLNZGXACMP-DDKKJVIOSA-N 1 2 302.418 2.257 20 10 DECDLO CN(C)c1ccc(/C=C\C[N@H+]2CCOC[C@]23CCOC3)cc1 ZINC000835052084 649872433 /nfs/dbraw/zinc/87/24/33/649872433.db2.gz NTJVSLNZGXACMP-DDKKJVIOSA-N 1 2 302.418 2.257 20 10 DECDLO CN(C)c1ccc(/C=C/C[N@@H+]2CCOC[C@@]23CCOC3)cc1 ZINC000835052091 649872240 /nfs/dbraw/zinc/87/22/40/649872240.db2.gz NTJVSLNZGXACMP-WHLIDYPQSA-N 1 2 302.418 2.257 20 10 DECDLO CN(C)c1ccc(/C=C/C[N@H+]2CCOC[C@@]23CCOC3)cc1 ZINC000835052091 649872241 /nfs/dbraw/zinc/87/22/41/649872241.db2.gz NTJVSLNZGXACMP-WHLIDYPQSA-N 1 2 302.418 2.257 20 10 DECDLO CCS(=O)(=O)C1CC[NH+](Cc2cc(Cl)ccc2O)CC1 ZINC000195164140 625776506 /nfs/dbraw/zinc/77/65/06/625776506.db2.gz VEBUUPFBZFPDSS-UHFFFAOYSA-N 1 2 317.838 2.445 20 10 DECDLO Oc1c(F)cc(Br)cc1C[N@H+]1CCC[C@H](O)C1 ZINC000893872883 636051853 /nfs/dbraw/zinc/05/18/53/636051853.db2.gz XFCBZSISAVXUID-JTQLQIEISA-N 1 2 304.159 2.251 20 10 DECDLO Oc1c(F)cc(Br)cc1C[N@@H+]1CCC[C@H](O)C1 ZINC000893872883 636051854 /nfs/dbraw/zinc/05/18/54/636051854.db2.gz XFCBZSISAVXUID-JTQLQIEISA-N 1 2 304.159 2.251 20 10 DECDLO COc1ccc(CNC(=O)NCc2c[nH+]c(C)cc2C)c(O)c1 ZINC000836656837 650116894 /nfs/dbraw/zinc/11/68/94/650116894.db2.gz OBMZHWZHUOLSGB-UHFFFAOYSA-N 1 2 315.373 2.412 20 10 DECDLO COC(=O)[C@H]1C[C@H](C)CC[N@@H+]1Cc1ccc(OC)c(OC)c1O ZINC000893677660 635756862 /nfs/dbraw/zinc/75/68/62/635756862.db2.gz XDKNCSJHBSCHRQ-DGCLKSJQSA-N 1 2 323.389 2.183 20 10 DECDLO COC(=O)[C@H]1C[C@H](C)CC[N@H+]1Cc1ccc(OC)c(OC)c1O ZINC000893677660 635756865 /nfs/dbraw/zinc/75/68/65/635756865.db2.gz XDKNCSJHBSCHRQ-DGCLKSJQSA-N 1 2 323.389 2.183 20 10 DECDLO CC[N@H+](Cc1cc(F)cc(F)c1O)[C@H](C)CS(=O)(=O)CC ZINC000894025457 636095082 /nfs/dbraw/zinc/09/50/82/636095082.db2.gz BBZRRKBFWXXOFS-SNVBAGLBSA-N 1 2 321.389 2.316 20 10 DECDLO CC[N@@H+](Cc1cc(F)cc(F)c1O)[C@H](C)CS(=O)(=O)CC ZINC000894025457 636095085 /nfs/dbraw/zinc/09/50/85/636095085.db2.gz BBZRRKBFWXXOFS-SNVBAGLBSA-N 1 2 321.389 2.316 20 10 DECDLO OC[C@H]1CSCC[N@@H+]1Cc1cccc(Br)c1O ZINC000877780437 636425648 /nfs/dbraw/zinc/42/56/48/636425648.db2.gz QRNQDSMHQHWKHZ-JTQLQIEISA-N 1 2 318.236 2.064 20 10 DECDLO OC[C@H]1CSCC[N@H+]1Cc1cccc(Br)c1O ZINC000877780437 636425651 /nfs/dbraw/zinc/42/56/51/636425651.db2.gz QRNQDSMHQHWKHZ-JTQLQIEISA-N 1 2 318.236 2.064 20 10 DECDLO COC(=O)c1cnc(C[NH2+]Cc2ccc(N(C)C)c(F)c2)s1 ZINC000894209209 636450298 /nfs/dbraw/zinc/45/02/98/636450298.db2.gz QSKZEOALENRFEE-UHFFFAOYSA-N 1 2 323.393 2.425 20 10 DECDLO C[N@H+](Cc1cc(Br)cc(F)c1O)C1CC(O)C1 ZINC000894461211 637054649 /nfs/dbraw/zinc/05/46/49/637054649.db2.gz DXQIBALDINSRTE-UHFFFAOYSA-N 1 2 304.159 2.249 20 10 DECDLO C[N@@H+](Cc1cc(Br)cc(F)c1O)C1CC(O)C1 ZINC000894461211 637054653 /nfs/dbraw/zinc/05/46/53/637054653.db2.gz DXQIBALDINSRTE-UHFFFAOYSA-N 1 2 304.159 2.249 20 10 DECDLO Cc1nnc([C@H](C)[N@H+](C)Cc2ccc(N3CCOCC3)cc2)[nH]1 ZINC000839459762 637883586 /nfs/dbraw/zinc/88/35/86/637883586.db2.gz SGWWIDXPWQBHDO-ZDUSSCGKSA-N 1 2 315.421 2.143 20 10 DECDLO Cc1nnc([C@H](C)[N@@H+](C)Cc2ccc(N3CCOCC3)cc2)[nH]1 ZINC000839459762 637883591 /nfs/dbraw/zinc/88/35/91/637883591.db2.gz SGWWIDXPWQBHDO-ZDUSSCGKSA-N 1 2 315.421 2.143 20 10 DECDLO Cc1cn(C(C)(C)C(=O)NCc2ccc(N(C)C)cc2)c[nH+]1 ZINC000895487415 638048623 /nfs/dbraw/zinc/04/86/23/638048623.db2.gz FXKZKEQDQJCTJQ-UHFFFAOYSA-N 1 2 300.406 2.309 20 10 DECDLO COc1ccc(C[N@@H+]2CCO[C@@](C)(C(F)F)C2)c(O)c1OC ZINC000895484671 638053685 /nfs/dbraw/zinc/05/36/85/638053685.db2.gz SVLSHMLWIMYYOQ-OAHLLOKOSA-N 1 2 317.332 2.265 20 10 DECDLO COc1ccc(C[N@H+]2CCO[C@@](C)(C(F)F)C2)c(O)c1OC ZINC000895484671 638053689 /nfs/dbraw/zinc/05/36/89/638053689.db2.gz SVLSHMLWIMYYOQ-OAHLLOKOSA-N 1 2 317.332 2.265 20 10 DECDLO COC(=O)N[C@H]1CC[N@H+](Cc2cc(Cl)c(F)cc2O)C1 ZINC000895848872 638231986 /nfs/dbraw/zinc/23/19/86/638231986.db2.gz QSHJPQYKMPLDGB-VIFPVBQESA-N 1 2 302.733 2.115 20 10 DECDLO COC(=O)N[C@H]1CC[N@@H+](Cc2cc(Cl)c(F)cc2O)C1 ZINC000895848872 638231988 /nfs/dbraw/zinc/23/19/88/638231988.db2.gz QSHJPQYKMPLDGB-VIFPVBQESA-N 1 2 302.733 2.115 20 10 DECDLO Cc1cc(C(=O)NCc2[nH]c[nH+]c2C)c(C)n1-c1ccccn1 ZINC000748406640 638552696 /nfs/dbraw/zinc/55/26/96/638552696.db2.gz TYISAQSZLVPPNO-UHFFFAOYSA-N 1 2 309.373 2.451 20 10 DECDLO Fc1cc(C[N@@H+]2CCn3cccc3C2)ccc1N1CCOCC1 ZINC000896760388 638668649 /nfs/dbraw/zinc/66/86/49/638668649.db2.gz LALBUSPXAWPVQY-UHFFFAOYSA-N 1 2 315.392 2.480 20 10 DECDLO Fc1cc(C[N@H+]2CCn3cccc3C2)ccc1N1CCOCC1 ZINC000896760388 638668654 /nfs/dbraw/zinc/66/86/54/638668654.db2.gz LALBUSPXAWPVQY-UHFFFAOYSA-N 1 2 315.392 2.480 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@@H+]2CC[C@H](c3nnc(C)[nH]3)C2)c1O ZINC000839660109 639783522 /nfs/dbraw/zinc/78/35/22/639783522.db2.gz SCRKUYQABJGPKJ-NSHDSACASA-N 1 2 318.352 2.150 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@H+]2CC[C@H](c3nnc(C)[nH]3)C2)c1O ZINC000839660109 639783529 /nfs/dbraw/zinc/78/35/29/639783529.db2.gz SCRKUYQABJGPKJ-NSHDSACASA-N 1 2 318.352 2.150 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@@H+]2CC[C@H](c3nc(C)n[nH]3)C2)c1O ZINC000839660109 639783532 /nfs/dbraw/zinc/78/35/32/639783532.db2.gz SCRKUYQABJGPKJ-NSHDSACASA-N 1 2 318.352 2.150 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@H+]2CC[C@H](c3nc(C)n[nH]3)C2)c1O ZINC000839660109 639783537 /nfs/dbraw/zinc/78/35/37/639783537.db2.gz SCRKUYQABJGPKJ-NSHDSACASA-N 1 2 318.352 2.150 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@@H+]2CC[C@H](c3n[nH]c(C)n3)C2)c1O ZINC000839660109 639783541 /nfs/dbraw/zinc/78/35/41/639783541.db2.gz SCRKUYQABJGPKJ-NSHDSACASA-N 1 2 318.352 2.150 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@H+]2CC[C@H](c3n[nH]c(C)n3)C2)c1O ZINC000839660109 639783546 /nfs/dbraw/zinc/78/35/46/639783546.db2.gz SCRKUYQABJGPKJ-NSHDSACASA-N 1 2 318.352 2.150 20 10 DECDLO C[C@H]([NH2+][C@@H](CO)C1CCOCC1)c1cc(F)cc(F)c1O ZINC000757656540 639865111 /nfs/dbraw/zinc/86/51/11/639865111.db2.gz BAIQEZUWWVPVFQ-XPTSAGLGSA-N 1 2 301.333 2.109 20 10 DECDLO C[C@@H]1CN(Cc2c(O)ccc(Cl)c2F)[C@@H](C)C[N@@H+]1CCO ZINC000841891204 650594358 /nfs/dbraw/zinc/59/43/58/650594358.db2.gz KIAJBGOJFSYESD-MNOVXSKESA-N 1 2 316.804 2.072 20 10 DECDLO C[C@@H]1CN(Cc2c(O)ccc(Cl)c2F)[C@@H](C)C[N@H+]1CCO ZINC000841891204 650594360 /nfs/dbraw/zinc/59/43/60/650594360.db2.gz KIAJBGOJFSYESD-MNOVXSKESA-N 1 2 316.804 2.072 20 10 DECDLO OCCC1CC([NH2+]Cc2cccc(Br)c2O)C1 ZINC000898008836 640991838 /nfs/dbraw/zinc/99/18/38/640991838.db2.gz WWEGZXVRKMSVJR-UHFFFAOYSA-N 1 2 300.196 2.405 20 10 DECDLO Oc1c(F)cc(Cl)cc1C[NH2+]Cc1cnc2n1CCOC2 ZINC000898271402 641078615 /nfs/dbraw/zinc/07/86/15/641078615.db2.gz YYVJQXDYLLGMBD-UHFFFAOYSA-N 1 2 311.744 2.201 20 10 DECDLO Cc1nnc(C[NH2+][C@@H](C)c2ccc(N3CCOCC3)cc2)o1 ZINC000775259083 642023650 /nfs/dbraw/zinc/02/36/50/642023650.db2.gz NWUHAWSNTRPGNY-LBPRGKRZSA-N 1 2 302.378 2.065 20 10 DECDLO CCN(CC)c1ccc(CN(C)C(=O)Cc2c[nH+]c[nH]2)cc1 ZINC000900025790 642242638 /nfs/dbraw/zinc/24/26/38/642242638.db2.gz HMOUVIXUYKTATQ-UHFFFAOYSA-N 1 2 300.406 2.457 20 10 DECDLO CC(=O)c1cc(F)cc(C[NH+]2CCC(O)(C(F)F)CC2)c1O ZINC000778312346 642370818 /nfs/dbraw/zinc/37/08/18/642370818.db2.gz WAELOJHIZKRWKB-UHFFFAOYSA-N 1 2 317.307 2.326 20 10 DECDLO COc1ccc(O)c(C[N@@H+]2CCN(CC(C)C)C(=O)[C@@H]2C)c1 ZINC000779202275 642471941 /nfs/dbraw/zinc/47/19/41/642471941.db2.gz MIBHHNGMEWCQMS-ZDUSSCGKSA-N 1 2 306.406 2.090 20 10 DECDLO COc1ccc(O)c(C[N@H+]2CCN(CC(C)C)C(=O)[C@@H]2C)c1 ZINC000779202275 642471944 /nfs/dbraw/zinc/47/19/44/642471944.db2.gz MIBHHNGMEWCQMS-ZDUSSCGKSA-N 1 2 306.406 2.090 20 10 DECDLO COC[C@@H]1COCC[N@@H+]1Cc1cc(C(C)(C)C)cc(O)c1O ZINC000902564147 643070851 /nfs/dbraw/zinc/07/08/51/643070851.db2.gz OLLYHCJLPIRXIP-CQSZACIVSA-N 1 2 309.406 2.243 20 10 DECDLO COC[C@@H]1COCC[N@H+]1Cc1cc(C(C)(C)C)cc(O)c1O ZINC000902564147 643070855 /nfs/dbraw/zinc/07/08/55/643070855.db2.gz OLLYHCJLPIRXIP-CQSZACIVSA-N 1 2 309.406 2.243 20 10 DECDLO CCC[N@H+](Cc1cc(F)ccc1O)[C@H](COC)C(=O)OCC ZINC000792184560 644086418 /nfs/dbraw/zinc/08/64/18/644086418.db2.gz HEBXNRSVDHXUTA-CQSZACIVSA-N 1 2 313.369 2.321 20 10 DECDLO CCC[N@@H+](Cc1cc(F)ccc1O)[C@H](COC)C(=O)OCC ZINC000792184560 644086422 /nfs/dbraw/zinc/08/64/22/644086422.db2.gz HEBXNRSVDHXUTA-CQSZACIVSA-N 1 2 313.369 2.321 20 10 DECDLO O=C1CCCN1[C@H]1CC[N@@H+](Cc2c(O)ccc(Cl)c2F)C1 ZINC000792186538 644086554 /nfs/dbraw/zinc/08/65/54/644086554.db2.gz OXKWQVPVJFDIFD-JTQLQIEISA-N 1 2 312.772 2.381 20 10 DECDLO O=C1CCCN1[C@H]1CC[N@H+](Cc2c(O)ccc(Cl)c2F)C1 ZINC000792186538 644086556 /nfs/dbraw/zinc/08/65/56/644086556.db2.gz OXKWQVPVJFDIFD-JTQLQIEISA-N 1 2 312.772 2.381 20 10 DECDLO COc1ccc(N2CC[NH+](Cc3ccnc(C)n3)CC2)cc1F ZINC000796442062 644737087 /nfs/dbraw/zinc/73/70/87/644737087.db2.gz MJKMYCPQMFYWSZ-UHFFFAOYSA-N 1 2 316.380 2.255 20 10 DECDLO CC(C)OC[C@H](CO)[N@H+](C)Cc1c(O)ccc(Cl)c1F ZINC000809768433 646281024 /nfs/dbraw/zinc/28/10/24/646281024.db2.gz LBJCMPRKYDVZMD-JTQLQIEISA-N 1 2 305.777 2.402 20 10 DECDLO CC(C)OC[C@H](CO)[N@@H+](C)Cc1c(O)ccc(Cl)c1F ZINC000809768433 646281030 /nfs/dbraw/zinc/28/10/30/646281030.db2.gz LBJCMPRKYDVZMD-JTQLQIEISA-N 1 2 305.777 2.402 20 10 DECDLO Cc1cc(O)c(C[NH+]2CCN(C(=O)C3CC3)CC2)cc1Cl ZINC000824530242 648603423 /nfs/dbraw/zinc/60/34/23/648603423.db2.gz WURHANOFYZSWQX-UHFFFAOYSA-N 1 2 308.809 2.408 20 10 DECDLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)NCc1ccc2c(c1)CCCN2C ZINC000847405227 651394179 /nfs/dbraw/zinc/39/41/79/651394179.db2.gz CETBMGYYSPLHMB-CYBMUJFWSA-N 1 2 312.417 2.287 20 10 DECDLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)NCc1ccc2c(c1)CCCN2C ZINC000847405227 651394181 /nfs/dbraw/zinc/39/41/81/651394181.db2.gz CETBMGYYSPLHMB-CYBMUJFWSA-N 1 2 312.417 2.287 20 10 DECDLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)NCCCSc1nccs1 ZINC000847488293 651398499 /nfs/dbraw/zinc/39/84/99/651398499.db2.gz WFNYWVVWCYLEBL-SNVBAGLBSA-N 1 2 310.448 2.343 20 10 DECDLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)NCCCSc1nccs1 ZINC000847488293 651398500 /nfs/dbraw/zinc/39/85/00/651398500.db2.gz WFNYWVVWCYLEBL-SNVBAGLBSA-N 1 2 310.448 2.343 20 10 DECDLO Oc1cccc2c1[C@H]([NH2+]Cc1nc([C@@H]3CCCO3)n[nH]1)CC2 ZINC000848557907 651470519 /nfs/dbraw/zinc/47/05/19/651470519.db2.gz NEXWBYBIMHZLHG-YPMHNXCESA-N 1 2 300.362 2.139 20 10 DECDLO Cc1cc(O)c(C[NH2+]Cc2nc([C@H]3CCCO3)n[nH]2)cc1C ZINC000848563653 651471541 /nfs/dbraw/zinc/47/15/41/651471541.db2.gz XSOZDGSXDFIZMU-CQSZACIVSA-N 1 2 302.378 2.268 20 10 DECDLO O=C(CCCn1cc[nH+]c1)NCCCSc1nccs1 ZINC000114374172 651948788 /nfs/dbraw/zinc/94/87/88/651948788.db2.gz YMWJMHFONQQAHL-UHFFFAOYSA-N 1 2 310.448 2.418 20 10 DECDLO CN(C)c1cc(F)c(C[N@@H+]2CC[C@](O)(C(F)F)C2)cc1F ZINC000862384381 686288657 /nfs/dbraw/zinc/28/86/57/686288657.db2.gz XQNTZDAWDHYTFF-CQSZACIVSA-N 1 2 306.303 2.233 20 10 DECDLO CN(C)c1cc(F)c(C[N@H+]2CC[C@](O)(C(F)F)C2)cc1F ZINC000862384381 686288663 /nfs/dbraw/zinc/28/86/63/686288663.db2.gz XQNTZDAWDHYTFF-CQSZACIVSA-N 1 2 306.303 2.233 20 10 DECDLO CC(C)C1(O)C[NH+](Cc2c(O)cccc2Br)C1 ZINC000862390517 686290213 /nfs/dbraw/zinc/29/02/13/686290213.db2.gz XPCSQRNAQFHALJ-UHFFFAOYSA-N 1 2 300.196 2.357 20 10 DECDLO C[C@H](NC(=O)NCCCCn1cc[nH+]c1)c1ccccc1O ZINC000868123375 687917710 /nfs/dbraw/zinc/91/77/10/687917710.db2.gz FTCGEZSTOLMKDO-ZDUSSCGKSA-N 1 2 302.378 2.429 20 10 DECDLO CC(C)C(=O)N[C@@H]1CCC[N@H+](Cc2ccc(F)c(F)c2O)C1 ZINC000876654865 689890792 /nfs/dbraw/zinc/89/07/92/689890792.db2.gz RKEOFMIKPIZSDO-GFCCVEGCSA-N 1 2 312.360 2.407 20 10 DECDLO CC(C)C(=O)N[C@@H]1CCC[N@@H+](Cc2ccc(F)c(F)c2O)C1 ZINC000876654865 689890798 /nfs/dbraw/zinc/89/07/98/689890798.db2.gz RKEOFMIKPIZSDO-GFCCVEGCSA-N 1 2 312.360 2.407 20 10 DECDLO Cc1cccc(O)c1C[N@@H+]1CCNC(=O)[C@H]1c1cccs1 ZINC000876764503 689930375 /nfs/dbraw/zinc/93/03/75/689930375.db2.gz PWSVREQGSQKMBW-OAHLLOKOSA-N 1 2 302.399 2.435 20 10 DECDLO Cc1cccc(O)c1C[N@H+]1CCNC(=O)[C@H]1c1cccs1 ZINC000876764503 689930376 /nfs/dbraw/zinc/93/03/76/689930376.db2.gz PWSVREQGSQKMBW-OAHLLOKOSA-N 1 2 302.399 2.435 20 10 DECDLO CC(=O)c1cc(Cl)cc(C[N@@H+]2CCNC(=O)CC2(C)C)c1O ZINC000931201935 694339178 /nfs/dbraw/zinc/33/91/78/694339178.db2.gz HETYUXKTQQTRIK-UHFFFAOYSA-N 1 2 324.808 2.349 20 10 DECDLO CC(=O)c1cc(Cl)cc(C[N@H+]2CCNC(=O)CC2(C)C)c1O ZINC000931201935 694339180 /nfs/dbraw/zinc/33/91/80/694339180.db2.gz HETYUXKTQQTRIK-UHFFFAOYSA-N 1 2 324.808 2.349 20 10 DECDLO C[C@@](CO)([NH2+]Cc1ccc(F)c(F)c1O)c1cccc(O)c1 ZINC000877648732 690178533 /nfs/dbraw/zinc/17/85/33/690178533.db2.gz SXSRUZTWSJTBRC-INIZCTEOSA-N 1 2 309.312 2.373 20 10 DECDLO C[C@H]1CN(CCC[NH2+]Cc2cc(F)cc(F)c2O)C[C@H](C)O1 ZINC000882882106 691378572 /nfs/dbraw/zinc/37/85/72/691378572.db2.gz UMEDKXMBYRZTHZ-RYUDHWBXSA-N 1 2 314.376 2.259 20 10 DECDLO Nc1ccc(C[NH+]2CCN(C(=O)c3ccsc3)CC2)cc1 ZINC001356083369 1152056637 /nfs/dbraw/zinc/05/66/37/1152056637.db2.gz NUTXRTSKKYHUNC-UHFFFAOYSA-N 1 2 301.415 2.288 20 10 DECDLO CS(=O)(=O)[C@H]1CCC[N@H+](Cc2ccc(Cl)cc2O)C1 ZINC001140466121 777190559 /nfs/dbraw/zinc/19/05/59/777190559.db2.gz XROVLAIVCSKDQT-LBPRGKRZSA-N 1 2 303.811 2.055 20 10 DECDLO CS(=O)(=O)[C@H]1CCC[N@@H+](Cc2ccc(Cl)cc2O)C1 ZINC001140466121 777190562 /nfs/dbraw/zinc/19/05/62/777190562.db2.gz XROVLAIVCSKDQT-LBPRGKRZSA-N 1 2 303.811 2.055 20 10 DECDLO Oc1c(F)cc(Br)cc1C[NH2+][C@@H]1CCC[C@H]1O ZINC000715817834 792524519 /nfs/dbraw/zinc/52/45/19/792524519.db2.gz KEFPEJWHWGMKNM-GHMZBOCLSA-N 1 2 304.159 2.297 20 10 DECDLO COc1ccc(C[N@H+]2CC[C@@H](F)[C@@H]([NH3+])CC2)c([O-])c1Cl ZINC001206201587 793734421 /nfs/dbraw/zinc/73/44/21/793734421.db2.gz XXOHHHZBHMNSPE-MNOVXSKESA-N 1 2 302.777 2.315 20 10 DECDLO COc1ccc(C[N@@H+]2CC[C@@H](F)[C@@H]([NH3+])CC2)c([O-])c1Cl ZINC001206201587 793734423 /nfs/dbraw/zinc/73/44/23/793734423.db2.gz XXOHHHZBHMNSPE-MNOVXSKESA-N 1 2 302.777 2.315 20 10 DECDLO CCn1ncnc1C[NH2+]Cc1c(O)cccc1Br ZINC001118859535 795233964 /nfs/dbraw/zinc/23/39/64/795233964.db2.gz JWSXJLICHHJMFV-UHFFFAOYSA-N 1 2 311.183 2.056 20 10 DECDLO CCn1ncc2c1[C@H](COC)C[N@H+](Cc1c(O)cccc1F)C2 ZINC001137834447 796144176 /nfs/dbraw/zinc/14/41/76/796144176.db2.gz HFIZPYWFWHFSKE-ZDUSSCGKSA-N 1 2 319.380 2.494 20 10 DECDLO CCn1ncc2c1[C@H](COC)C[N@@H+](Cc1c(O)cccc1F)C2 ZINC001137834447 796144179 /nfs/dbraw/zinc/14/41/79/796144179.db2.gz HFIZPYWFWHFSKE-ZDUSSCGKSA-N 1 2 319.380 2.494 20 10 DECDLO Oc1c(F)cccc1CN1CC[NH+](CCc2ccncc2)CC1 ZINC001138127464 796167092 /nfs/dbraw/zinc/16/70/92/796167092.db2.gz DDLAKGKGYSDYTD-UHFFFAOYSA-N 1 2 315.392 2.287 20 10 DECDLO Oc1c(F)cccc1C[NH+]1CCN(CCc2ccncc2)CC1 ZINC001138127464 796167096 /nfs/dbraw/zinc/16/70/96/796167096.db2.gz DDLAKGKGYSDYTD-UHFFFAOYSA-N 1 2 315.392 2.287 20 10 DECDLO CCn1cc2c(n1)C[N@@H+](Cc1cccc(F)c1O)C[C@H]2COC ZINC001138125469 796167323 /nfs/dbraw/zinc/16/73/23/796167323.db2.gz QATJFIWMMYYKMW-ZDUSSCGKSA-N 1 2 319.380 2.494 20 10 DECDLO CCn1cc2c(n1)C[N@H+](Cc1cccc(F)c1O)C[C@H]2COC ZINC001138125469 796167326 /nfs/dbraw/zinc/16/73/26/796167326.db2.gz QATJFIWMMYYKMW-ZDUSSCGKSA-N 1 2 319.380 2.494 20 10 DECDLO CCOC(=O)CC[N@H+](C)Cc1c(O)ccc2c(C)cc(=O)oc21 ZINC001139127036 796327116 /nfs/dbraw/zinc/32/71/16/796327116.db2.gz CCZAWGDMTBUDKZ-UHFFFAOYSA-N 1 2 319.357 2.192 20 10 DECDLO CCOC(=O)CC[N@@H+](C)Cc1c(O)ccc2c(C)cc(=O)oc21 ZINC001139127036 796327119 /nfs/dbraw/zinc/32/71/19/796327119.db2.gz CCZAWGDMTBUDKZ-UHFFFAOYSA-N 1 2 319.357 2.192 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CCC[C@@H](CO)CC1 ZINC001139126728 796327675 /nfs/dbraw/zinc/32/76/75/796327675.db2.gz OJWDABGHFYYYSR-CYBMUJFWSA-N 1 2 317.385 2.401 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CCC[C@@H](CO)CC1 ZINC001139126728 796327679 /nfs/dbraw/zinc/32/76/79/796327679.db2.gz OJWDABGHFYYYSR-CYBMUJFWSA-N 1 2 317.385 2.401 20 10 DECDLO CC1(C)CN(C2C[NH+](Cc3ccc(Cl)cc3O)C2)CCO1 ZINC001140465947 796525576 /nfs/dbraw/zinc/52/55/76/796525576.db2.gz UZNXVDGRPUAAPD-UHFFFAOYSA-N 1 2 310.825 2.341 20 10 DECDLO OC[C@H]1CCn2nccc2C[N@@H+]1Cc1ccc(Cl)cc1O ZINC001140464108 796525698 /nfs/dbraw/zinc/52/56/98/796525698.db2.gz BRWXNVGSXUWSJI-CQSZACIVSA-N 1 2 307.781 2.009 20 10 DECDLO OC[C@H]1CCn2nccc2C[N@H+]1Cc1ccc(Cl)cc1O ZINC001140464108 796525703 /nfs/dbraw/zinc/52/57/03/796525703.db2.gz BRWXNVGSXUWSJI-CQSZACIVSA-N 1 2 307.781 2.009 20 10 DECDLO Cc1c(O)ccc(C[N@@H+]2CCN(c3ccccc3)C(=O)C2)c1O ZINC001140746107 796566648 /nfs/dbraw/zinc/56/66/48/796566648.db2.gz VDLQOBBEPHNVGB-UHFFFAOYSA-N 1 2 312.369 2.255 20 10 DECDLO Cc1c(O)ccc(C[N@H+]2CCN(c3ccccc3)C(=O)C2)c1O ZINC001140746107 796566652 /nfs/dbraw/zinc/56/66/52/796566652.db2.gz VDLQOBBEPHNVGB-UHFFFAOYSA-N 1 2 312.369 2.255 20 10 DECDLO CC(C)(C)OC(=O)N1CC[N@H+](Cc2cc(O)ccc2O)[C@H]2C[C@H]21 ZINC001141158077 796641796 /nfs/dbraw/zinc/64/17/96/796641796.db2.gz SLSSOFOCILMWPB-UONOGXRCSA-N 1 2 320.389 2.291 20 10 DECDLO CC(C)(C)OC(=O)N1CC[N@@H+](Cc2cc(O)ccc2O)[C@H]2C[C@H]21 ZINC001141158077 796641803 /nfs/dbraw/zinc/64/18/03/796641803.db2.gz SLSSOFOCILMWPB-UONOGXRCSA-N 1 2 320.389 2.291 20 10 DECDLO O=C(c1ccc(O)c(O)c1Cl)N1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC001193233129 797527744 /nfs/dbraw/zinc/52/77/44/797527744.db2.gz VDOPGMODCZQWNI-SECBINFHSA-N 1 2 321.764 2.494 20 10 DECDLO Cc1nc(-n2cncn2)cc(N(C)Cc2ccc(N(C)C)cc2)[nH+]1 ZINC001156928803 798112074 /nfs/dbraw/zinc/11/20/74/798112074.db2.gz WBGDIIOPBYADTE-UHFFFAOYSA-N 1 2 323.404 2.068 20 10 DECDLO CN(C)c1ccc(C[N@@H+]2CCN(C3CCCC3)C(=O)C2)cc1 ZINC001203934149 798475872 /nfs/dbraw/zinc/47/58/72/798475872.db2.gz OEPUZWZDOUDGEZ-UHFFFAOYSA-N 1 2 301.434 2.339 20 10 DECDLO CN(C)c1ccc(C[N@H+]2CCN(C3CCCC3)C(=O)C2)cc1 ZINC001203934149 798475873 /nfs/dbraw/zinc/47/58/73/798475873.db2.gz OEPUZWZDOUDGEZ-UHFFFAOYSA-N 1 2 301.434 2.339 20 10 DECDLO COc1cccc(C[N@@H+]2CC[C@@](O)(C(F)(F)F)[C@@H](F)C2)c1O ZINC001203589507 800085181 /nfs/dbraw/zinc/08/51/81/800085181.db2.gz JSSWZODEERVHBT-AAEUAGOBSA-N 1 2 323.286 2.238 20 10 DECDLO COc1cccc(C[N@H+]2CC[C@@](O)(C(F)(F)F)[C@@H](F)C2)c1O ZINC001203589507 800085187 /nfs/dbraw/zinc/08/51/87/800085187.db2.gz JSSWZODEERVHBT-AAEUAGOBSA-N 1 2 323.286 2.238 20 10 DECDLO Oc1ccc(CN2CC[C@@H]([NH+]3CCCC3)C(F)(F)C2)c(O)c1 ZINC001204281747 800200696 /nfs/dbraw/zinc/20/06/96/800200696.db2.gz HZHXZXYCNYGFAH-OAHLLOKOSA-N 1 2 312.360 2.403 20 10 DECDLO N[C@@]1(C(F)(F)F)CC[N@H+](Cc2cc(Cl)c(O)cc2O)C1 ZINC001206237520 800494764 /nfs/dbraw/zinc/49/47/64/800494764.db2.gz JCCOVPCBHQZEMM-NSHDSACASA-N 1 2 310.703 2.217 20 10 DECDLO N[C@@]1(C(F)(F)F)CC[N@@H+](Cc2cc(Cl)c(O)cc2O)C1 ZINC001206237520 800494765 /nfs/dbraw/zinc/49/47/65/800494765.db2.gz JCCOVPCBHQZEMM-NSHDSACASA-N 1 2 310.703 2.217 20 10 DECDLO C[N@@H+]1CC[C@@H](Oc2cccc3c2C(=O)c2cccc(O)c2C3=O)C1 ZINC001229187186 801239251 /nfs/dbraw/zinc/23/92/51/801239251.db2.gz WPIXJGJNKKFUFR-LLVKDONJSA-N 1 2 323.348 2.251 20 10 DECDLO C[N@H+]1CC[C@@H](Oc2cccc3c2C(=O)c2cccc(O)c2C3=O)C1 ZINC001229187186 801239256 /nfs/dbraw/zinc/23/92/56/801239256.db2.gz WPIXJGJNKKFUFR-LLVKDONJSA-N 1 2 323.348 2.251 20 10 DECDLO COc1cc(O)c(C[N@H+]2CCN(C(C)=O)[C@H](C)C2)cc1Cl ZINC001232267406 801832897 /nfs/dbraw/zinc/83/28/97/801832897.db2.gz BIXAFEOGHCZRCX-SNVBAGLBSA-N 1 2 312.797 2.107 20 10 DECDLO Cc1cncnc1O[C@H]1CC[N@H+](Cc2ccc(F)c(F)c2O)C1 ZINC001233079684 802022556 /nfs/dbraw/zinc/02/25/56/802022556.db2.gz KDJSAVZNZZLMAD-LBPRGKRZSA-N 1 2 321.327 2.422 20 10 DECDLO Cc1nccnc1O[C@@H]1CC[N@H+](Cc2ccc(F)c(F)c2O)C1 ZINC001233079907 802023188 /nfs/dbraw/zinc/02/31/88/802023188.db2.gz NEQMHFUBZLUMFZ-GFCCVEGCSA-N 1 2 321.327 2.422 20 10 DECDLO CC[C@@H]([NH2+]CCC[C@H](C)CO)c1cccc(-c2nn[nH]n2)c1O ZINC001604056594 1070190932 /nfs/dbraw/zinc/19/09/32/1070190932.db2.gz VCQNXUCEMMUBQM-SMDDNHRTSA-N 1 2 319.409 2.022 20 10 DECDLO CC[C@H]([NH2+]C[C@@H]1CC[C@H](C)O1)c1cccc(-c2nn[nH]n2)c1O ZINC001604056493 1070190965 /nfs/dbraw/zinc/19/09/65/1070190965.db2.gz ULWQBYFWZHOBCB-MJVIPROJSA-N 1 2 317.393 2.181 20 10 DECDLO Cc1nnc([C@@H]2CCC[N@H+](Cc3cc(F)c(F)cc3O)C2)[nH]1 ZINC001474432700 1060868332 /nfs/dbraw/zinc/86/83/32/1060868332.db2.gz KLKZBNGFFCNAJQ-SNVBAGLBSA-N 1 2 308.332 2.477 20 10 DECDLO Cc1nnc([C@@H]2CCC[N@@H+](Cc3cc(F)c(F)cc3O)C2)[nH]1 ZINC001474432700 1060868349 /nfs/dbraw/zinc/86/83/49/1060868349.db2.gz KLKZBNGFFCNAJQ-SNVBAGLBSA-N 1 2 308.332 2.477 20 10 DECDLO Cc1n[nH]c([C@@H]2CCC[N@H+](Cc3cc(F)c(F)cc3O)C2)n1 ZINC001474432700 1060868361 /nfs/dbraw/zinc/86/83/61/1060868361.db2.gz KLKZBNGFFCNAJQ-SNVBAGLBSA-N 1 2 308.332 2.477 20 10 DECDLO Cc1n[nH]c([C@@H]2CCC[N@@H+](Cc3cc(F)c(F)cc3O)C2)n1 ZINC001474432700 1060868376 /nfs/dbraw/zinc/86/83/76/1060868376.db2.gz KLKZBNGFFCNAJQ-SNVBAGLBSA-N 1 2 308.332 2.477 20 10 DECDLO [NH3+][C@H]1CCc2ncc(NCc3cc([N+](=O)[O-])ccc3O)cc2C1 ZINC001580208575 1067525838 /nfs/dbraw/zinc/52/58/38/1067525838.db2.gz UMNGUWIADVESMA-LBPRGKRZSA-N 1 2 314.345 2.124 20 10 DECDLO CCCOC(=O)[C@@H](C)[N@H+](C)CCN(C)c1ccc(OC)cc1 ZINC001646718899 1074575028 /nfs/dbraw/zinc/57/50/28/1074575028.db2.gz JUSUPXQGDUKOSW-CQSZACIVSA-N 1 2 308.422 2.405 20 10 DECDLO CCCOC(=O)[C@@H](C)[N@@H+](C)CCN(C)c1ccc(OC)cc1 ZINC001646718899 1074575031 /nfs/dbraw/zinc/57/50/31/1074575031.db2.gz JUSUPXQGDUKOSW-CQSZACIVSA-N 1 2 308.422 2.405 20 10 DECDLO COC1(OC)CCOC[C@H]1[NH2+]Cc1cc(Cl)cc(F)c1O ZINC001560574538 1075142334 /nfs/dbraw/zinc/14/23/34/1075142334.db2.gz VAPAATLAEYJBAY-GFCCVEGCSA-N 1 2 319.760 2.052 20 10 DECDLO C[C@@H]1OCC[C@@]12C[N@H+](Cc1cc(F)c(F)cc1O)C[C@@H](C)O2 ZINC001560803655 1075145976 /nfs/dbraw/zinc/14/59/76/1075145976.db2.gz CDCADHYADBIEQO-OHUAYANFSA-N 1 2 313.344 2.439 20 10 DECDLO C[C@@H]1OCC[C@@]12C[N@@H+](Cc1cc(F)c(F)cc1O)C[C@@H](C)O2 ZINC001560803655 1075145977 /nfs/dbraw/zinc/14/59/77/1075145977.db2.gz CDCADHYADBIEQO-OHUAYANFSA-N 1 2 313.344 2.439 20 10 DECDLO O=C(NCc1cccc(Cl)c1O)[C@H]1[NH2+]CCc2occc21 ZINC001580718751 1075982190 /nfs/dbraw/zinc/98/21/90/1075982190.db2.gz OZGPKGVKIVSAOJ-ZDUSSCGKSA-N 1 2 306.749 2.142 20 10 DECDLO C[C@H]([NH2+][C@H]1CCOC(C)(C)C1)c1cccc(-c2nn[nH]n2)c1O ZINC001589952828 1076534900 /nfs/dbraw/zinc/53/49/00/1076534900.db2.gz DGQYSVMIAYCJGJ-QWRGUYRKSA-N 1 2 317.393 2.181 20 10 DECDLO CC[C@H](C)[C@@H](C[NH2+][C@H](C)c1cccc(-c2nn[nH]n2)c1O)OC ZINC001590401741 1076621714 /nfs/dbraw/zinc/62/17/14/1076621714.db2.gz XAAGWLUGFVXTKC-MISXGVKJSA-N 1 2 319.409 2.284 20 10 DECDLO CO[C@@H]([C@H](C)[NH2+][C@H](C)c1cccc(-c2nn[nH]n2)c1O)C1CC1 ZINC001591326443 1076723128 /nfs/dbraw/zinc/72/31/28/1076723128.db2.gz LDRNMYAHHDIMKV-FTGAXOIBSA-N 1 2 317.393 2.036 20 10 DECDLO Oc1cc(Cl)ccc1C[NH2+]Cc1nc([C@H]2CCCO2)n[nH]1 ZINC001659541627 1080243075 /nfs/dbraw/zinc/24/30/75/1080243075.db2.gz AVEBYIFPXLLWOJ-GFCCVEGCSA-N 1 2 308.769 2.305 20 10 DECDLO CN(C)c1ccc(C[NH2+][C@H](C(N)=O)c2ccc(F)cc2)cc1F ZINC001662156965 1080575055 /nfs/dbraw/zinc/57/50/55/1080575055.db2.gz UNJJLLJNERWDSF-INIZCTEOSA-N 1 2 319.355 2.347 20 10 DECDLO OC[C@H]1CCC[N@@H+]1Cc1cc(F)cc(Br)c1O ZINC001235295798 1084377140 /nfs/dbraw/zinc/37/71/40/1084377140.db2.gz FUHDFYRFMTZWQO-SNVBAGLBSA-N 1 2 304.159 2.251 20 10 DECDLO OC[C@H]1CCC[N@H+]1Cc1cc(F)cc(Br)c1O ZINC001235295798 1084377151 /nfs/dbraw/zinc/37/71/51/1084377151.db2.gz FUHDFYRFMTZWQO-SNVBAGLBSA-N 1 2 304.159 2.251 20 10 DECDLO Cc1c(C[N@@H+]2CCn3cnc(CO)c3C2)c2ccccc2n1C ZINC001235503605 1084448933 /nfs/dbraw/zinc/44/89/33/1084448933.db2.gz NWKJULQYKMNNPW-UHFFFAOYSA-N 1 2 310.401 2.191 20 10 DECDLO Cc1c(C[N@H+]2CCn3cnc(CO)c3C2)c2ccccc2n1C ZINC001235503605 1084448935 /nfs/dbraw/zinc/44/89/35/1084448935.db2.gz NWKJULQYKMNNPW-UHFFFAOYSA-N 1 2 310.401 2.191 20 10 DECDLO Cc1nnc([C@@H](C)[NH2+]Cc2ccc(Br)cc2O)[nH]1 ZINC000700974748 1086345257 /nfs/dbraw/zinc/34/52/57/1086345257.db2.gz MQIVPHTUFAPBTM-SSDOTTSWSA-N 1 2 311.183 2.432 20 10 DECDLO COC[C@@H]1C[N@H+](Cc2c(O)cccc2Br)CCO1 ZINC000707144715 1086659407 /nfs/dbraw/zinc/65/94/07/1086659407.db2.gz QSDOJWYPCCKRIU-JTQLQIEISA-N 1 2 316.195 2.002 20 10 DECDLO COC[C@@H]1C[N@@H+](Cc2c(O)cccc2Br)CCO1 ZINC000707144715 1086659422 /nfs/dbraw/zinc/65/94/22/1086659422.db2.gz QSDOJWYPCCKRIU-JTQLQIEISA-N 1 2 316.195 2.002 20 10 DECDLO COc1cc(O)c(C[N@@H+]2CCc3c(cnn3C)C2)c(Cl)c1 ZINC001236809014 1138435425 /nfs/dbraw/zinc/43/54/25/1138435425.db2.gz SIWPIGBFWUFCJI-UHFFFAOYSA-N 1 2 307.781 2.346 20 10 DECDLO COc1cc(O)c(C[N@H+]2CCc3c(cnn3C)C2)c(Cl)c1 ZINC001236809014 1138435434 /nfs/dbraw/zinc/43/54/34/1138435434.db2.gz SIWPIGBFWUFCJI-UHFFFAOYSA-N 1 2 307.781 2.346 20 10 DECDLO CCOC(=O)C1=C(O)CC[N@H+](Cc2ccc(C(C)C)cc2O)C1 ZINC001237044958 1138487470 /nfs/dbraw/zinc/48/74/70/1138487470.db2.gz GEOKOHWFNOAUEY-HNNXBMFYSA-N 1 2 319.401 2.470 20 10 DECDLO CCOC(=O)C1=C(O)CC[N@@H+](Cc2ccc(C(C)C)cc2O)C1 ZINC001237044958 1138487477 /nfs/dbraw/zinc/48/74/77/1138487477.db2.gz GEOKOHWFNOAUEY-HNNXBMFYSA-N 1 2 319.401 2.470 20 10 DECDLO CCOC(=O)[C@H]1C[N@H+](Cc2ccc(C(C)C)cc2O)CCC1=O ZINC001237044958 1138487491 /nfs/dbraw/zinc/48/74/91/1138487491.db2.gz GEOKOHWFNOAUEY-HNNXBMFYSA-N 1 2 319.401 2.470 20 10 DECDLO CCOC(=O)[C@H]1C[N@@H+](Cc2ccc(C(C)C)cc2O)CCC1=O ZINC001237044958 1138487497 /nfs/dbraw/zinc/48/74/97/1138487497.db2.gz GEOKOHWFNOAUEY-HNNXBMFYSA-N 1 2 319.401 2.470 20 10 DECDLO CCOc1ccc(C[NH+]2CC(NC(=O)OC(C)(C)C)C2)c(O)c1 ZINC001237045731 1138487755 /nfs/dbraw/zinc/48/77/55/1138487755.db2.gz SOBXTBFWURODEB-UHFFFAOYSA-N 1 2 322.405 2.500 20 10 DECDLO OC[C@H]1C[C@H](F)C[N@H+](Cc2c(O)cccc2OC(F)(F)F)C1 ZINC001237120581 1138507805 /nfs/dbraw/zinc/50/78/05/1138507805.db2.gz QPDXQRNAHXMRTN-UWVGGRQHSA-N 1 2 323.286 2.443 20 10 DECDLO OC[C@H]1C[C@H](F)C[N@@H+](Cc2c(O)cccc2OC(F)(F)F)C1 ZINC001237120581 1138507809 /nfs/dbraw/zinc/50/78/09/1138507809.db2.gz QPDXQRNAHXMRTN-UWVGGRQHSA-N 1 2 323.286 2.443 20 10 DECDLO CNC(=O)N[C@H]1CCC[N@H+](Cc2cc(Cl)cc(F)c2O)C1 ZINC001237623102 1138721213 /nfs/dbraw/zinc/72/12/13/1138721213.db2.gz HPCDZXKEPROHAT-NSHDSACASA-N 1 2 315.776 2.078 20 10 DECDLO CNC(=O)N[C@H]1CCC[N@@H+](Cc2cc(Cl)cc(F)c2O)C1 ZINC001237623102 1138721217 /nfs/dbraw/zinc/72/12/17/1138721217.db2.gz HPCDZXKEPROHAT-NSHDSACASA-N 1 2 315.776 2.078 20 10 DECDLO Cc1cc(O)c(C[N@@H+]2C[C@@H](F)C[C@H]2CO)cc1Br ZINC001237678172 1138752933 /nfs/dbraw/zinc/75/29/33/1138752933.db2.gz VPZRUPQYJIWRKF-QWRGUYRKSA-N 1 2 318.186 2.368 20 10 DECDLO Cc1cc(O)c(C[N@H+]2C[C@@H](F)C[C@H]2CO)cc1Br ZINC001237678172 1138752952 /nfs/dbraw/zinc/75/29/52/1138752952.db2.gz VPZRUPQYJIWRKF-QWRGUYRKSA-N 1 2 318.186 2.368 20 10 DECDLO CCOC(=O)[C@H]1[C@@H]2C[N@@H+](Cc3cc(F)cc(Cl)c3O)C[C@@H]21 ZINC001237804327 1138794096 /nfs/dbraw/zinc/79/40/96/1138794096.db2.gz CXUOQKIOJHFQLI-PJXYFTJBSA-N 1 2 313.756 2.426 20 10 DECDLO CCOC(=O)[C@H]1[C@@H]2C[N@H+](Cc3cc(F)cc(Cl)c3O)C[C@@H]21 ZINC001237804327 1138794105 /nfs/dbraw/zinc/79/41/05/1138794105.db2.gz CXUOQKIOJHFQLI-PJXYFTJBSA-N 1 2 313.756 2.426 20 10 DECDLO CNc1cc(NCc2ccc(N3CCOCC3)c(F)c2)nc[nH+]1 ZINC001342846068 1143839263 /nfs/dbraw/zinc/83/92/63/1143839263.db2.gz BIMPGLNKRNZBCT-UHFFFAOYSA-N 1 2 317.368 2.106 20 10 DECDLO CNc1cc(NCc2ccc(N3CCOCC3)c(F)c2)[nH+]cn1 ZINC001342846068 1143839264 /nfs/dbraw/zinc/83/92/64/1143839264.db2.gz BIMPGLNKRNZBCT-UHFFFAOYSA-N 1 2 317.368 2.106 20 10 DECDLO COC(=O)[C@H]1C[C@H](OC)CC[N@@H+]1Cc1cccc(Cl)c1O ZINC000376821593 533549383 /nfs/dbraw/zinc/54/93/83/533549383.db2.gz FOJCRFNJDZWFJA-DGCLKSJQSA-N 1 2 313.781 2.198 20 10 DECDLO COC(=O)[C@H]1C[C@H](OC)CC[N@H+]1Cc1cccc(Cl)c1O ZINC000376821593 533549389 /nfs/dbraw/zinc/54/93/89/533549389.db2.gz FOJCRFNJDZWFJA-DGCLKSJQSA-N 1 2 313.781 2.198 20 10 DECDLO C[C@H]([NH2+]C[C@@H]1CCCS(=O)(=O)C1)c1ccc(F)c(F)c1O ZINC000287136610 131266410 /nfs/dbraw/zinc/26/64/10/131266410.db2.gz RYNGQLIKLSPNIK-UWVGGRQHSA-N 1 2 319.373 2.146 20 10 DECDLO CC[C@H]([NH2+][C@@H](C(N)=O)c1ccccn1)c1ccc(N(C)C)cc1 ZINC000297286517 132007497 /nfs/dbraw/zinc/00/74/97/132007497.db2.gz LPDZILGDFGSLIZ-DOTOQJQBSA-N 1 2 312.417 2.415 20 10 DECDLO CCN(CC)c1ccc(C[N@H+](C)CCS(=O)(=O)CC)cc1 ZINC000118532535 401899947 /nfs/dbraw/zinc/89/99/47/401899947.db2.gz NUMLWVGWCSGMAW-UHFFFAOYSA-N 1 2 312.479 2.399 20 10 DECDLO CCN(CC)c1ccc(C[N@@H+](C)CCS(=O)(=O)CC)cc1 ZINC000118532535 401899948 /nfs/dbraw/zinc/89/99/48/401899948.db2.gz NUMLWVGWCSGMAW-UHFFFAOYSA-N 1 2 312.479 2.399 20 10 DECDLO COc1cc(Cl)cc(C[N@@H+]2CC(=O)N[C@@H]3CCCC[C@@H]32)c1O ZINC000184685038 402291618 /nfs/dbraw/zinc/29/16/18/402291618.db2.gz LVCZKIPFIMDPPN-OLZOCXBDSA-N 1 2 324.808 2.297 20 10 DECDLO COc1cc(Cl)cc(C[N@H+]2CC(=O)N[C@@H]3CCCC[C@@H]32)c1O ZINC000184685038 402291620 /nfs/dbraw/zinc/29/16/20/402291620.db2.gz LVCZKIPFIMDPPN-OLZOCXBDSA-N 1 2 324.808 2.297 20 10 DECDLO C[C@@H]([NH2+]CC(F)(F)CO)c1ccc(Br)cc1O ZINC000184713032 402294230 /nfs/dbraw/zinc/29/42/30/402294230.db2.gz LRWYCYDYNGUHSQ-SSDOTTSWSA-N 1 2 310.138 2.433 20 10 DECDLO C[C@H]([NH2+]CCN1CCOCC1(C)C)c1ccc(F)c(F)c1O ZINC000187695881 402508373 /nfs/dbraw/zinc/50/83/73/402508373.db2.gz DXNYISYVHYLDBM-NSHDSACASA-N 1 2 314.376 2.432 20 10 DECDLO CCS(=O)(=O)C1CC[NH+](Cc2c(O)cccc2Cl)CC1 ZINC000278570810 402868548 /nfs/dbraw/zinc/86/85/48/402868548.db2.gz BZJPFXPTZVBKFO-UHFFFAOYSA-N 1 2 317.838 2.445 20 10 DECDLO COc1cc(O)c(C[NH2+][C@@H](C)C(=O)OC2CCCC2)cc1OC ZINC000277833315 403262349 /nfs/dbraw/zinc/26/23/49/403262349.db2.gz ZNMQKHWPSKHZJI-NSHDSACASA-N 1 2 323.389 2.373 20 10 DECDLO CC(C)c1nc(N(C)C)nc(NCCc2ccc(O)c(O)c2)[nH+]1 ZINC000271187512 403275878 /nfs/dbraw/zinc/27/58/78/403275878.db2.gz NLSSNKWCSQVSFS-UHFFFAOYSA-N 1 2 317.393 2.127 20 10 DECDLO CC(C)c1nc(NCCc2ccc(O)c(O)c2)nc(N(C)C)[nH+]1 ZINC000271187512 403275881 /nfs/dbraw/zinc/27/58/81/403275881.db2.gz NLSSNKWCSQVSFS-UHFFFAOYSA-N 1 2 317.393 2.127 20 10 DECDLO O=C(NC1CC1)[C@@H]1CCC[N@H+]1Cc1c(O)ccc(Cl)c1F ZINC000191241116 225107630 /nfs/dbraw/zinc/10/76/30/225107630.db2.gz ZQIMGOUPEHHZHN-LBPRGKRZSA-N 1 2 312.772 2.428 20 10 DECDLO O=C(NC1CC1)[C@@H]1CCC[N@@H+]1Cc1c(O)ccc(Cl)c1F ZINC000191241116 225107631 /nfs/dbraw/zinc/10/76/31/225107631.db2.gz ZQIMGOUPEHHZHN-LBPRGKRZSA-N 1 2 312.772 2.428 20 10 DECDLO CC[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1O)[C@H](O)C(F)(F)F ZINC000270776434 280946418 /nfs/dbraw/zinc/94/64/18/280946418.db2.gz BQSSDUCNYRLWKF-ONGXEEELSA-N 1 2 308.256 2.092 20 10 DECDLO CCOCCN1CC[NH+](C/C=C\c2ccc(N(C)C)cc2)CC1 ZINC000835025616 649867886 /nfs/dbraw/zinc/86/78/86/649867886.db2.gz LLODVQUOGJEODB-WAYWQWQTSA-N 1 2 317.477 2.420 20 10 DECDLO CCN(CC)c1ccc(C[NH+]2CCN(C(C)=O)CC2)cc1F ZINC000157846239 520891940 /nfs/dbraw/zinc/89/19/40/520891940.db2.gz COGWRJDJUHBBCM-UHFFFAOYSA-N 1 2 307.413 2.336 20 10 DECDLO COCc1nc(C[NH2+]Cc2cc([N+](=O)[O-])ccc2O)cs1 ZINC000266186565 523200267 /nfs/dbraw/zinc/20/02/67/523200267.db2.gz HMQHWYZVUHHFCB-UHFFFAOYSA-N 1 2 309.347 2.193 20 10 DECDLO CN(C)c1ccc(/C=C/C[N@@H+]2CCC[C@H](S(C)(=O)=O)C2)cc1 ZINC000835048059 649871160 /nfs/dbraw/zinc/87/11/60/649871160.db2.gz YZCRRQSHAJDIQZ-YXMMZVCTSA-N 1 2 322.474 2.275 20 10 DECDLO CN(C)c1ccc(/C=C/C[N@H+]2CCC[C@H](S(C)(=O)=O)C2)cc1 ZINC000835048059 649871161 /nfs/dbraw/zinc/87/11/61/649871161.db2.gz YZCRRQSHAJDIQZ-YXMMZVCTSA-N 1 2 322.474 2.275 20 10 DECDLO COCCN1CC[N@H+](Cc2cc(C(C)C)c(C)cc2O)CC1=O ZINC000160799485 624081259 /nfs/dbraw/zinc/08/12/59/624081259.db2.gz NQPVIBDMDVMBDN-UHFFFAOYSA-N 1 2 320.433 2.115 20 10 DECDLO COCCN1CC[N@@H+](Cc2cc(C(C)C)c(C)cc2O)CC1=O ZINC000160799485 624081263 /nfs/dbraw/zinc/08/12/63/624081263.db2.gz NQPVIBDMDVMBDN-UHFFFAOYSA-N 1 2 320.433 2.115 20 10 DECDLO COc1ccc(O)c([C@H](C)NC(=O)CCCn2cc[nH+]c2)c1 ZINC000735858660 633545351 /nfs/dbraw/zinc/54/53/51/633545351.db2.gz XLSSMVVAMPIVSD-LBPRGKRZSA-N 1 2 303.362 2.255 20 10 DECDLO CO[C@@H]1CC[C@H]2OCC[N@H+](Cc3cc(F)cc(F)c3O)[C@H]2C1 ZINC000894096760 636113080 /nfs/dbraw/zinc/11/30/80/636113080.db2.gz ZOQYGRIGEWIXQF-VHDGCEQUSA-N 1 2 313.344 2.439 20 10 DECDLO CO[C@@H]1CC[C@H]2OCC[N@@H+](Cc3cc(F)cc(F)c3O)[C@H]2C1 ZINC000894096760 636113083 /nfs/dbraw/zinc/11/30/83/636113083.db2.gz ZOQYGRIGEWIXQF-VHDGCEQUSA-N 1 2 313.344 2.439 20 10 DECDLO C[C@H]1C[N@H+](Cc2cc(Br)cc(F)c2O)CC[C@@H]1O ZINC000894498072 637070332 /nfs/dbraw/zinc/07/03/32/637070332.db2.gz SQHZEXZKZPYROO-UFBFGSQYSA-N 1 2 318.186 2.497 20 10 DECDLO C[C@H]1C[N@@H+](Cc2cc(Br)cc(F)c2O)CC[C@@H]1O ZINC000894498072 637070339 /nfs/dbraw/zinc/07/03/39/637070339.db2.gz SQHZEXZKZPYROO-UFBFGSQYSA-N 1 2 318.186 2.497 20 10 DECDLO C[C@@H]1C[C@H](O)C[N@H+](Cc2cc(Br)cc(F)c2O)C1 ZINC000894951234 637345089 /nfs/dbraw/zinc/34/50/89/637345089.db2.gz ZXVQGQUPHLFATE-KCJUWKMLSA-N 1 2 318.186 2.497 20 10 DECDLO C[C@@H]1C[C@H](O)C[N@@H+](Cc2cc(Br)cc(F)c2O)C1 ZINC000894951234 637345093 /nfs/dbraw/zinc/34/50/93/637345093.db2.gz ZXVQGQUPHLFATE-KCJUWKMLSA-N 1 2 318.186 2.497 20 10 DECDLO Cc1noc(C2C[NH+](Cc3cccc(Br)c3O)C2)n1 ZINC000839130476 637799666 /nfs/dbraw/zinc/79/96/66/637799666.db2.gz DHKBEGVMHLHTAQ-UHFFFAOYSA-N 1 2 324.178 2.446 20 10 DECDLO CC[C@@H](CN1CCOCC1)[NH2+]Cc1cc(Cl)cc(F)c1O ZINC000896619213 638609636 /nfs/dbraw/zinc/60/96/36/638609636.db2.gz FGXYWJVUBDCECZ-ZDUSSCGKSA-N 1 2 316.804 2.385 20 10 DECDLO C[C@@H]([NH2+]CCN1CCO[C@H](C)C1)c1cc(F)cc(F)c1O ZINC000756544438 639671165 /nfs/dbraw/zinc/67/11/65/639671165.db2.gz IKAXNEBHWCNSSW-GHMZBOCLSA-N 1 2 300.349 2.042 20 10 DECDLO C[C@@H](CCS(C)(=O)=O)[NH2+][C@@H](C)c1cc(F)cc(F)c1O ZINC000756657264 639682546 /nfs/dbraw/zinc/68/25/46/639682546.db2.gz CACNKHYCXNNSSW-IUCAKERBSA-N 1 2 307.362 2.144 20 10 DECDLO O=C1NCCC2(C[NH+](Cc3ccc(N4CCCCC4)cc3)C2)O1 ZINC000897752790 640915525 /nfs/dbraw/zinc/91/55/25/640915525.db2.gz SQZGFSOUTMVODL-UHFFFAOYSA-N 1 2 315.417 2.361 20 10 DECDLO C[C@@H]1C[N@H+](Cc2ccc(N3CCOCC3)c(F)c2)[C@@H](C)CO1 ZINC000768537129 641094238 /nfs/dbraw/zinc/09/42/38/641094238.db2.gz NJQFATQLCSGNDR-UONOGXRCSA-N 1 2 308.397 2.272 20 10 DECDLO C[C@@H]1C[N@@H+](Cc2ccc(N3CCOCC3)c(F)c2)[C@@H](C)CO1 ZINC000768537129 641094243 /nfs/dbraw/zinc/09/42/43/641094243.db2.gz NJQFATQLCSGNDR-UONOGXRCSA-N 1 2 308.397 2.272 20 10 DECDLO OCCCC[NH+]1CCN(Cc2cc(Cl)cc(F)c2O)CC1 ZINC000775691119 642080364 /nfs/dbraw/zinc/08/03/64/642080364.db2.gz UVMYEDGTMJXBMY-UHFFFAOYSA-N 1 2 316.804 2.075 20 10 DECDLO CNC(=O)[C@H]1CCC[C@@H]1[NH2+]Cc1cc(Cl)cc(F)c1O ZINC000776252590 642149569 /nfs/dbraw/zinc/14/95/69/642149569.db2.gz MPJIHJLDHQGBJE-JQWIXIFHSA-N 1 2 300.761 2.189 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@@H+](C)[C@@H](C)C(=O)NC(C)(C)C)c1O ZINC000776855998 642213059 /nfs/dbraw/zinc/21/30/59/642213059.db2.gz OHRVCZIAPGHBOF-JTQLQIEISA-N 1 2 324.396 2.469 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@H+](C)[C@@H](C)C(=O)NC(C)(C)C)c1O ZINC000776855998 642213062 /nfs/dbraw/zinc/21/30/62/642213062.db2.gz OHRVCZIAPGHBOF-JTQLQIEISA-N 1 2 324.396 2.469 20 10 DECDLO CNC(=O)C1([NH2+]Cc2cc(Cl)cc(F)c2O)CCCC1 ZINC000779173240 642469093 /nfs/dbraw/zinc/46/90/93/642469093.db2.gz DCCVXVHAFGTVDO-UHFFFAOYSA-N 1 2 300.761 2.333 20 10 DECDLO C[C@@H](C(=O)OCC(=O)c1ccc(O)c(O)c1)[NH+]1CCCCCC1 ZINC000783785465 643053117 /nfs/dbraw/zinc/05/31/17/643053117.db2.gz RGXUWBWAFPVHLQ-LBPRGKRZSA-N 1 2 321.373 2.088 20 10 DECDLO C[C@@H]([NH2+]Cc1nncn1C)c1cccc(C(F)(F)F)c1O ZINC000788526975 643620139 /nfs/dbraw/zinc/62/01/39/643620139.db2.gz QNWCZYNTMOCHBO-MRVPVSSYSA-N 1 2 300.284 2.390 20 10 DECDLO CN(C)c1ccc(C[N@H+](C)CN2C(=O)CC3(CCC3)C2=O)cc1 ZINC000839952296 645477380 /nfs/dbraw/zinc/47/73/80/645477380.db2.gz CUYMONSTJJWIDI-UHFFFAOYSA-N 1 2 315.417 2.071 20 10 DECDLO CN(C)c1ccc(C[N@@H+](C)CN2C(=O)CC3(CCC3)C2=O)cc1 ZINC000839952296 645477384 /nfs/dbraw/zinc/47/73/84/645477384.db2.gz CUYMONSTJJWIDI-UHFFFAOYSA-N 1 2 315.417 2.071 20 10 DECDLO Cc1cc(C(=O)NCc2c[nH+]cn2C)c(C)n1-c1ccccn1 ZINC000811589122 646547578 /nfs/dbraw/zinc/54/75/78/646547578.db2.gz LMNIOYBKQKMZGO-UHFFFAOYSA-N 1 2 309.373 2.153 20 10 DECDLO Oc1c(Cl)cccc1C[NH2+]CCc1nnc2ccccn21 ZINC000158079760 646589847 /nfs/dbraw/zinc/58/98/47/646589847.db2.gz HJKYGBOYSQVWHK-UHFFFAOYSA-N 1 2 302.765 2.421 20 10 DECDLO COC(=O)c1conc1C(C)(C)[NH2+]Cc1cc(F)ccc1O ZINC000822534866 648227227 /nfs/dbraw/zinc/22/72/27/648227227.db2.gz ZJEHHUPKBKHFEL-UHFFFAOYSA-N 1 2 308.309 2.331 20 10 DECDLO CC[C@H](C(=O)N[C@H](C)c1ccccc1O)[N@@H+]1CCO[C@@H](CC)C1 ZINC000827946683 649109341 /nfs/dbraw/zinc/10/93/41/649109341.db2.gz OLOCEEWFLPSXDB-IJEWVQPXSA-N 1 2 320.433 2.459 20 10 DECDLO CC[C@H](C(=O)N[C@H](C)c1ccccc1O)[N@H+]1CCO[C@@H](CC)C1 ZINC000827946683 649109344 /nfs/dbraw/zinc/10/93/44/649109344.db2.gz OLOCEEWFLPSXDB-IJEWVQPXSA-N 1 2 320.433 2.459 20 10 DECDLO COc1c(O)c(C[N@@H+]2C[C@H](C)OCC23CCC3)ccc1[N+](=O)[O-] ZINC000846067393 651306140 /nfs/dbraw/zinc/30/61/40/651306140.db2.gz RHDUJLFAWYKEJE-NSHDSACASA-N 1 2 322.361 2.452 20 10 DECDLO COc1c(O)c(C[N@H+]2C[C@H](C)OCC23CCC3)ccc1[N+](=O)[O-] ZINC000846067393 651306141 /nfs/dbraw/zinc/30/61/41/651306141.db2.gz RHDUJLFAWYKEJE-NSHDSACASA-N 1 2 322.361 2.452 20 10 DECDLO COc1ccc(O)c([C@@H](C)NC(=O)[C@@H](C)Cc2c[nH]c[nH+]2)c1 ZINC000847588794 651404507 /nfs/dbraw/zinc/40/45/07/651404507.db2.gz BZJNTSICOOYVAD-WDEREUQCSA-N 1 2 303.362 2.180 20 10 DECDLO COc1ccc(O)c([C@@H](C)NC(=O)[C@@H](C)Cc2c[nH+]c[nH]2)c1 ZINC000847588794 651404508 /nfs/dbraw/zinc/40/45/08/651404508.db2.gz BZJNTSICOOYVAD-WDEREUQCSA-N 1 2 303.362 2.180 20 10 DECDLO Oc1cccc2c1[C@@H]([NH2+]Cc1nc([C@H]3CCCO3)n[nH]1)CC2 ZINC000848557906 651470671 /nfs/dbraw/zinc/47/06/71/651470671.db2.gz NEXWBYBIMHZLHG-WCQYABFASA-N 1 2 300.362 2.139 20 10 DECDLO O=C(NC[C@@H]1CC[N@@H+]1Cc1ccccc1)C1=CC(=O)CS1 ZINC000856357602 651906384 /nfs/dbraw/zinc/90/63/84/651906384.db2.gz MPCWJXGNOZLURN-ZDUSSCGKSA-N 1 2 302.399 2.458 20 10 DECDLO O=C(NC[C@@H]1CC[N@H+]1Cc1ccccc1)C1=CC(=O)CS1 ZINC000856357602 651906387 /nfs/dbraw/zinc/90/63/87/651906387.db2.gz MPCWJXGNOZLURN-ZDUSSCGKSA-N 1 2 302.399 2.458 20 10 DECDLO COc1ccc(N2CC[C@@H](Nc3[nH+]cnc4c3cnn4C)C2)cc1 ZINC000853759616 652600355 /nfs/dbraw/zinc/60/03/55/652600355.db2.gz XZZUSGUTFZUXBN-GFCCVEGCSA-N 1 2 324.388 2.063 20 10 DECDLO CCC[N@H+](CC(=O)N(C)C)Cc1cc(F)c(N(C)C)cc1F ZINC000862231770 686260703 /nfs/dbraw/zinc/26/07/03/686260703.db2.gz LMTJQDAFZXVEFP-UHFFFAOYSA-N 1 2 313.392 2.331 20 10 DECDLO CCC[N@@H+](CC(=O)N(C)C)Cc1cc(F)c(N(C)C)cc1F ZINC000862231770 686260706 /nfs/dbraw/zinc/26/07/06/686260706.db2.gz LMTJQDAFZXVEFP-UHFFFAOYSA-N 1 2 313.392 2.331 20 10 DECDLO CC(C)CN1CCO[C@@H](C[NH2+]Cc2cc(F)cc(F)c2O)C1 ZINC000882880258 691377845 /nfs/dbraw/zinc/37/78/45/691377845.db2.gz KGWNOMIKDINVPS-AWEZNQCLSA-N 1 2 314.376 2.117 20 10 DECDLO CCOC(=O)[C@H]1CSCC[N@@H+]1Cc1cc(C)c(C)cc1O ZINC000887556385 692399210 /nfs/dbraw/zinc/39/92/10/692399210.db2.gz LCWJHAWILSRUOJ-CQSZACIVSA-N 1 2 309.431 2.490 20 10 DECDLO CCOC(=O)[C@H]1CSCC[N@H+]1Cc1cc(C)c(C)cc1O ZINC000887556385 692399211 /nfs/dbraw/zinc/39/92/11/692399211.db2.gz LCWJHAWILSRUOJ-CQSZACIVSA-N 1 2 309.431 2.490 20 10 DECDLO NC(=O)c1csc(C[NH2+]Cc2ccc(N3CCCC3)cc2)n1 ZINC001346848389 1151027687 /nfs/dbraw/zinc/02/76/87/1151027687.db2.gz YJIRMWHYXWSUIG-UHFFFAOYSA-N 1 2 316.430 2.132 20 10 DECDLO COc1cc(Cl)cc(CN2CC[NH2+]CC(F)(F)C2)c1O ZINC001211345628 777037107 /nfs/dbraw/zinc/03/71/07/777037107.db2.gz BRDZRWTYTXDOKF-UHFFFAOYSA-N 1 2 306.740 2.095 20 10 DECDLO Cc1c(O)ccc(CN2CC([NH+]3CCC(F)(F)CC3)C2)c1O ZINC001140747434 777740877 /nfs/dbraw/zinc/74/08/77/777740877.db2.gz CSYAGPIZBCDBOX-UHFFFAOYSA-N 1 2 312.360 2.322 20 10 DECDLO Cc1nc([C@@H]2CCCC[N@@H+]2Cc2c(O)cc(O)cc2O)no1 ZINC001144509326 790940073 /nfs/dbraw/zinc/94/00/73/790940073.db2.gz SQQONDMWUYNDQC-LBPRGKRZSA-N 1 2 305.334 2.222 20 10 DECDLO Cc1nc([C@@H]2CCCC[N@H+]2Cc2c(O)cc(O)cc2O)no1 ZINC001144509326 790940080 /nfs/dbraw/zinc/94/00/80/790940080.db2.gz SQQONDMWUYNDQC-LBPRGKRZSA-N 1 2 305.334 2.222 20 10 DECDLO CCOC(=O)[C@H]1C[N@H+](Cc2ccc(N3CCCC3)cc2)CCO1 ZINC001119959430 795379456 /nfs/dbraw/zinc/37/94/56/795379456.db2.gz KYFJGEBIBCRLGM-QGZVFWFLSA-N 1 2 318.417 2.051 20 10 DECDLO CCOC(=O)[C@H]1C[N@@H+](Cc2ccc(N3CCCC3)cc2)CCO1 ZINC001119959430 795379470 /nfs/dbraw/zinc/37/94/70/795379470.db2.gz KYFJGEBIBCRLGM-QGZVFWFLSA-N 1 2 318.417 2.051 20 10 DECDLO O=C(CCc1ccc(O)c(O)c1)N1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC001182155259 795614486 /nfs/dbraw/zinc/61/44/86/795614486.db2.gz UPFGRDFSUVNSFK-CYBMUJFWSA-N 1 2 315.373 2.160 20 10 DECDLO NC(=O)c1cccc2c1CC[N@H+](Cc1cc(F)c(F)cc1O)C2 ZINC001183064982 795800671 /nfs/dbraw/zinc/80/06/71/795800671.db2.gz BYYRCSHVDHIRRC-UHFFFAOYSA-N 1 2 318.323 2.328 20 10 DECDLO NC(=O)c1cccc2c1CC[N@@H+](Cc1cc(F)c(F)cc1O)C2 ZINC001183064982 795800678 /nfs/dbraw/zinc/80/06/78/795800678.db2.gz BYYRCSHVDHIRRC-UHFFFAOYSA-N 1 2 318.323 2.328 20 10 DECDLO CCOC[C@H]1C[N@H+](Cc2cccc(F)c2O)Cc2cn(C)nc21 ZINC001138125734 796168059 /nfs/dbraw/zinc/16/80/59/796168059.db2.gz WUURIIZUEIJZDJ-CQSZACIVSA-N 1 2 319.380 2.401 20 10 DECDLO CCOC[C@H]1C[N@@H+](Cc2cccc(F)c2O)Cc2cn(C)nc21 ZINC001138125734 796168062 /nfs/dbraw/zinc/16/80/62/796168062.db2.gz WUURIIZUEIJZDJ-CQSZACIVSA-N 1 2 319.380 2.401 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+](C)[C@H]1CCCOC1 ZINC001139129910 796329806 /nfs/dbraw/zinc/32/98/06/796329806.db2.gz KBEZANIDOUFFFW-LBPRGKRZSA-N 1 2 303.358 2.418 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+](C)[C@H]1CCCOC1 ZINC001139129910 796329807 /nfs/dbraw/zinc/32/98/07/796329807.db2.gz KBEZANIDOUFFFW-LBPRGKRZSA-N 1 2 303.358 2.418 20 10 DECDLO CCOCc1ncn2c1C[N@H+](Cc1ccc(OC)cc1O)CC2 ZINC001203630798 796346406 /nfs/dbraw/zinc/34/64/06/796346406.db2.gz VUJBYKKHZHZFNE-UHFFFAOYSA-N 1 2 317.389 2.150 20 10 DECDLO CCOCc1ncn2c1C[N@@H+](Cc1ccc(OC)cc1O)CC2 ZINC001203630798 796346409 /nfs/dbraw/zinc/34/64/09/796346409.db2.gz VUJBYKKHZHZFNE-UHFFFAOYSA-N 1 2 317.389 2.150 20 10 DECDLO Cc1ccc(O)c(C[N@@H+]2CCN(C(=O)OC(C)(C)C)C(=O)C2)c1 ZINC001140622757 796547054 /nfs/dbraw/zinc/54/70/54/796547054.db2.gz FZNDPFDLQPQARB-UHFFFAOYSA-N 1 2 320.389 2.280 20 10 DECDLO Cc1ccc(O)c(C[N@H+]2CCN(C(=O)OC(C)(C)C)C(=O)C2)c1 ZINC001140622757 796547056 /nfs/dbraw/zinc/54/70/56/796547056.db2.gz FZNDPFDLQPQARB-UHFFFAOYSA-N 1 2 320.389 2.280 20 10 DECDLO COc1cc(O)c(C[N@@H+]2CCC[C@H]2c2nc(C)no2)c(OC)c1 ZINC001141029341 796621461 /nfs/dbraw/zinc/62/14/61/796621461.db2.gz QHVFRTVRAVRWRI-ZDUSSCGKSA-N 1 2 319.361 2.438 20 10 DECDLO COc1cc(O)c(C[N@H+]2CCC[C@H]2c2nc(C)no2)c(OC)c1 ZINC001141029341 796621464 /nfs/dbraw/zinc/62/14/64/796621464.db2.gz QHVFRTVRAVRWRI-ZDUSSCGKSA-N 1 2 319.361 2.438 20 10 DECDLO C[C@H]1C(=O)N(C)CC[N@H+]1Cc1cc2c3c(c1)CCCN3CCC2 ZINC001141077834 796632625 /nfs/dbraw/zinc/63/26/25/796632625.db2.gz BRBZCOGBAHMWIL-AWEZNQCLSA-N 1 2 313.445 2.048 20 10 DECDLO C[C@H]1C(=O)N(C)CC[N@@H+]1Cc1cc2c3c(c1)CCCN3CCC2 ZINC001141077834 796632629 /nfs/dbraw/zinc/63/26/29/796632629.db2.gz BRBZCOGBAHMWIL-AWEZNQCLSA-N 1 2 313.445 2.048 20 10 DECDLO Oc1ccc(O)c(CN2CCC[N@H+](Cc3ccncc3)CC2)c1 ZINC001141156692 796642534 /nfs/dbraw/zinc/64/25/34/796642534.db2.gz QTXWVQJCISNDAP-UHFFFAOYSA-N 1 2 313.401 2.201 20 10 DECDLO Oc1ccc(O)c(CN2CCC[N@@H+](Cc3ccncc3)CC2)c1 ZINC001141156692 796642535 /nfs/dbraw/zinc/64/25/35/796642535.db2.gz QTXWVQJCISNDAP-UHFFFAOYSA-N 1 2 313.401 2.201 20 10 DECDLO CCOC(=O)[C@H]1C[N@H+](Cc2cc(F)c(F)cc2O)CCS1 ZINC001142530988 796748004 /nfs/dbraw/zinc/74/80/04/796748004.db2.gz NINNBJIAFUANAM-CYBMUJFWSA-N 1 2 317.357 2.151 20 10 DECDLO CCOC(=O)[C@H]1C[N@@H+](Cc2cc(F)c(F)cc2O)CCS1 ZINC001142530988 796748007 /nfs/dbraw/zinc/74/80/07/796748007.db2.gz NINNBJIAFUANAM-CYBMUJFWSA-N 1 2 317.357 2.151 20 10 DECDLO Cc1cc(C)c(CNc2cc(N3CCOCC3)nc[nH+]2)c(O)c1 ZINC001160808634 798743832 /nfs/dbraw/zinc/74/38/32/798743832.db2.gz WETVVKQXUONTKE-UHFFFAOYSA-N 1 2 314.389 2.248 20 10 DECDLO Cc1cc(C)c(CNc2cc(N3CCOCC3)[nH+]cn2)c(O)c1 ZINC001160808634 798743836 /nfs/dbraw/zinc/74/38/36/798743836.db2.gz WETVVKQXUONTKE-UHFFFAOYSA-N 1 2 314.389 2.248 20 10 DECDLO COC(=O)[C@H]1[C@@H]2CC[C@@H](C2)[N@@H+]1Cc1ccc(N(C)C)cc1OC ZINC001231857142 801738955 /nfs/dbraw/zinc/73/89/55/801738955.db2.gz WOVUIRJEKNGWPM-ISTRZQFTSA-N 1 2 318.417 2.287 20 10 DECDLO COC(=O)[C@H]1[C@@H]2CC[C@@H](C2)[N@H+]1Cc1ccc(N(C)C)cc1OC ZINC001231857142 801738960 /nfs/dbraw/zinc/73/89/60/801738960.db2.gz WOVUIRJEKNGWPM-ISTRZQFTSA-N 1 2 318.417 2.287 20 10 DECDLO COc1ccc(C[N@H+](C)Cc2cc(O)c(O)c(O)c2)c(OC)c1 ZINC001233016665 802004935 /nfs/dbraw/zinc/00/49/35/802004935.db2.gz IWXCELORQNZQPV-UHFFFAOYSA-N 1 2 319.357 2.453 20 10 DECDLO COc1ccc(C[N@@H+](C)Cc2cc(O)c(O)c(O)c2)c(OC)c1 ZINC001233016665 802004945 /nfs/dbraw/zinc/00/49/45/802004945.db2.gz IWXCELORQNZQPV-UHFFFAOYSA-N 1 2 319.357 2.453 20 10 DECDLO COc1cc(Cl)cc(C[N@@H+]2CC[C@@](C)(O)[C@@H](F)C2)c1O ZINC001233287883 802065175 /nfs/dbraw/zinc/06/51/75/802065175.db2.gz LEYXYJXWOIGEJH-GXTWGEPZSA-N 1 2 303.761 2.349 20 10 DECDLO COc1cc(Cl)cc(C[N@H+]2CC[C@@](C)(O)[C@@H](F)C2)c1O ZINC001233287883 802065180 /nfs/dbraw/zinc/06/51/80/802065180.db2.gz LEYXYJXWOIGEJH-GXTWGEPZSA-N 1 2 303.761 2.349 20 10 DECDLO COc1ccc2ccc(O)c(C[NH+]3CC(OC(C)=O)C3)c2c1 ZINC001234552698 802412803 /nfs/dbraw/zinc/41/28/03/802412803.db2.gz FWHXBZNAFGMVSB-UHFFFAOYSA-N 1 2 301.342 2.301 20 10 DECDLO CC[C@H]([NH2+][C@H](C)c1cccc(-c2nn[nH]n2)c1O)[C@H]1CCCO1 ZINC001604055489 1070188583 /nfs/dbraw/zinc/18/85/83/1070188583.db2.gz PRDJHRHGFNRPBZ-DDTOSNHZSA-N 1 2 317.393 2.181 20 10 DECDLO CC[C@H]([NH2+]C[C@@H]1CCCOC1)c1cccc(-c2nn[nH]n2)c1O ZINC001604056251 1070189463 /nfs/dbraw/zinc/18/94/63/1070189463.db2.gz RLNSFKDYIUOPDM-FZMZJTMJSA-N 1 2 317.393 2.040 20 10 DECDLO C[C@@H]([NH2+]C[C@H]([NH3+])c1ccccc1)c1cc(C(=O)[O-])ccc1O ZINC001604332144 1070332413 /nfs/dbraw/zinc/33/24/13/1070332413.db2.gz IDVWYCUKXDOQPR-ABAIWWIYSA-N 1 2 300.358 2.441 20 10 DECDLO CCCOc1ccc(C[NH2+]Cc2nc(N(C)C)n[nH]2)cc1C ZINC001461837432 1058724769 /nfs/dbraw/zinc/72/47/69/1058724769.db2.gz IFBIWVSBFVZIDR-UHFFFAOYSA-N 1 2 303.410 2.258 20 10 DECDLO CCOC(=O)C[N@H+](CCOCC1CC1)Cc1ccccc1O ZINC001646326513 1074415952 /nfs/dbraw/zinc/41/59/52/1074415952.db2.gz OEIDBVWQFNDORU-UHFFFAOYSA-N 1 2 307.390 2.184 20 10 DECDLO CCOC(=O)C[N@@H+](CCOCC1CC1)Cc1ccccc1O ZINC001646326513 1074415955 /nfs/dbraw/zinc/41/59/55/1074415955.db2.gz OEIDBVWQFNDORU-UHFFFAOYSA-N 1 2 307.390 2.184 20 10 DECDLO C[C@H](Cc1ccccn1)[NH2+][C@H](C)c1cccc(-c2nn[nH]n2)c1O ZINC001589901505 1076526557 /nfs/dbraw/zinc/52/65/57/1076526557.db2.gz POUXEPNGJYFVJN-VXGBXAGGSA-N 1 2 324.388 2.249 20 10 DECDLO C[C@H]([NH2+]CC1SCCS1)c1cccc(-c2nn[nH]n2)c1O ZINC001589963247 1076537972 /nfs/dbraw/zinc/53/79/72/1076537972.db2.gz KRBIXCZTIUWURP-QMMMGPOBSA-N 1 2 323.447 2.029 20 10 DECDLO C[C@@H]([NH2+]CC[C@@H]1CCCCO1)c1cccc(-c2nn[nH]n2)c1O ZINC001589963758 1076538681 /nfs/dbraw/zinc/53/86/81/1076538681.db2.gz YDPZHFILSQUEQW-NEPJUHHUSA-N 1 2 317.393 2.182 20 10 DECDLO CC[C@@H]([NH2+]C[C@@](C)(O)C(C)C)c1cccc(-c2nn[nH]n2)c1O ZINC001590464002 1076632446 /nfs/dbraw/zinc/63/24/46/1076632446.db2.gz NYPGMUQASWYINE-CZUORRHYSA-N 1 2 319.409 2.020 20 10 DECDLO CC[C@H]([NH2+]C[C@H]1CCCCO1)c1cccc(-c2nn[nH]n2)c1O ZINC001590468135 1076633964 /nfs/dbraw/zinc/63/39/64/1076633964.db2.gz SRLHMXFFQGYTOY-RISCZKNCSA-N 1 2 317.393 2.182 20 10 DECDLO CCS(=O)(=O)C[C@H](C)[NH2+]Cc1cc(Cl)cc(F)c1O ZINC001657210322 1080164467 /nfs/dbraw/zinc/16/44/67/1080164467.db2.gz BDPMEMUWUANSGS-QMMMGPOBSA-N 1 2 309.790 2.098 20 10 DECDLO COC[C@@]1(C(=O)OC)CCC[N@@H+]1Cc1ccc(Cl)cc1O ZINC001658644577 1080212993 /nfs/dbraw/zinc/21/29/93/1080212993.db2.gz AIVNRYMAENYVOO-OAHLLOKOSA-N 1 2 313.781 2.200 20 10 DECDLO CCOC(=O)[C@H](F)C1C[NH+](Cc2ccc(Cl)cc2O)C1 ZINC001664843435 1080970678 /nfs/dbraw/zinc/97/06/78/1080970678.db2.gz OVICSPQPHXRWGA-CYBMUJFWSA-N 1 2 301.745 2.379 20 10 DECDLO C[C@@]1(O)CC[N@H+](Cc2cc(F)cc(Br)c2O)C1 ZINC001235298377 1084376669 /nfs/dbraw/zinc/37/66/69/1084376669.db2.gz RXMKRXGFKATOLB-GFCCVEGCSA-N 1 2 304.159 2.251 20 10 DECDLO C[C@@]1(O)CC[N@@H+](Cc2cc(F)cc(Br)c2O)C1 ZINC001235298377 1084376679 /nfs/dbraw/zinc/37/66/79/1084376679.db2.gz RXMKRXGFKATOLB-GFCCVEGCSA-N 1 2 304.159 2.251 20 10 DECDLO CC(=O)N[C@@H]1CC[N@@H+](Cc2cc(Cl)c(Cl)cc2O)C1 ZINC001236798652 1138431825 /nfs/dbraw/zinc/43/18/25/1138431825.db2.gz JHEKOBIDKYSPFJ-SNVBAGLBSA-N 1 2 303.189 2.409 20 10 DECDLO CC(=O)N[C@@H]1CC[N@H+](Cc2cc(Cl)c(Cl)cc2O)C1 ZINC001236798652 1138431824 /nfs/dbraw/zinc/43/18/24/1138431824.db2.gz JHEKOBIDKYSPFJ-SNVBAGLBSA-N 1 2 303.189 2.409 20 10 DECDLO COc1cc(O)c(C[N@@H+]2CCN(C(C)=O)C[C@@H]2C)c(Cl)c1 ZINC001236807035 1138432483 /nfs/dbraw/zinc/43/24/83/1138432483.db2.gz DGJMDSGBPWENEZ-JTQLQIEISA-N 1 2 312.797 2.107 20 10 DECDLO COc1cc(O)c(C[N@H+]2CCN(C(C)=O)C[C@@H]2C)c(Cl)c1 ZINC001236807035 1138432500 /nfs/dbraw/zinc/43/25/00/1138432500.db2.gz DGJMDSGBPWENEZ-JTQLQIEISA-N 1 2 312.797 2.107 20 10 DECDLO C[C@]1(CO)CC[N@H+](Cc2c(O)ccc(Cl)c2Cl)C[C@H]1O ZINC001237077010 1138498322 /nfs/dbraw/zinc/49/83/22/1138498322.db2.gz BMGFWMSEZDTXBI-TZMCWYRMSA-N 1 2 320.216 2.264 20 10 DECDLO C[C@]1(CO)CC[N@@H+](Cc2c(O)ccc(Cl)c2Cl)C[C@H]1O ZINC001237077010 1138498332 /nfs/dbraw/zinc/49/83/32/1138498332.db2.gz BMGFWMSEZDTXBI-TZMCWYRMSA-N 1 2 320.216 2.264 20 10 DECDLO CC(C)(C)[N@@H+](Cc1cc(F)cc(Cl)c1O)C[C@@H](O)CO ZINC001237808970 1138798615 /nfs/dbraw/zinc/79/86/15/1138798615.db2.gz XHRJOBADNVJDSE-LLVKDONJSA-N 1 2 305.777 2.138 20 10 DECDLO CC(C)(C)[N@H+](Cc1cc(F)cc(Cl)c1O)C[C@@H](O)CO ZINC001237808970 1138798624 /nfs/dbraw/zinc/79/86/24/1138798624.db2.gz XHRJOBADNVJDSE-LLVKDONJSA-N 1 2 305.777 2.138 20 10 DECDLO O=C1NC[C@@]2(CCC[N@@H+](Cc3cc(F)c(Cl)cc3O)C2)O1 ZINC001237950705 1138812296 /nfs/dbraw/zinc/81/22/96/1138812296.db2.gz ZFUIYDARUQFDKY-CQSZACIVSA-N 1 2 314.744 2.259 20 10 DECDLO O=C1NC[C@@]2(CCC[N@H+](Cc3cc(F)c(Cl)cc3O)C2)O1 ZINC001237950705 1138812298 /nfs/dbraw/zinc/81/22/98/1138812298.db2.gz ZFUIYDARUQFDKY-CQSZACIVSA-N 1 2 314.744 2.259 20 10 DECDLO C[C@H]1CCN(C(=O)NCc2ccc(N)cc2)C[C@H]1n1cc[nH+]c1 ZINC001262603729 1144322692 /nfs/dbraw/zinc/32/26/92/1144322692.db2.gz SVYQJVRIVDYYAW-XJKSGUPXSA-N 1 2 313.405 2.258 20 10 DECDLO CC(C)N1CC[C@H]([NH2+]Cc2cc(Cl)cc(F)c2O)C1=O ZINC001308272492 1147462614 /nfs/dbraw/zinc/46/26/14/1147462614.db2.gz BQUZZSWKHQCYQH-LBPRGKRZSA-N 1 2 300.761 2.284 20 10 DECDLO C[C@H]1CC(=O)NCC[N@@H+]1Cc1cc(Cl)cc(Cl)c1O ZINC000377827060 290324937 /nfs/dbraw/zinc/32/49/37/290324937.db2.gz SKYWUNIWYWUDFX-QMMMGPOBSA-N 1 2 303.189 2.409 20 10 DECDLO C[C@H]1CC(=O)NCC[N@H+]1Cc1cc(Cl)cc(Cl)c1O ZINC000377827060 290324942 /nfs/dbraw/zinc/32/49/42/290324942.db2.gz SKYWUNIWYWUDFX-QMMMGPOBSA-N 1 2 303.189 2.409 20 10 DECDLO C[C@@H](C[NH2+][C@@H](C)c1ccc(F)c(F)c1O)N1CCOCC1 ZINC000191192870 295972424 /nfs/dbraw/zinc/97/24/24/295972424.db2.gz OAYGNNWRZUUDRQ-QWRGUYRKSA-N 1 2 300.349 2.042 20 10 DECDLO CCN(C)C(=O)[C@@H]([NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1O)C(C)C ZINC000296635359 284305742 /nfs/dbraw/zinc/30/57/42/284305742.db2.gz XSANUDWBDLDZCT-NHYWBVRUSA-N 1 2 323.393 2.454 20 10 DECDLO O=[N+]([O-])c1ccc(O)c(C[NH2+]C[C@H](O)Cc2cccc(F)c2)c1 ZINC000294685930 224167972 /nfs/dbraw/zinc/16/79/72/224167972.db2.gz BKVYJCMIEWAMPD-OAHLLOKOSA-N 1 2 320.320 2.133 20 10 DECDLO CCNC(=O)C[N@H+](CC)Cc1cc(Cl)cc(C(C)=O)c1O ZINC000050155103 402025844 /nfs/dbraw/zinc/02/58/44/402025844.db2.gz UVXYWHUVNAUQKQ-UHFFFAOYSA-N 1 2 312.797 2.206 20 10 DECDLO CCNC(=O)C[N@@H+](CC)Cc1cc(Cl)cc(C(C)=O)c1O ZINC000050155103 402025847 /nfs/dbraw/zinc/02/58/47/402025847.db2.gz UVXYWHUVNAUQKQ-UHFFFAOYSA-N 1 2 312.797 2.206 20 10 DECDLO O=S1(=O)CC[C@H]([N@H+](Cc2cccc(Cl)c2O)C2CC2)C1 ZINC000179710802 402598760 /nfs/dbraw/zinc/59/87/60/402598760.db2.gz XFUJDSNAIBXQFA-LBPRGKRZSA-N 1 2 315.822 2.197 20 10 DECDLO O=S1(=O)CC[C@H]([N@@H+](Cc2cccc(Cl)c2O)C2CC2)C1 ZINC000179710802 402598763 /nfs/dbraw/zinc/59/87/63/402598763.db2.gz XFUJDSNAIBXQFA-LBPRGKRZSA-N 1 2 315.822 2.197 20 10 DECDLO CCc1nnc([C@H](C)[NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2O)[nH]1 ZINC000273539523 403013363 /nfs/dbraw/zinc/01/33/63/403013363.db2.gz YADLURKEKVBIHJ-BDAKNGLRSA-N 1 2 305.338 2.393 20 10 DECDLO CCOC(=O)[C@@H]([NH2+]Cc1cc2c(cc1O)OCO2)[C@H](C)CC ZINC000276525556 403183788 /nfs/dbraw/zinc/18/37/88/403183788.db2.gz VYILCWXUHXWYCT-BMIGLBTASA-N 1 2 309.362 2.188 20 10 DECDLO COCCc1noc(C[N@H+](C)Cc2ccc(N(C)C)c(C)c2)n1 ZINC000292843293 403380005 /nfs/dbraw/zinc/38/00/05/403380005.db2.gz PSZTZUDYBQTYFW-UHFFFAOYSA-N 1 2 318.421 2.265 20 10 DECDLO COCCc1noc(C[N@@H+](C)Cc2ccc(N(C)C)c(C)c2)n1 ZINC000292843293 403380009 /nfs/dbraw/zinc/38/00/09/403380009.db2.gz PSZTZUDYBQTYFW-UHFFFAOYSA-N 1 2 318.421 2.265 20 10 DECDLO COC(=O)C[N@@H+](Cc1cc(Cl)ccc1O)C[C@@H](O)C(C)C ZINC000293029607 403387298 /nfs/dbraw/zinc/38/72/98/403387298.db2.gz WADHUOXMVJFWNL-CQSZACIVSA-N 1 2 315.797 2.038 20 10 DECDLO COC(=O)C[N@H+](Cc1cc(Cl)ccc1O)C[C@@H](O)C(C)C ZINC000293029607 403387301 /nfs/dbraw/zinc/38/73/01/403387301.db2.gz WADHUOXMVJFWNL-CQSZACIVSA-N 1 2 315.797 2.038 20 10 DECDLO CCOC(=O)[C@@H]1CCCC[N@@H+]1Cc1cc2c(cc1O)OCO2 ZINC000298783139 403462513 /nfs/dbraw/zinc/46/25/13/403462513.db2.gz GURRPKPCBNEVPK-LBPRGKRZSA-N 1 2 307.346 2.039 20 10 DECDLO CCOC(=O)[C@@H]1CCCC[N@H+]1Cc1cc2c(cc1O)OCO2 ZINC000298783139 403462517 /nfs/dbraw/zinc/46/25/17/403462517.db2.gz GURRPKPCBNEVPK-LBPRGKRZSA-N 1 2 307.346 2.039 20 10 DECDLO Cc1nc([C@@H](C)[N@H+](C)Cc2ccc(N3CCOCC3)cc2)no1 ZINC000289741443 403994599 /nfs/dbraw/zinc/99/45/99/403994599.db2.gz IEWVOPIBGRAUQC-CYBMUJFWSA-N 1 2 316.405 2.408 20 10 DECDLO Cc1nc([C@@H](C)[N@@H+](C)Cc2ccc(N3CCOCC3)cc2)no1 ZINC000289741443 403994608 /nfs/dbraw/zinc/99/46/08/403994608.db2.gz IEWVOPIBGRAUQC-CYBMUJFWSA-N 1 2 316.405 2.408 20 10 DECDLO NC(=O)C[C@@H]1CC[N@H+](Cc2cc(Cl)cc(Cl)c2O)C1 ZINC000368135220 227004233 /nfs/dbraw/zinc/00/42/33/227004233.db2.gz OZKAFFDDQKYTDS-QMMMGPOBSA-N 1 2 303.189 2.396 20 10 DECDLO NC(=O)C[C@@H]1CC[N@@H+](Cc2cc(Cl)cc(Cl)c2O)C1 ZINC000368135220 227004237 /nfs/dbraw/zinc/00/42/37/227004237.db2.gz OZKAFFDDQKYTDS-QMMMGPOBSA-N 1 2 303.189 2.396 20 10 DECDLO O=S1(=O)C[C@H]([NH2+]Cc2cc(F)ccc2O)c2ccccc21 ZINC000378490714 227215624 /nfs/dbraw/zinc/21/56/24/227215624.db2.gz CWQLZYUGSGHTGA-ZDUSSCGKSA-N 1 2 307.346 2.150 20 10 DECDLO CCOc1ccc(N2CC[NH+](Cc3n[nH]cc3C)CC2)cc1 ZINC001350085554 1151323447 /nfs/dbraw/zinc/32/34/47/1151323447.db2.gz MZQURXWLVWZLQM-UHFFFAOYSA-N 1 2 300.406 2.439 20 10 DECDLO O=C1CCCN1[C@@H]1CCC[N@@H+](Cc2cc(F)cc(F)c2O)C1 ZINC000894014481 636092519 /nfs/dbraw/zinc/09/25/19/636092519.db2.gz LTRRASXKRIALTK-CYBMUJFWSA-N 1 2 310.344 2.257 20 10 DECDLO O=C1CCCN1[C@@H]1CCC[N@H+](Cc2cc(F)cc(F)c2O)C1 ZINC000894014481 636092521 /nfs/dbraw/zinc/09/25/21/636092521.db2.gz LTRRASXKRIALTK-CYBMUJFWSA-N 1 2 310.344 2.257 20 10 DECDLO Oc1c(F)cc(F)cc1C[NH2+]C1(c2ncccn2)CCOCC1 ZINC000923011397 636911243 /nfs/dbraw/zinc/91/12/43/636911243.db2.gz RGNLUIQLWLWDFM-UHFFFAOYSA-N 1 2 321.327 2.256 20 10 DECDLO CCOC(=O)[C@@H]1[C@@H]2CC[N@H+](Cc3cc(F)cc(F)c3O)C[C@@H]21 ZINC000896444465 638526411 /nfs/dbraw/zinc/52/64/11/638526411.db2.gz KQSOSGBXUNWEEB-MBNYWOFBSA-N 1 2 311.328 2.301 20 10 DECDLO CCOC(=O)[C@@H]1[C@@H]2CC[N@@H+](Cc3cc(F)cc(F)c3O)C[C@@H]21 ZINC000896444465 638526413 /nfs/dbraw/zinc/52/64/13/638526413.db2.gz KQSOSGBXUNWEEB-MBNYWOFBSA-N 1 2 311.328 2.301 20 10 DECDLO C[C@H]([NH2+]CCCN1CCOC1=O)c1cc(F)cc(F)c1O ZINC000756539970 639670367 /nfs/dbraw/zinc/67/03/67/639670367.db2.gz YNOFEPHXWBGAIT-VIFPVBQESA-N 1 2 300.305 2.163 20 10 DECDLO C[C@H](CC(N)=O)[NH2+][C@H](C)c1cc(Br)cc(F)c1O ZINC000756662162 639683305 /nfs/dbraw/zinc/68/33/05/639683305.db2.gz WSXYSRBDRKVDOA-RNFRBKRXSA-N 1 2 319.174 2.208 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@H+]2CCCc3c(cnn3C)C2)c1O ZINC000839628589 639775169 /nfs/dbraw/zinc/77/51/69/639775169.db2.gz VWLXKCIMPJXEIV-UHFFFAOYSA-N 1 2 317.364 2.416 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@@H+]2CCCc3c(cnn3C)C2)c1O ZINC000839628589 639775172 /nfs/dbraw/zinc/77/51/72/639775172.db2.gz VWLXKCIMPJXEIV-UHFFFAOYSA-N 1 2 317.364 2.416 20 10 DECDLO COc1cccc(O)c1C[NH+]1CCN(C(=O)OCC(C)C)CC1 ZINC000769233213 641200568 /nfs/dbraw/zinc/20/05/68/641200568.db2.gz OSQUXQBWVVTYQI-UHFFFAOYSA-N 1 2 322.405 2.311 20 10 DECDLO CN(C)c1ccc(CNC(=O)c2cccc3[nH+]ccn32)cc1F ZINC000770077795 641330436 /nfs/dbraw/zinc/33/04/36/641330436.db2.gz NSWPISGGKDKAQS-UHFFFAOYSA-N 1 2 312.348 2.469 20 10 DECDLO C[C@H](NC(=O)NCCn1cc[nH+]c1)c1ccc(N(C)C)cc1 ZINC000773367110 641764726 /nfs/dbraw/zinc/76/47/26/641764726.db2.gz TTYXSDZKKYZAKF-ZDUSSCGKSA-N 1 2 301.394 2.010 20 10 DECDLO CC(=O)N1CC[C@H](C[N@@H+](C)Cc2cc(Cl)cc(F)c2O)C1 ZINC000775743407 642088212 /nfs/dbraw/zinc/08/82/12/642088212.db2.gz GJYBKWAMDSSNOA-LLVKDONJSA-N 1 2 314.788 2.485 20 10 DECDLO CC(=O)N1CC[C@H](C[N@H+](C)Cc2cc(Cl)cc(F)c2O)C1 ZINC000775743407 642088214 /nfs/dbraw/zinc/08/82/14/642088214.db2.gz GJYBKWAMDSSNOA-LLVKDONJSA-N 1 2 314.788 2.485 20 10 DECDLO COC1(C[NH2+]Cc2cc(Cl)cc(F)c2O)CCOCC1 ZINC000776254014 642150035 /nfs/dbraw/zinc/15/00/35/642150035.db2.gz ZIVLOIRQFGUOPA-UHFFFAOYSA-N 1 2 303.761 2.470 20 10 DECDLO COC[C@H]([NH2+]Cc1cc(Cl)cc(F)c1O)[C@@H]1CCCO1 ZINC000789777592 643775326 /nfs/dbraw/zinc/77/53/26/643775326.db2.gz YULLWYMMKPSLNZ-STQMWFEESA-N 1 2 303.761 2.468 20 10 DECDLO COc1ccc(N2CC[NH+](CN3C(=O)CCC3(C)C)CC2)cc1 ZINC000808135111 646037325 /nfs/dbraw/zinc/03/73/25/646037325.db2.gz GWXZHGGLJYNKCP-UHFFFAOYSA-N 1 2 317.433 2.176 20 10 DECDLO COc1cccc(O)c1C[NH2+][C@H]1CS(=O)(=O)c2ccccc21 ZINC000809754572 646277347 /nfs/dbraw/zinc/27/73/47/646277347.db2.gz FSDJRXZVOAKFDW-ZDUSSCGKSA-N 1 2 319.382 2.019 20 10 DECDLO C[C@@H]1C[N@@H+](C[C@H]2CCCN2C(=O)C2=CC(=O)CS2)C[C@H](C)O1 ZINC000731871440 647516185 /nfs/dbraw/zinc/51/61/85/647516185.db2.gz LBRXOGFEZZABEU-FRRDWIJNSA-N 1 2 324.446 2.168 20 10 DECDLO C[C@@H]1C[N@H+](C[C@H]2CCCN2C(=O)C2=CC(=O)CS2)C[C@H](C)O1 ZINC000731871440 647516186 /nfs/dbraw/zinc/51/61/86/647516186.db2.gz LBRXOGFEZZABEU-FRRDWIJNSA-N 1 2 324.446 2.168 20 10 DECDLO Cn1c[nH+]cc1[C@@H]1C[C@H]1C(=O)NCc1ccc(N2CCCC2)cc1 ZINC000821842655 648119658 /nfs/dbraw/zinc/11/96/58/648119658.db2.gz MLAZSRCHAKLIJN-IAGOWNOFSA-N 1 2 324.428 2.440 20 10 DECDLO COC(=O)N1CC[NH+](Cc2cc(C(C)(C)C)cc(O)c2O)CC1 ZINC000921052079 648270374 /nfs/dbraw/zinc/27/03/74/648270374.db2.gz XYKVFKIGRXINFN-UHFFFAOYSA-N 1 2 322.405 2.279 20 10 DECDLO C[N@H+](Cc1cc(Cl)cc(F)c1O)[C@@H]1CCN2CCO[C@H]1C2 ZINC000824501381 648598651 /nfs/dbraw/zinc/59/86/51/648598651.db2.gz JLKDRTXQEGGNRM-KGLIPLIRSA-N 1 2 314.788 2.090 20 10 DECDLO C[N@@H+](Cc1cc(Cl)cc(F)c1O)[C@@H]1CCN2CCO[C@H]1C2 ZINC000824501381 648598658 /nfs/dbraw/zinc/59/86/58/648598658.db2.gz JLKDRTXQEGGNRM-KGLIPLIRSA-N 1 2 314.788 2.090 20 10 DECDLO Oc1c(Br)cccc1C[NH2+]Cc1nnc(C2CC2)[nH]1 ZINC000824603728 648621729 /nfs/dbraw/zinc/62/17/29/648621729.db2.gz ZJTBJZNSKVMPPX-UHFFFAOYSA-N 1 2 323.194 2.440 20 10 DECDLO Oc1c(Cl)cccc1C[N@@H+]1C[C@H](O)C[C@H]1[C@@H]1CCCOC1 ZINC000824655716 648630857 /nfs/dbraw/zinc/63/08/57/648630857.db2.gz ZKZBQCXUUKINHU-NFAWXSAZSA-N 1 2 311.809 2.407 20 10 DECDLO Oc1c(Cl)cccc1C[N@H+]1C[C@H](O)C[C@H]1[C@@H]1CCCOC1 ZINC000824655716 648630859 /nfs/dbraw/zinc/63/08/59/648630859.db2.gz ZKZBQCXUUKINHU-NFAWXSAZSA-N 1 2 311.809 2.407 20 10 DECDLO C[C@H]1CC[C@@H]([NH2+]Cc2cccc(Cl)c2O)CS1(=O)=O ZINC000827173747 648986721 /nfs/dbraw/zinc/98/67/21/648986721.db2.gz ZZXSZDNDMSZEHS-GXSJLCMTSA-N 1 2 303.811 2.101 20 10 DECDLO Nc1ccc(Cc2noc(Cc3cn4c([nH+]3)CCCC4)n2)cc1 ZINC000844906252 651181427 /nfs/dbraw/zinc/18/14/27/651181427.db2.gz MUSOLTAVKUYZBH-UHFFFAOYSA-N 1 2 309.373 2.366 20 10 DECDLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)NCc1ccc2c(c1)CCCN2C ZINC000847405228 651394130 /nfs/dbraw/zinc/39/41/30/651394130.db2.gz CETBMGYYSPLHMB-ZDUSSCGKSA-N 1 2 312.417 2.287 20 10 DECDLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)NCc1ccc2c(c1)CCCN2C ZINC000847405228 651394131 /nfs/dbraw/zinc/39/41/31/651394131.db2.gz CETBMGYYSPLHMB-ZDUSSCGKSA-N 1 2 312.417 2.287 20 10 DECDLO C[C@@H]([NH2+]Cc1nc([C@H]2CCCO2)n[nH]1)c1cc(F)ccc1O ZINC000848558172 651470541 /nfs/dbraw/zinc/47/05/41/651470541.db2.gz OSBJQFGGHMIWAY-NOZJJQNGSA-N 1 2 306.341 2.352 20 10 DECDLO CC[NH+]1CCN(C(=O)[C@@H](C)Sc2ncc(Cl)s2)CC1 ZINC000849998718 651798495 /nfs/dbraw/zinc/79/84/95/651798495.db2.gz RVOCLIPXAXVGEA-SECBINFHSA-N 1 2 319.883 2.441 20 10 DECDLO COC(=O)[C@@H]1C[N@@H+](Cc2c(O)cc(C)cc2Cl)C[C@@H](C)O1 ZINC000862487441 686309638 /nfs/dbraw/zinc/30/96/38/686309638.db2.gz PBZCCMSOYJOCQI-YGRLFVJLSA-N 1 2 313.781 2.116 20 10 DECDLO CC[C@@H](C(=O)N1Cc2cccc(O)c2C1)[N@@H+]1CCO[C@H](CC)C1 ZINC000871205514 688749378 /nfs/dbraw/zinc/74/93/78/688749378.db2.gz USADANOAZUGIQH-ZBFHGGJFSA-N 1 2 318.417 2.124 20 10 DECDLO CC[C@@H](C(=O)N1Cc2cccc(O)c2C1)[N@H+]1CCO[C@H](CC)C1 ZINC000871205514 688749383 /nfs/dbraw/zinc/74/93/83/688749383.db2.gz USADANOAZUGIQH-ZBFHGGJFSA-N 1 2 318.417 2.124 20 10 DECDLO CC[NH+](CC)CCN(CCOC)Cc1ccc(F)c(F)c1O ZINC000876693334 689904987 /nfs/dbraw/zinc/90/49/87/689904987.db2.gz UQNOZWFYZVSHQF-UHFFFAOYSA-N 1 2 316.392 2.461 20 10 DECDLO COC(=O)[C@@H](C[C@@H]1CCCOC1)[NH2+]Cc1ccc(C)cc1O ZINC000877656280 690181375 /nfs/dbraw/zinc/18/13/75/690181375.db2.gz DAVMGHFWOUEYMV-DZGCQCFKSA-N 1 2 307.390 2.149 20 10 DECDLO C[N@@H+]1CCN(C(=O)c2c(F)ccc(O)c2O)C[C@@H]1C(C)(C)C ZINC000880611802 690942702 /nfs/dbraw/zinc/94/27/02/690942702.db2.gz CPETXPGHKNASCX-GFCCVEGCSA-N 1 2 310.369 2.039 20 10 DECDLO C[N@H+]1CCN(C(=O)c2c(F)ccc(O)c2O)C[C@@H]1C(C)(C)C ZINC000880611802 690942705 /nfs/dbraw/zinc/94/27/05/690942705.db2.gz CPETXPGHKNASCX-GFCCVEGCSA-N 1 2 310.369 2.039 20 10 DECDLO C[C@@H]([NH2+][C@H]1CCc2nnn(C)c2C1)c1cc(F)cc(F)c1O ZINC000927148954 693560937 /nfs/dbraw/zinc/56/09/37/693560937.db2.gz YXRMCJFTKZXKBS-SCZZXKLOSA-N 1 2 308.332 2.007 20 10 DECDLO COC[C@@H]1Cn2nccc2C[N@H+](Cc2cc(F)c(F)cc2O)C1 ZINC001142520545 780790335 /nfs/dbraw/zinc/79/03/35/780790335.db2.gz LJOOWOFYUCFHPU-NSHDSACASA-N 1 2 323.343 2.145 20 10 DECDLO COC[C@@H]1Cn2nccc2C[N@@H+](Cc2cc(F)c(F)cc2O)C1 ZINC001142520545 780790344 /nfs/dbraw/zinc/79/03/44/780790344.db2.gz LJOOWOFYUCFHPU-NSHDSACASA-N 1 2 323.343 2.145 20 10 DECDLO OC[C@H]1CCC[N@@H+]1Cc1cc(Br)c(F)cc1O ZINC001144298410 790845535 /nfs/dbraw/zinc/84/55/35/790845535.db2.gz CZZLQHBCXVSIQQ-SECBINFHSA-N 1 2 304.159 2.251 20 10 DECDLO OC[C@H]1CCC[N@H+]1Cc1cc(Br)c(F)cc1O ZINC001144298410 790845544 /nfs/dbraw/zinc/84/55/44/790845544.db2.gz CZZLQHBCXVSIQQ-SECBINFHSA-N 1 2 304.159 2.251 20 10 DECDLO CCOC(=O)C[N@H+](CCC(=O)OC(C)C)Cc1ccccc1O ZINC001171389906 792183943 /nfs/dbraw/zinc/18/39/43/792183943.db2.gz DGRKSERUYITMIU-UHFFFAOYSA-N 1 2 323.389 2.099 20 10 DECDLO CCOC(=O)C[N@@H+](CCC(=O)OC(C)C)Cc1ccccc1O ZINC001171389906 792183949 /nfs/dbraw/zinc/18/39/49/792183949.db2.gz DGRKSERUYITMIU-UHFFFAOYSA-N 1 2 323.389 2.099 20 10 DECDLO Cc1ccc(C(=O)N2CCC(Cc3c[nH]c[nH+]3)CC2)c(O)c1O ZINC001123990101 796016453 /nfs/dbraw/zinc/01/64/53/796016453.db2.gz HTXKPBZSMUKXLG-UHFFFAOYSA-N 1 2 315.373 2.224 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CC[C@@H](O)C[C@@H]1C ZINC001139132723 796330698 /nfs/dbraw/zinc/33/06/98/796330698.db2.gz ZMJDEPSNEKBZKU-NWDGAFQWSA-N 1 2 303.358 2.152 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CC[C@@H](O)C[C@@H]1C ZINC001139132723 796330704 /nfs/dbraw/zinc/33/07/04/796330704.db2.gz ZMJDEPSNEKBZKU-NWDGAFQWSA-N 1 2 303.358 2.152 20 10 DECDLO CCn1cc2c(n1)C[N@@H+](Cc1cc(F)ccc1O)C[C@@H]2COC ZINC001140063057 796472295 /nfs/dbraw/zinc/47/22/95/796472295.db2.gz JIZAJVMOQKNHRN-CYBMUJFWSA-N 1 2 319.380 2.494 20 10 DECDLO CCn1cc2c(n1)C[N@H+](Cc1cc(F)ccc1O)C[C@@H]2COC ZINC001140063057 796472300 /nfs/dbraw/zinc/47/23/00/796472300.db2.gz JIZAJVMOQKNHRN-CYBMUJFWSA-N 1 2 319.380 2.494 20 10 DECDLO CC1(C)CN(C2C[NH+](Cc3c(O)cccc3Cl)C2)CCO1 ZINC001140341179 796509360 /nfs/dbraw/zinc/50/93/60/796509360.db2.gz AUQAMBXQKOAUIP-UHFFFAOYSA-N 1 2 310.825 2.341 20 10 DECDLO CCOC(=O)[C@]12C[C@H]1CC[N@@H+]2Cc1ccc2c(c1)OCCN2C ZINC001141142095 796638928 /nfs/dbraw/zinc/63/89/28/796638928.db2.gz FICHHXJPVJZUDM-KDOFPFPSSA-N 1 2 316.401 2.043 20 10 DECDLO CCOC(=O)[C@]12C[C@H]1CC[N@H+]2Cc1ccc2c(c1)OCCN2C ZINC001141142095 796638930 /nfs/dbraw/zinc/63/89/30/796638930.db2.gz FICHHXJPVJZUDM-KDOFPFPSSA-N 1 2 316.401 2.043 20 10 DECDLO O=C(C1CCCCC1)N1CC[NH+](Cc2cc(O)ccc2O)CC1 ZINC001141161849 796643024 /nfs/dbraw/zinc/64/30/24/796643024.db2.gz GADVHHGIFHRQEY-UHFFFAOYSA-N 1 2 318.417 2.322 20 10 DECDLO Cc1[nH]c2c([nH+]1)CCN(C(=O)c1ccc(O)c(O)c1Cl)CC2 ZINC001193220345 797523591 /nfs/dbraw/zinc/52/35/91/797523591.db2.gz SPWJXVMUBQHRSU-UHFFFAOYSA-N 1 2 321.764 2.024 20 10 DECDLO CCOC[C@H]1C[N@H+](Cc2ccccc2O)Cc2nnn(CC)c21 ZINC001203551539 800077472 /nfs/dbraw/zinc/07/74/72/800077472.db2.gz HKRZSJKXQHDANI-CQSZACIVSA-N 1 2 316.405 2.140 20 10 DECDLO CCOC[C@H]1C[N@@H+](Cc2ccccc2O)Cc2nnn(CC)c21 ZINC001203551539 800077484 /nfs/dbraw/zinc/07/74/84/800077484.db2.gz HKRZSJKXQHDANI-CQSZACIVSA-N 1 2 316.405 2.140 20 10 DECDLO CN(c1ccc2[nH]c[nH+]c2c1)S(=O)(=O)Cc1ccc(N)cc1 ZINC001209847306 801294987 /nfs/dbraw/zinc/29/49/87/801294987.db2.gz BHANLCIBXUMVOT-UHFFFAOYSA-N 1 2 316.386 2.111 20 10 DECDLO Oc1cc(C[NH+]2CCN(c3cccc(F)c3)CC2)cc(O)c1O ZINC001233016421 802005330 /nfs/dbraw/zinc/00/53/30/802005330.db2.gz WWZUZNBTSMBBIX-UHFFFAOYSA-N 1 2 318.348 2.265 20 10 DECDLO COC(=O)[C@H]1C[N@H+](Cc2cc(C(C)(C)C)ccc2O)CCO1 ZINC001233283962 802065153 /nfs/dbraw/zinc/06/51/53/802065153.db2.gz CEIXZEOSCOITHV-OAHLLOKOSA-N 1 2 307.390 2.064 20 10 DECDLO COC(=O)[C@H]1C[N@@H+](Cc2cc(C(C)(C)C)ccc2O)CCO1 ZINC001233283962 802065157 /nfs/dbraw/zinc/06/51/57/802065157.db2.gz CEIXZEOSCOITHV-OAHLLOKOSA-N 1 2 307.390 2.064 20 10 DECDLO OC[C@]1(C(F)(F)F)CC[N@H+](Cc2c(O)ccc(F)c2F)C1 ZINC001233332508 802078514 /nfs/dbraw/zinc/07/85/14/802078514.db2.gz NHCBFQLQRIWNBQ-LBPRGKRZSA-N 1 2 311.250 2.417 20 10 DECDLO OC[C@]1(C(F)(F)F)CC[N@@H+](Cc2c(O)ccc(F)c2F)C1 ZINC001233332508 802078521 /nfs/dbraw/zinc/07/85/21/802078521.db2.gz NHCBFQLQRIWNBQ-LBPRGKRZSA-N 1 2 311.250 2.417 20 10 DECDLO Oc1c(C[N@@H+]2CCO[C@]3(CCOC3)C2)cccc1C(F)(F)F ZINC001233416409 802111309 /nfs/dbraw/zinc/11/13/09/802111309.db2.gz HABLOVALGOVSDP-CQSZACIVSA-N 1 2 317.307 2.402 20 10 DECDLO Oc1c(C[N@H+]2CCO[C@]3(CCOC3)C2)cccc1C(F)(F)F ZINC001233416409 802111312 /nfs/dbraw/zinc/11/13/12/802111312.db2.gz HABLOVALGOVSDP-CQSZACIVSA-N 1 2 317.307 2.402 20 10 DECDLO C[C@H]1CN(C)C(=O)C[N@@H+]1Cc1ccc(C(F)(F)F)cc1O ZINC001233455329 802121745 /nfs/dbraw/zinc/12/17/45/802121745.db2.gz GDJZSNYOFIIZGI-VIFPVBQESA-N 1 2 302.296 2.074 20 10 DECDLO CC(C)O[C@H]1C[C@@H]([NH2+][C@H](C)c2cccc(-c3nn[nH]n3)c2O)C1 ZINC001603356573 1069953984 /nfs/dbraw/zinc/95/39/84/1069953984.db2.gz DRHKPSDRAZWKIO-UTUOFQBUSA-N 1 2 317.393 2.179 20 10 DECDLO C[C@H]([NH2+]Cc1cc(Cl)cc(F)c1O)[C@H](C)N1CCOCC1 ZINC001461178294 1058601316 /nfs/dbraw/zinc/60/13/16/1058601316.db2.gz UGSORSSSTUGAJU-QWRGUYRKSA-N 1 2 316.804 2.384 20 10 DECDLO C[C@H]1OCC[C@]12C[N@H+](Cc1cc(F)c(F)cc1O)C[C@@H](C)O2 ZINC001560803656 1075146249 /nfs/dbraw/zinc/14/62/49/1075146249.db2.gz CDCADHYADBIEQO-UVWXRNBGSA-N 1 2 313.344 2.439 20 10 DECDLO C[C@H]1OCC[C@]12C[N@@H+](Cc1cc(F)c(F)cc1O)C[C@@H](C)O2 ZINC001560803656 1075146252 /nfs/dbraw/zinc/14/62/52/1075146252.db2.gz CDCADHYADBIEQO-UVWXRNBGSA-N 1 2 313.344 2.439 20 10 DECDLO C[C@@H]([NH2+][C@H](CO)CC(C)(C)C)c1cccc(-c2nn[nH]n2)c1O ZINC001589953881 1076535168 /nfs/dbraw/zinc/53/51/68/1076535168.db2.gz WTLXHVOTMOKNKT-MNOVXSKESA-N 1 2 319.409 2.020 20 10 DECDLO C[C@@H]([NH2+]C[C@@H]1CCC(C)(C)O1)c1cccc(-c2nn[nH]n2)c1O ZINC001589961167 1076537646 /nfs/dbraw/zinc/53/76/46/1076537646.db2.gz BQLLWDYAQBPRLD-MNOVXSKESA-N 1 2 317.393 2.181 20 10 DECDLO C[C@H]([NH2+][C@@H](C)c1cccc(-c2nn[nH]n2)c1O)c1cccnc1 ZINC001589973109 1076540963 /nfs/dbraw/zinc/54/09/63/1076540963.db2.gz BKGNNSBNKKRQFJ-QWRGUYRKSA-N 1 2 310.361 2.379 20 10 DECDLO CC[C@@H]([NH2+]C[C@](C)(O)C(C)C)c1cccc(-c2nn[nH]n2)c1O ZINC001590464001 1076632624 /nfs/dbraw/zinc/63/26/24/1076632624.db2.gz NYPGMUQASWYINE-CJNGLKHVSA-N 1 2 319.409 2.020 20 10 DECDLO CCC(O)(CC)CC[NH2+][C@@H](C)c1cccc(-c2nn[nH]n2)c1O ZINC001590473840 1076635981 /nfs/dbraw/zinc/63/59/81/1076635981.db2.gz WDLSJINHBPAXFX-NSHDSACASA-N 1 2 319.409 2.164 20 10 DECDLO CCOC(=O)CCC[N@H+](CC(=O)OCC)Cc1ccccc1O ZINC001654805878 1079977117 /nfs/dbraw/zinc/97/71/17/1079977117.db2.gz GTDRCRDIDWBJHE-UHFFFAOYSA-N 1 2 323.389 2.101 20 10 DECDLO CCOC(=O)CCC[N@@H+](CC(=O)OCC)Cc1ccccc1O ZINC001654805878 1079977123 /nfs/dbraw/zinc/97/71/23/1079977123.db2.gz GTDRCRDIDWBJHE-UHFFFAOYSA-N 1 2 323.389 2.101 20 10 DECDLO O=C1N[C@@H]2C[N@H+](Cc3c(O)ccc(Cl)c3F)CC[C@H]2CO1 ZINC001659594554 1080245536 /nfs/dbraw/zinc/24/55/36/1080245536.db2.gz VIKAMSDFCVUQQZ-GZMMTYOYSA-N 1 2 314.744 2.115 20 10 DECDLO O=C1N[C@@H]2C[N@@H+](Cc3c(O)ccc(Cl)c3F)CC[C@H]2CO1 ZINC001659594554 1080245542 /nfs/dbraw/zinc/24/55/42/1080245542.db2.gz VIKAMSDFCVUQQZ-GZMMTYOYSA-N 1 2 314.744 2.115 20 10 DECDLO CCCC[N@H+](CC(N)=O)Cc1c(O)cccc1Br ZINC000707153066 1086662683 /nfs/dbraw/zinc/66/26/83/1086662683.db2.gz UVEWWTYUXUHKAO-UHFFFAOYSA-N 1 2 315.211 2.242 20 10 DECDLO CCCC[N@@H+](CC(N)=O)Cc1c(O)cccc1Br ZINC000707153066 1086662686 /nfs/dbraw/zinc/66/26/86/1086662686.db2.gz UVEWWTYUXUHKAO-UHFFFAOYSA-N 1 2 315.211 2.242 20 10 DECDLO CNC(=O)[C@@H]1CC12CC[NH+](Cc1cccc(Cl)c1O)CC2 ZINC001274234148 1091144430 /nfs/dbraw/zinc/14/44/30/1091144430.db2.gz ITLBVAYAJPPQGD-LBPRGKRZSA-N 1 2 308.809 2.394 20 10 DECDLO COc1ccc(C[NH+]2CCC3(CNC(=O)C3)CC2)c(O)c1Cl ZINC001236801211 1138431844 /nfs/dbraw/zinc/43/18/44/1138431844.db2.gz HILWLDKXATWAGX-UHFFFAOYSA-N 1 2 324.808 2.156 20 10 DECDLO CC(=O)N[C@H]1CC[N@H+](Cc2c(O)ccc(Cl)c2Cl)C1 ZINC001237085312 1138500969 /nfs/dbraw/zinc/50/09/69/1138500969.db2.gz XSKVRYWEOHFSAE-VIFPVBQESA-N 1 2 303.189 2.409 20 10 DECDLO CC(=O)N[C@H]1CC[N@@H+](Cc2c(O)ccc(Cl)c2Cl)C1 ZINC001237085312 1138500972 /nfs/dbraw/zinc/50/09/72/1138500972.db2.gz XSKVRYWEOHFSAE-VIFPVBQESA-N 1 2 303.189 2.409 20 10 DECDLO CCOC(=O)CC[N@H+](CC(=O)OCC)Cc1c(C)cccc1O ZINC001237489801 1138655693 /nfs/dbraw/zinc/65/56/93/1138655693.db2.gz KISSRJRVUVRSEU-UHFFFAOYSA-N 1 2 323.389 2.019 20 10 DECDLO CCOC(=O)CC[N@@H+](CC(=O)OCC)Cc1c(C)cccc1O ZINC001237489801 1138655706 /nfs/dbraw/zinc/65/57/06/1138655706.db2.gz KISSRJRVUVRSEU-UHFFFAOYSA-N 1 2 323.389 2.019 20 10 DECDLO CC[N@H+](CC(=O)OC)Cc1cc(Br)c(C)cc1O ZINC001237686761 1138758576 /nfs/dbraw/zinc/75/85/76/1138758576.db2.gz XQHOENGFTLOFTD-UHFFFAOYSA-N 1 2 316.195 2.458 20 10 DECDLO CC[N@@H+](CC(=O)OC)Cc1cc(Br)c(C)cc1O ZINC001237686761 1138758591 /nfs/dbraw/zinc/75/85/91/1138758591.db2.gz XQHOENGFTLOFTD-UHFFFAOYSA-N 1 2 316.195 2.458 20 10 DECDLO C[N@H+](C1CN(Cc2cc(F)cc(Cl)c2O)C1)[C@@H]1CCOC1 ZINC001237799161 1138791013 /nfs/dbraw/zinc/79/10/13/1138791013.db2.gz OQCOIWCPEDJLMS-GFCCVEGCSA-N 1 2 314.788 2.090 20 10 DECDLO C[N@@H+](C1CN(Cc2cc(F)cc(Cl)c2O)C1)[C@@H]1CCOC1 ZINC001237799161 1138791016 /nfs/dbraw/zinc/79/10/16/1138791016.db2.gz OQCOIWCPEDJLMS-GFCCVEGCSA-N 1 2 314.788 2.090 20 10 DECDLO CC1(C(N)=O)CC[NH+](Cc2cc(F)cc(Cl)c2O)CC1 ZINC001237799607 1138791371 /nfs/dbraw/zinc/79/13/71/1138791371.db2.gz SESIQXSWLFEQBS-UHFFFAOYSA-N 1 2 300.761 2.272 20 10 DECDLO O=C1NCC2(CC[NH+](Cc3cc(F)cc(Cl)c3O)CC2)O1 ZINC001237806034 1138795637 /nfs/dbraw/zinc/79/56/37/1138795637.db2.gz QJBBVXFMULWZBL-UHFFFAOYSA-N 1 2 314.744 2.259 20 10 DECDLO COC(=O)[C@@H](C)[N@H+](C)Cc1cc(C)c(Br)cc1O ZINC001250128183 1142085468 /nfs/dbraw/zinc/08/54/68/1142085468.db2.gz AGKKSGJRDGNUDF-SECBINFHSA-N 1 2 316.195 2.456 20 10 DECDLO COC(=O)[C@@H](C)[N@@H+](C)Cc1cc(C)c(Br)cc1O ZINC001250128183 1142085477 /nfs/dbraw/zinc/08/54/77/1142085477.db2.gz AGKKSGJRDGNUDF-SECBINFHSA-N 1 2 316.195 2.456 20 10 DECDLO Oc1cc(Cl)ccc1C[NH2+]Cc1nnc(C2CCOCC2)[nH]1 ZINC001308895295 1147488750 /nfs/dbraw/zinc/48/87/50/1147488750.db2.gz NKILNZGSNWBOPQ-UHFFFAOYSA-N 1 2 322.796 2.348 20 10 DECDLO CCOC[C@H]1C[N@H+](Cc2cc(Cl)cc(OC)c2O)CCO1 ZINC000529666019 284234886 /nfs/dbraw/zinc/23/48/86/284234886.db2.gz IVZFJXOKTWPFHB-CYBMUJFWSA-N 1 2 315.797 2.292 20 10 DECDLO CCOC[C@H]1C[N@@H+](Cc2cc(Cl)cc(OC)c2O)CCO1 ZINC000529666019 284234888 /nfs/dbraw/zinc/23/48/88/284234888.db2.gz IVZFJXOKTWPFHB-CYBMUJFWSA-N 1 2 315.797 2.292 20 10 DECDLO O=C(/C=C/c1ccc(O)c(O)c1)N1CCC(n2cc[nH+]c2)CC1 ZINC000272534040 130039197 /nfs/dbraw/zinc/03/91/97/130039197.db2.gz XFNMRQVSKUPTPS-DUXPYHPUSA-N 1 2 313.357 2.171 20 10 DECDLO O=[N+]([O-])c1ccc(O)c(C[NH2+][C@H]2CCO[C@@H]2c2cccnc2)c1 ZINC000285259713 131152150 /nfs/dbraw/zinc/15/21/50/131152150.db2.gz ZPZKCQLCASIJOC-GOEBONIOSA-N 1 2 315.329 2.315 20 10 DECDLO COc1cc[nH+]cc1CNC(=O)N(C)Cc1ccccc1O ZINC000297364334 132012279 /nfs/dbraw/zinc/01/22/79/132012279.db2.gz OZZKQYLXBNXPCN-UHFFFAOYSA-N 1 2 301.346 2.137 20 10 DECDLO NC(=O)[C@H]1CCC[N@H+](Cc2cc(Cl)cc(Cl)c2O)C1 ZINC000155015166 402242196 /nfs/dbraw/zinc/24/21/96/402242196.db2.gz SGMGDUUAQMPRPY-QMMMGPOBSA-N 1 2 303.189 2.396 20 10 DECDLO NC(=O)[C@H]1CCC[N@@H+](Cc2cc(Cl)cc(Cl)c2O)C1 ZINC000155015166 402242197 /nfs/dbraw/zinc/24/21/97/402242197.db2.gz SGMGDUUAQMPRPY-QMMMGPOBSA-N 1 2 303.189 2.396 20 10 DECDLO O=C(NCc1ccccc1-n1cc[nH+]c1)c1cccc(O)c1O ZINC000187011473 402477807 /nfs/dbraw/zinc/47/78/07/402477807.db2.gz PWLAYBHSSQHNJU-UHFFFAOYSA-N 1 2 309.325 2.214 20 10 DECDLO CCn1ncnc1C[N@@H+](Cc1ccccc1O)C[C@@H]1CCCO1 ZINC000193425895 402770723 /nfs/dbraw/zinc/77/07/23/402770723.db2.gz CZIWZBJRHUTXDJ-HNNXBMFYSA-N 1 2 316.405 2.185 20 10 DECDLO CCn1ncnc1C[N@H+](Cc1ccccc1O)C[C@@H]1CCCO1 ZINC000193425895 402770727 /nfs/dbraw/zinc/77/07/27/402770727.db2.gz CZIWZBJRHUTXDJ-HNNXBMFYSA-N 1 2 316.405 2.185 20 10 DECDLO Oc1cc(F)c(Cl)cc1C[NH2+]CCCO[C@@H]1CCOC1 ZINC000293734734 403551571 /nfs/dbraw/zinc/55/15/71/403551571.db2.gz WRUMOEAAKOSFEF-LLVKDONJSA-N 1 2 303.761 2.470 20 10 DECDLO C[C@H]([NH2+][C@@H]1CCCN(CCCO)C1)c1ccc(F)c(F)c1O ZINC000297383295 227095238 /nfs/dbraw/zinc/09/52/38/227095238.db2.gz RFOBOAHNYPPJLL-NWDGAFQWSA-N 1 2 314.376 2.168 20 10 DECDLO CC(C)S(=O)(=O)CC[NH2+][C@@H](C)c1ccc(F)c(F)c1O ZINC000290354764 279744283 /nfs/dbraw/zinc/74/42/83/279744283.db2.gz QIQUILMRSFTBCE-VIFPVBQESA-N 1 2 307.362 2.144 20 10 DECDLO COc1cccc(C[NH+]2CC(O)(c3ccc(F)cc3)C2)c1O ZINC000365660793 525932820 /nfs/dbraw/zinc/93/28/20/525932820.db2.gz HIJUFSMJLNVSDH-UHFFFAOYSA-N 1 2 303.333 2.243 20 10 DECDLO Cc1ccc([C@H](O)C[NH2+]Cc2cc([N+](=O)[O-])ccc2O)cc1 ZINC000237790158 525976352 /nfs/dbraw/zinc/97/63/52/525976352.db2.gz OYXJCVRMIFXYAA-MRXNPFEDSA-N 1 2 302.330 2.432 20 10 DECDLO Oc1ccc(Br)cc1C[NH2+]Cc1csnn1 ZINC000309994856 625378840 /nfs/dbraw/zinc/37/88/40/625378840.db2.gz BWLCWXNJXROKEU-UHFFFAOYSA-N 1 2 300.181 2.296 20 10 DECDLO CC(C)C1(O)C[NH+](Cc2cc(Br)ccc2O)C1 ZINC000839132934 637800727 /nfs/dbraw/zinc/80/07/27/637800727.db2.gz NNLZUWOZZUFYRC-UHFFFAOYSA-N 1 2 300.196 2.357 20 10 DECDLO OC[C@H]([NH2+]Cc1cc(Cl)cc(F)c1O)[C@@H]1CCCOC1 ZINC000840961485 650395832 /nfs/dbraw/zinc/39/58/32/650395832.db2.gz BKBNFFVDEQTIFO-RNCFNFMXSA-N 1 2 303.761 2.062 20 10 DECDLO CCS(=O)(=O)C[C@@H](C)[NH2+][C@H](C)c1cc(F)cc(F)c1O ZINC000756707125 639686072 /nfs/dbraw/zinc/68/60/72/639686072.db2.gz URNFOWJUCQQVNB-RKDXNWHRSA-N 1 2 307.362 2.144 20 10 DECDLO CCNC(=O)N1CC[C@H]([NH2+][C@H](C)c2cc(F)cc(F)c2O)C1 ZINC000756760338 639692810 /nfs/dbraw/zinc/69/28/10/639692810.db2.gz NSZSVPYCQOXZGV-KOLCDFICSA-N 1 2 313.348 2.125 20 10 DECDLO C[C@H]1C[N@H+](CCO)[C@@H](C)CN1Cc1c(O)ccc(Cl)c1F ZINC000841891206 650594334 /nfs/dbraw/zinc/59/43/34/650594334.db2.gz KIAJBGOJFSYESD-QWRGUYRKSA-N 1 2 316.804 2.072 20 10 DECDLO C[C@H]1C[N@@H+](CCO)[C@@H](C)CN1Cc1c(O)ccc(Cl)c1F ZINC000841891206 650594336 /nfs/dbraw/zinc/59/43/36/650594336.db2.gz KIAJBGOJFSYESD-QWRGUYRKSA-N 1 2 316.804 2.072 20 10 DECDLO C[C@H]1C[N@H+](Cc2cc(Br)cc(F)c2O)C[C@@H]1O ZINC000897675784 640898678 /nfs/dbraw/zinc/89/86/78/640898678.db2.gz CAGVVBWZNXSKGU-CPCISQLKSA-N 1 2 304.159 2.106 20 10 DECDLO C[C@H]1C[N@@H+](Cc2cc(Br)cc(F)c2O)C[C@@H]1O ZINC000897675784 640898680 /nfs/dbraw/zinc/89/86/80/640898680.db2.gz CAGVVBWZNXSKGU-CPCISQLKSA-N 1 2 304.159 2.106 20 10 DECDLO Cn1cnc(C[NH2+]Cc2cc(Br)cc(F)c2O)c1 ZINC000898042578 641010868 /nfs/dbraw/zinc/01/08/68/641010868.db2.gz SIBCQDHKVGEXHW-UHFFFAOYSA-N 1 2 314.158 2.317 20 10 DECDLO COC(=O)[C@@H]1[C@H](C[NH2+]Cc2cccc(Cl)c2O)C1(F)F ZINC000898218209 641051608 /nfs/dbraw/zinc/05/16/08/641051608.db2.gz AUEYVURVBZZABI-WPRPVWTQSA-N 1 2 305.708 2.190 20 10 DECDLO CC[C@@H](C(=O)N(C)Cc1ccccc1O)[N@@H+]1CCO[C@@H](CC)C1 ZINC000774043031 641855546 /nfs/dbraw/zinc/85/55/46/641855546.db2.gz IMNVPCMSLIPXNH-HOTGVXAUSA-N 1 2 320.433 2.240 20 10 DECDLO CC[C@@H](C(=O)N(C)Cc1ccccc1O)[N@H+]1CCO[C@@H](CC)C1 ZINC000774043031 641855551 /nfs/dbraw/zinc/85/55/51/641855551.db2.gz IMNVPCMSLIPXNH-HOTGVXAUSA-N 1 2 320.433 2.240 20 10 DECDLO CC[C@@H](CN1CCOCC1)[NH2+][C@H](C)c1cc(F)cc(F)c1O ZINC000903342819 643319647 /nfs/dbraw/zinc/31/96/47/643319647.db2.gz KXBXDSIGWGCUTF-YPMHNXCESA-N 1 2 314.376 2.432 20 10 DECDLO OCCO[C@H]1CCC[N@H+](Cc2c(O)ccc(Cl)c2F)C1 ZINC000792168000 644082559 /nfs/dbraw/zinc/08/25/59/644082559.db2.gz XIHXXHGFHFIKKF-JTQLQIEISA-N 1 2 303.761 2.158 20 10 DECDLO OCCO[C@H]1CCC[N@@H+](Cc2c(O)ccc(Cl)c2F)C1 ZINC000792168000 644082562 /nfs/dbraw/zinc/08/25/62/644082562.db2.gz XIHXXHGFHFIKKF-JTQLQIEISA-N 1 2 303.761 2.158 20 10 DECDLO C[C@@H]1C[N@H+](Cc2c3c(ccc2O)oc2c3CCCC2)CC(=O)N1 ZINC000840134514 646072627 /nfs/dbraw/zinc/07/26/27/646072627.db2.gz PJSKJHXDQMVWHH-LLVKDONJSA-N 1 2 314.385 2.338 20 10 DECDLO C[C@@H]1C[N@@H+](Cc2c3c(ccc2O)oc2c3CCCC2)CC(=O)N1 ZINC000840134514 646072630 /nfs/dbraw/zinc/07/26/30/646072630.db2.gz PJSKJHXDQMVWHH-LLVKDONJSA-N 1 2 314.385 2.338 20 10 DECDLO CC[C@H]([NH2+]Cc1nnn(C)n1)c1ccc(C(F)(F)F)cc1O ZINC000810237693 646343024 /nfs/dbraw/zinc/34/30/24/646343024.db2.gz JVEPOQKJMHIIRU-JTQLQIEISA-N 1 2 315.299 2.175 20 10 DECDLO COc1ccc(O)c(CNC(=O)NCc2cc(C)[nH+]c(C)c2)c1 ZINC000817774613 647358705 /nfs/dbraw/zinc/35/87/05/647358705.db2.gz OCOFXWMXJOZVLO-UHFFFAOYSA-N 1 2 315.373 2.412 20 10 DECDLO CN(C)C(=O)O[C@H]1CC[N@H+](Cc2c(O)ccc(Cl)c2F)C1 ZINC000824576750 648614277 /nfs/dbraw/zinc/61/42/77/648614277.db2.gz RYORZFBQKUCZQD-VIFPVBQESA-N 1 2 316.760 2.457 20 10 DECDLO CN(C)C(=O)O[C@H]1CC[N@@H+](Cc2c(O)ccc(Cl)c2F)C1 ZINC000824576750 648614280 /nfs/dbraw/zinc/61/42/80/648614280.db2.gz RYORZFBQKUCZQD-VIFPVBQESA-N 1 2 316.760 2.457 20 10 DECDLO Cc1noc(C2C[NH+](Cc3ccc(Br)cc3O)C2)n1 ZINC000826113324 648851844 /nfs/dbraw/zinc/85/18/44/648851844.db2.gz JJDNJBVHKBURIG-UHFFFAOYSA-N 1 2 324.178 2.446 20 10 DECDLO O=C(C[N@H+](Cc1ccco1)Cc1ccccc1O)NC1CC1 ZINC000070975128 649041210 /nfs/dbraw/zinc/04/12/10/649041210.db2.gz RXKHGNDQVQNUCP-UHFFFAOYSA-N 1 2 300.358 2.266 20 10 DECDLO O=C(C[N@@H+](Cc1ccco1)Cc1ccccc1O)NC1CC1 ZINC000070975128 649041213 /nfs/dbraw/zinc/04/12/13/649041213.db2.gz RXKHGNDQVQNUCP-UHFFFAOYSA-N 1 2 300.358 2.266 20 10 DECDLO COC[C@]1(C(=O)OC)CCC[N@@H+]1Cc1cc(Cl)ccc1O ZINC000827489901 649041742 /nfs/dbraw/zinc/04/17/42/649041742.db2.gz XUMAEXWBGHIXPW-HNNXBMFYSA-N 1 2 313.781 2.200 20 10 DECDLO COC[C@]1(C(=O)OC)CCC[N@H+]1Cc1cc(Cl)ccc1O ZINC000827489901 649041745 /nfs/dbraw/zinc/04/17/45/649041745.db2.gz XUMAEXWBGHIXPW-HNNXBMFYSA-N 1 2 313.781 2.200 20 10 DECDLO O=C(NCCCSc1nccs1)[C@@H]1CCc2c[nH+]cn2C1 ZINC000844135252 651081806 /nfs/dbraw/zinc/08/18/06/651081806.db2.gz UZJMPIBKOKQSFS-LLVKDONJSA-N 1 2 322.459 2.201 20 10 DECDLO Cc1cc(N(C)C)ccc1CNC(=O)[C@H]1CCc2c[nH+]cn2C1 ZINC000844134805 651081846 /nfs/dbraw/zinc/08/18/46/651081846.db2.gz QUTZKRVBTYRIAE-HNNXBMFYSA-N 1 2 312.417 2.136 20 10 DECDLO COc1ccc(N(C)CC[N@H+](C)CC(=O)OC(C)(C)C)cc1 ZINC000844399444 651122833 /nfs/dbraw/zinc/12/28/33/651122833.db2.gz JPHHLNPAPREXFP-UHFFFAOYSA-N 1 2 308.422 2.405 20 10 DECDLO COc1ccc(N(C)CC[N@@H+](C)CC(=O)OC(C)(C)C)cc1 ZINC000844399444 651122835 /nfs/dbraw/zinc/12/28/35/651122835.db2.gz JPHHLNPAPREXFP-UHFFFAOYSA-N 1 2 308.422 2.405 20 10 DECDLO COC(=O)[C@H]([NH2+]Cc1ccccc1O)[C@H]1CCC[C@H](OC)C1 ZINC000846109724 651308325 /nfs/dbraw/zinc/30/83/25/651308325.db2.gz VETCRUXUBJSRRG-DUVNUKRYSA-N 1 2 307.390 2.229 20 10 DECDLO COC(=O)[C@H]([NH2+]Cc1ccccc1O)[C@@H]1CCC[C@@H](OC)C1 ZINC000846109727 651308341 /nfs/dbraw/zinc/30/83/41/651308341.db2.gz VETCRUXUBJSRRG-XNRPHZJLSA-N 1 2 307.390 2.229 20 10 DECDLO CCc1cccc(C[N@@H+]2CCO[C@H](C(=O)OC(C)(C)C)C2)c1O ZINC000848887739 651546570 /nfs/dbraw/zinc/54/65/70/651546570.db2.gz CVUWMHBMQKOQNX-HNNXBMFYSA-N 1 2 321.417 2.497 20 10 DECDLO CCc1cccc(C[N@H+]2CCO[C@H](C(=O)OC(C)(C)C)C2)c1O ZINC000848887739 651546573 /nfs/dbraw/zinc/54/65/73/651546573.db2.gz CVUWMHBMQKOQNX-HNNXBMFYSA-N 1 2 321.417 2.497 20 10 DECDLO Cn1cc(Br)c(C[NH2+]Cc2ccc3c(c2)CCO3)n1 ZINC000393331815 685451369 /nfs/dbraw/zinc/45/13/69/685451369.db2.gz LSECBORZTHFCGG-UHFFFAOYSA-N 1 2 322.206 2.407 20 10 DECDLO Oc1cccc2c1CN(c1cc(N3CCSCC3)[nH+]cn1)C2 ZINC000866117642 687452438 /nfs/dbraw/zinc/45/24/38/687452438.db2.gz QHIRAQGVGPPBMJ-UHFFFAOYSA-N 1 2 314.414 2.256 20 10 DECDLO Oc1cccc2c1CN(c1cc(N3CCSCC3)nc[nH+]1)C2 ZINC000866117642 687452442 /nfs/dbraw/zinc/45/24/42/687452442.db2.gz QHIRAQGVGPPBMJ-UHFFFAOYSA-N 1 2 314.414 2.256 20 10 DECDLO CN(CCO)c1ccc(NCc2ccc(F)c(F)c2O)[nH+]c1 ZINC000877095965 690017298 /nfs/dbraw/zinc/01/72/98/690017298.db2.gz WKVPAGKXVQOJED-UHFFFAOYSA-N 1 2 309.316 2.106 20 10 DECDLO CCOC(=O)C[N@H+](Cc1cc[nH]c(=O)c1)Cc1ccccc1O ZINC000878728667 690487065 /nfs/dbraw/zinc/48/70/65/690487065.db2.gz RDJXQPNFTKIJGY-UHFFFAOYSA-N 1 2 316.357 2.058 20 10 DECDLO CCOC(=O)C[N@@H+](Cc1cc[nH]c(=O)c1)Cc1ccccc1O ZINC000878728667 690487068 /nfs/dbraw/zinc/48/70/68/690487068.db2.gz RDJXQPNFTKIJGY-UHFFFAOYSA-N 1 2 316.357 2.058 20 10 DECDLO C[C@@H]1CC[N@H+](Cc2ccc(N)cc2)C[C@@H]1NC(=O)C(F)(F)F ZINC001345160439 1150869557 /nfs/dbraw/zinc/86/95/57/1150869557.db2.gz VXLXCCQSINKCBR-MFKMUULPSA-N 1 2 315.339 2.158 20 10 DECDLO C[C@@H]1CC[N@@H+](Cc2ccc(N)cc2)C[C@@H]1NC(=O)C(F)(F)F ZINC001345160439 1150869562 /nfs/dbraw/zinc/86/95/62/1150869562.db2.gz VXLXCCQSINKCBR-MFKMUULPSA-N 1 2 315.339 2.158 20 10 DECDLO C[C@@H]1C[N@H+](Cc2cc(Br)c(F)cc2O)CC[C@H]1O ZINC001144298957 790849691 /nfs/dbraw/zinc/84/96/91/790849691.db2.gz MRNGUPNSIFSCKV-PRHODGIISA-N 1 2 318.186 2.497 20 10 DECDLO C[C@@H]1C[N@@H+](Cc2cc(Br)c(F)cc2O)CC[C@H]1O ZINC001144298957 790849704 /nfs/dbraw/zinc/84/97/04/790849704.db2.gz MRNGUPNSIFSCKV-PRHODGIISA-N 1 2 318.186 2.497 20 10 DECDLO Cc1nonc1[C@@H](C)[NH2+]Cc1ccc(N2CCOCC2)c(F)c1 ZINC000826553908 783651607 /nfs/dbraw/zinc/65/16/07/783651607.db2.gz VXRIRGLGBBHAQV-LLVKDONJSA-N 1 2 320.368 2.205 20 10 DECDLO Oc1c(F)cc(Br)cc1C[NH2+][C@H]1CCC[C@@H]1O ZINC000715817844 792524625 /nfs/dbraw/zinc/52/46/25/792524625.db2.gz KEFPEJWHWGMKNM-QWRGUYRKSA-N 1 2 304.159 2.297 20 10 DECDLO O=C(NCc1ccccc1O)[C@@H]1CCCN(c2cccc[nH+]2)C1 ZINC001176970284 794543467 /nfs/dbraw/zinc/54/34/67/794543467.db2.gz LNQYSEWZHWUZJP-OAHLLOKOSA-N 1 2 311.385 2.320 20 10 DECDLO C[C@@H](C(=O)NCc1cc(Br)ccc1O)n1cc[nH+]c1 ZINC001117460476 795071132 /nfs/dbraw/zinc/07/11/32/795071132.db2.gz WTWRRIMMYBBJAN-VIFPVBQESA-N 1 2 324.178 2.229 20 10 DECDLO Oc1cccc(F)c1C[NH+]1CCN(c2ncccc2F)CC1 ZINC001137841924 796145697 /nfs/dbraw/zinc/14/56/97/796145697.db2.gz ZYYUWAVURRILPH-UHFFFAOYSA-N 1 2 305.328 2.388 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CCCC2(COC2)C1 ZINC001139124583 796326123 /nfs/dbraw/zinc/32/61/23/796326123.db2.gz CKEFCNAVPIHPMC-UHFFFAOYSA-N 1 2 315.369 2.419 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CCCC2(COC2)C1 ZINC001139124583 796326128 /nfs/dbraw/zinc/32/61/28/796326128.db2.gz CKEFCNAVPIHPMC-UHFFFAOYSA-N 1 2 315.369 2.419 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CCOC[C@@H](C)C1 ZINC001139126379 796328099 /nfs/dbraw/zinc/32/80/99/796328099.db2.gz FHQSWUHMDJTDAY-NSHDSACASA-N 1 2 303.358 2.275 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CCOC[C@@H](C)C1 ZINC001139126379 796328104 /nfs/dbraw/zinc/32/81/04/796328104.db2.gz FHQSWUHMDJTDAY-NSHDSACASA-N 1 2 303.358 2.275 20 10 DECDLO Cn1ncc2c1C[N@H+](Cc1c(O)cccc1Br)CC2 ZINC001140103519 796476832 /nfs/dbraw/zinc/47/68/32/796476832.db2.gz MZMIRLTWVOKVOV-UHFFFAOYSA-N 1 2 322.206 2.447 20 10 DECDLO Cn1ncc2c1C[N@@H+](Cc1c(O)cccc1Br)CC2 ZINC001140103519 796476836 /nfs/dbraw/zinc/47/68/36/796476836.db2.gz MZMIRLTWVOKVOV-UHFFFAOYSA-N 1 2 322.206 2.447 20 10 DECDLO CCOC(=O)c1nc2c(o1)CC[N@H+](Cc1cc(C)ccc1O)C2 ZINC001140623360 796546977 /nfs/dbraw/zinc/54/69/77/796546977.db2.gz OLRMMXJQUCMRDT-UHFFFAOYSA-N 1 2 316.357 2.424 20 10 DECDLO CCOC(=O)c1nc2c(o1)CC[N@@H+](Cc1cc(C)ccc1O)C2 ZINC001140623360 796546981 /nfs/dbraw/zinc/54/69/81/796546981.db2.gz OLRMMXJQUCMRDT-UHFFFAOYSA-N 1 2 316.357 2.424 20 10 DECDLO Oc1ccc(O)c(C[N@@H+]2CCO[C@@H](COc3ccccc3)C2)c1 ZINC001141161724 796642883 /nfs/dbraw/zinc/64/28/83/796642883.db2.gz VNGLCMGBJKNMGH-QGZVFWFLSA-N 1 2 315.369 2.378 20 10 DECDLO Oc1ccc(O)c(C[N@H+]2CCO[C@@H](COc3ccccc3)C2)c1 ZINC001141161724 796642887 /nfs/dbraw/zinc/64/28/87/796642887.db2.gz VNGLCMGBJKNMGH-QGZVFWFLSA-N 1 2 315.369 2.378 20 10 DECDLO Oc1ccc(O)c(C[N@@H+]2CCO[C@H](COc3ccccc3)C2)c1 ZINC001141161723 796643211 /nfs/dbraw/zinc/64/32/11/796643211.db2.gz VNGLCMGBJKNMGH-KRWDZBQOSA-N 1 2 315.369 2.378 20 10 DECDLO Oc1ccc(O)c(C[N@H+]2CCO[C@H](COc3ccccc3)C2)c1 ZINC001141161723 796643212 /nfs/dbraw/zinc/64/32/12/796643212.db2.gz VNGLCMGBJKNMGH-KRWDZBQOSA-N 1 2 315.369 2.378 20 10 DECDLO CN(C)c1ccc(CN(C)c2ccc(Cn3cncn3)c[nH+]2)cc1 ZINC001156920695 798109728 /nfs/dbraw/zinc/10/97/28/798109728.db2.gz IPNCJVRZSYXJLW-UHFFFAOYSA-N 1 2 322.416 2.424 20 10 DECDLO COc1ccc(N2CC[NH+](Cc3cncc(C)n3)CC2)c(C)c1 ZINC001203176740 798260203 /nfs/dbraw/zinc/26/02/03/798260203.db2.gz IKMGRFHHWVYYQD-UHFFFAOYSA-N 1 2 312.417 2.424 20 10 DECDLO CC(C)COC[C@@H](O)C[NH2+]Cc1cc(Cl)cc(F)c1O ZINC001199722556 798526451 /nfs/dbraw/zinc/52/64/51/798526451.db2.gz SRRVAMNOAZCMKI-LBPRGKRZSA-N 1 2 305.777 2.308 20 10 DECDLO CC[C@H](C)[C@@H](C(=O)OC)[N@H+](C)Cc1cc(O)c(O)c(OC)c1 ZINC001204349737 800206937 /nfs/dbraw/zinc/20/69/37/800206937.db2.gz WJNYNUUZVCVHNE-HZMBPMFUSA-N 1 2 311.378 2.126 20 10 DECDLO CC[C@H](C)[C@@H](C(=O)OC)[N@@H+](C)Cc1cc(O)c(O)c(OC)c1 ZINC001204349737 800206941 /nfs/dbraw/zinc/20/69/41/800206941.db2.gz WJNYNUUZVCVHNE-HZMBPMFUSA-N 1 2 311.378 2.126 20 10 DECDLO O=C1[C@H]2C[N@H+](Cc3cccc(Cl)c3O)C[C@H]2CN1CC1CC1 ZINC001231910425 801749249 /nfs/dbraw/zinc/74/92/49/801749249.db2.gz PHBXKHBVKLNZMM-KBPBESRZSA-N 1 2 320.820 2.346 20 10 DECDLO O=C1[C@H]2C[N@@H+](Cc3cccc(Cl)c3O)C[C@H]2CN1CC1CC1 ZINC001231910425 801749252 /nfs/dbraw/zinc/74/92/52/801749252.db2.gz PHBXKHBVKLNZMM-KBPBESRZSA-N 1 2 320.820 2.346 20 10 DECDLO CN1C(=O)CC[C@H]2C[N@@H+](Cc3cccc(Cl)c3O)CC[C@@H]21 ZINC001231913907 801749619 /nfs/dbraw/zinc/74/96/19/801749619.db2.gz UERFYRQVMVNXHV-FZMZJTMJSA-N 1 2 308.809 2.488 20 10 DECDLO CN1C(=O)CC[C@H]2C[N@H+](Cc3cccc(Cl)c3O)CC[C@@H]21 ZINC001231913907 801749626 /nfs/dbraw/zinc/74/96/26/801749626.db2.gz UERFYRQVMVNXHV-FZMZJTMJSA-N 1 2 308.809 2.488 20 10 DECDLO Cc1ccccc1N1CC[NH+](Cc2cc(O)c(O)c(O)c2)CC1 ZINC001233009860 802000382 /nfs/dbraw/zinc/00/03/82/802000382.db2.gz FAKHKXINSVTIAN-UHFFFAOYSA-N 1 2 314.385 2.434 20 10 DECDLO C[C@@H]1C[N@H+](Cc2c(O)cc(Br)cc2F)CC[C@@H]1O ZINC001233028316 802007064 /nfs/dbraw/zinc/00/70/64/802007064.db2.gz NFYFIOKQUPMYKQ-PELKAZGASA-N 1 2 318.186 2.497 20 10 DECDLO C[C@@H]1C[N@@H+](Cc2c(O)cc(Br)cc2F)CC[C@@H]1O ZINC001233028316 802007068 /nfs/dbraw/zinc/00/70/68/802007068.db2.gz NFYFIOKQUPMYKQ-PELKAZGASA-N 1 2 318.186 2.497 20 10 DECDLO Oc1c(C[N@@H+]2CCCN(c3ncccn3)CC2)ccc(F)c1F ZINC001233077684 802021275 /nfs/dbraw/zinc/02/12/75/802021275.db2.gz WLSAHBMJWUOZLN-UHFFFAOYSA-N 1 2 320.343 2.173 20 10 DECDLO CC(=O)N1CCC[N@@H+](Cc2cccc(C(F)(F)F)c2O)CC1 ZINC001233415577 802112285 /nfs/dbraw/zinc/11/22/85/802112285.db2.gz BHJOCPIORRTUGB-UHFFFAOYSA-N 1 2 316.323 2.465 20 10 DECDLO O=C(Nc1ccn(-c2cc[nH+]cc2)n1)c1c(F)ccc(O)c1O ZINC001472511249 1060525987 /nfs/dbraw/zinc/52/59/87/1060525987.db2.gz UDSIMDZKFFMCMU-UHFFFAOYSA-N 1 2 314.276 2.070 20 10 DECDLO O=C(NCc1ccc(O)cc1O)c1ccc(Cn2cc[nH+]c2)cc1 ZINC001570462299 1066083391 /nfs/dbraw/zinc/08/33/91/1066083391.db2.gz MZNYPYHPYBKAQK-UHFFFAOYSA-N 1 2 323.352 2.273 20 10 DECDLO Nc1ccc(CNC(=O)C[C@@H](n2cc[nH+]c2)C(F)(F)F)cc1 ZINC001515331665 1068862930 /nfs/dbraw/zinc/86/29/30/1068862930.db2.gz GBQWINSNQGUTGR-GFCCVEGCSA-N 1 2 312.295 2.275 20 10 DECDLO Cc1[nH+]c[nH]c1CC(=O)NCc1cccc(Br)c1O ZINC001556480504 1075033461 /nfs/dbraw/zinc/03/34/61/1075033461.db2.gz UETLATSTDBYUHC-UHFFFAOYSA-N 1 2 324.178 2.045 20 10 DECDLO C[C@H]([NH2+][C@@H]1C[C@@H](C)O[C@@H](C)C1)c1cccc(-c2nn[nH]n2)c1O ZINC001590203871 1076582700 /nfs/dbraw/zinc/58/27/00/1076582700.db2.gz XEEXSDBEPCTWQQ-USZNOCQGSA-N 1 2 317.393 2.179 20 10 DECDLO C[C@H](C[NH2+]Cc1cc(Cl)cc(F)c1O)CN1CCOCC1 ZINC001655696389 1080014158 /nfs/dbraw/zinc/01/41/58/1080014158.db2.gz MQMOKBXUQHVBCP-LLVKDONJSA-N 1 2 316.804 2.243 20 10 DECDLO C[C@H]1CC[N@H+](Cc2cc(Br)cc(F)c2O)C[C@@H]1O ZINC001659120735 1080231269 /nfs/dbraw/zinc/23/12/69/1080231269.db2.gz YQXRKKWWIUOLKW-UFBFGSQYSA-N 1 2 318.186 2.497 20 10 DECDLO C[C@H]1CC[N@@H+](Cc2cc(Br)cc(F)c2O)C[C@@H]1O ZINC001659120735 1080231276 /nfs/dbraw/zinc/23/12/76/1080231276.db2.gz YQXRKKWWIUOLKW-UFBFGSQYSA-N 1 2 318.186 2.497 20 10 DECDLO CCc1cccc(C[NH2+]Cc2nc(C(F)(F)F)n[nH]2)c1O ZINC001659143563 1080232470 /nfs/dbraw/zinc/23/24/70/1080232470.db2.gz IOZFQHXMBQZOBZ-UHFFFAOYSA-N 1 2 300.284 2.381 20 10 DECDLO C[C@@H]([NH2+]Cc1c(O)cccc1Br)c1nncn1C ZINC000706829141 1086652640 /nfs/dbraw/zinc/65/26/40/1086652640.db2.gz MCOPTZWRYPUBRO-MRVPVSSYSA-N 1 2 311.183 2.134 20 10 DECDLO C[N@H+]1C[C@H]2CN(Cc3cccc(C(C)(C)C)c3O)C[C@@H](C1)O2 ZINC001275799756 1092152805 /nfs/dbraw/zinc/15/28/05/1092152805.db2.gz SGUAIUALMCOHOM-GASCZTMLSA-N 1 2 304.434 2.205 20 10 DECDLO C[N@@H+]1C[C@H]2CN(Cc3cccc(C(C)(C)C)c3O)C[C@@H](C1)O2 ZINC001275799756 1092152811 /nfs/dbraw/zinc/15/28/11/1092152811.db2.gz SGUAIUALMCOHOM-GASCZTMLSA-N 1 2 304.434 2.205 20 10 DECDLO CN(C)C(=O)C1C[NH+](Cc2c(O)ccc(Cl)c2Cl)C1 ZINC001237080924 1138500921 /nfs/dbraw/zinc/50/09/21/1138500921.db2.gz HPWKPEDTIBHOFF-UHFFFAOYSA-N 1 2 303.189 2.219 20 10 DECDLO O=C1CCC2(CC[NH+](Cc3cc(Cl)cc(F)c3O)CC2)N1 ZINC001237624022 1138721725 /nfs/dbraw/zinc/72/17/25/1138721725.db2.gz VBUGOLVEYQPQRQ-UHFFFAOYSA-N 1 2 312.772 2.429 20 10 DECDLO CCOc1ccc(N2CC[NH+](CC(=O)N(CC)CC)CC2)cc1 ZINC001340946849 1143504049 /nfs/dbraw/zinc/50/40/49/1143504049.db2.gz ZZMDNJKVCONGBB-UHFFFAOYSA-N 1 2 319.449 2.076 20 10 DECDLO Cc1nnc(C[N@@H+](Cc2ccccc2O)C[C@@H]2CCCO2)o1 ZINC000096971065 185394811 /nfs/dbraw/zinc/39/48/11/185394811.db2.gz CCGZFTQGZAAEJU-AWEZNQCLSA-N 1 2 303.362 2.265 20 10 DECDLO Cc1nnc(C[N@H+](Cc2ccccc2O)C[C@@H]2CCCO2)o1 ZINC000096971065 185394812 /nfs/dbraw/zinc/39/48/12/185394812.db2.gz CCGZFTQGZAAEJU-AWEZNQCLSA-N 1 2 303.362 2.265 20 10 DECDLO Oc1c(F)cccc1C[NH+]1CCN(Cc2ccncc2)CC1 ZINC000273766788 130164985 /nfs/dbraw/zinc/16/49/85/130164985.db2.gz QEHUZTWMPJVXCR-UHFFFAOYSA-N 1 2 301.365 2.244 20 10 DECDLO Cc1noc([C@H]2CCC[N@@H+]2Cc2cc3c(cc2O)OCO3)n1 ZINC000285076508 131135637 /nfs/dbraw/zinc/13/56/37/131135637.db2.gz JLSPKKYOTRMHGN-LLVKDONJSA-N 1 2 303.318 2.149 20 10 DECDLO Cc1noc([C@H]2CCC[N@H+]2Cc2cc3c(cc2O)OCO3)n1 ZINC000285076508 131135639 /nfs/dbraw/zinc/13/56/39/131135639.db2.gz JLSPKKYOTRMHGN-LLVKDONJSA-N 1 2 303.318 2.149 20 10 DECDLO COc1c(O)c(CN[C@H]2CC[N@@H+]3CCCC[C@@H]23)ccc1[N+](=O)[O-] ZINC000278948913 402889480 /nfs/dbraw/zinc/88/94/80/402889480.db2.gz YZLBMJUNQBVQPO-STQMWFEESA-N 1 2 321.377 2.025 20 10 DECDLO COc1c(O)c(CN[C@H]2CC[N@H+]3CCCC[C@@H]23)ccc1[N+](=O)[O-] ZINC000278948913 402889481 /nfs/dbraw/zinc/88/94/81/402889481.db2.gz YZLBMJUNQBVQPO-STQMWFEESA-N 1 2 321.377 2.025 20 10 DECDLO COc1c(O)c(C[NH2+][C@H]2CCN3CCCC[C@@H]23)ccc1[N+](=O)[O-] ZINC000278948913 402889482 /nfs/dbraw/zinc/88/94/82/402889482.db2.gz YZLBMJUNQBVQPO-STQMWFEESA-N 1 2 321.377 2.025 20 10 DECDLO CS(=O)(=O)[C@H]1CCC[N@H+](Cc2c(O)cccc2Cl)C1 ZINC000274140826 403030460 /nfs/dbraw/zinc/03/04/60/403030460.db2.gz QTZIPMLHWPKHJQ-JTQLQIEISA-N 1 2 303.811 2.055 20 10 DECDLO CS(=O)(=O)[C@H]1CCC[N@@H+](Cc2c(O)cccc2Cl)C1 ZINC000274140826 403030461 /nfs/dbraw/zinc/03/04/61/403030461.db2.gz QTZIPMLHWPKHJQ-JTQLQIEISA-N 1 2 303.811 2.055 20 10 DECDLO CCC[NH+](CCC)c1ccc(CN[C@@H](C(=O)OC)[C@@H](C)O)cc1 ZINC000276507248 403182213 /nfs/dbraw/zinc/18/22/13/403182213.db2.gz SQPLVKDTRUTGHR-RHSMWYFYSA-N 1 2 322.449 2.325 20 10 DECDLO CCN(CC)c1ccc(CNC(=O)CCn2cc[nH+]c2)cc1 ZINC000299650572 403563870 /nfs/dbraw/zinc/56/38/70/403563870.db2.gz KSOFUOJXWNLTON-UHFFFAOYSA-N 1 2 300.406 2.436 20 10 DECDLO COCCN1CC[C@H]([NH2+][C@@H](C)c2ccc(F)c(F)c2O)C1 ZINC000276930463 292543112 /nfs/dbraw/zinc/54/31/12/292543112.db2.gz ODXATXYGWRYRFT-QWRGUYRKSA-N 1 2 300.349 2.042 20 10 DECDLO C[C@@H]([NH2+][C@H]1C[C@@H](O)C1)c1cc(Br)cc(F)c1O ZINC000834905457 649859154 /nfs/dbraw/zinc/85/91/54/649859154.db2.gz IEEZHZKOBNHZGX-VDAHYXPESA-N 1 2 304.159 2.468 20 10 DECDLO C[C@H]1C[N@@H+](Cc2cc(F)cc(F)c2O)C[C@@]2(CCCOC2)O1 ZINC001350320540 1151343776 /nfs/dbraw/zinc/34/37/76/1151343776.db2.gz ZXVBVXNEGDCUMR-MEDUHNTESA-N 1 2 313.344 2.440 20 10 DECDLO COC(=O)[C@@H](CC(C)C)[NH2+]Cc1cc(OC)c(OC)cc1O ZINC000276361063 334076200 /nfs/dbraw/zinc/07/62/00/334076200.db2.gz ALXWMGFHEINCII-GFCCVEGCSA-N 1 2 311.378 2.087 20 10 DECDLO CC[N@H+](C/C=C/c1ccc(N(C)C)cc1)[C@H]1CCS(=O)(=O)C1 ZINC000835025024 649867879 /nfs/dbraw/zinc/86/78/79/649867879.db2.gz FQQRPAKGKJOROP-RTRPANQVSA-N 1 2 322.474 2.275 20 10 DECDLO CC[N@@H+](C/C=C/c1ccc(N(C)C)cc1)[C@H]1CCS(=O)(=O)C1 ZINC000835025024 649867880 /nfs/dbraw/zinc/86/78/80/649867880.db2.gz FQQRPAKGKJOROP-RTRPANQVSA-N 1 2 322.474 2.275 20 10 DECDLO Cc1[nH+]ccn1-c1ccc(NC(=O)c2cccc(O)c2O)cn1 ZINC000373836151 534766854 /nfs/dbraw/zinc/76/68/54/534766854.db2.gz KCBURRZDWJEUQB-UHFFFAOYSA-N 1 2 310.313 2.239 20 10 DECDLO Cn1cc(N2CC[NH+](Cc3cccc(Cl)c3O)CC2)cn1 ZINC000180241000 527252661 /nfs/dbraw/zinc/25/26/61/527252661.db2.gz HPJAOXIBPZVRMV-UHFFFAOYSA-N 1 2 306.797 2.101 20 10 DECDLO Cc1cc(N(C)C)ccc1CNC(=O)N[C@@H](C)Cn1cc[nH+]c1 ZINC000734524865 633386853 /nfs/dbraw/zinc/38/68/53/633386853.db2.gz DOEAQRDKGBZADZ-AWEZNQCLSA-N 1 2 315.421 2.145 20 10 DECDLO COC(=O)[C@@H]1[C@H]2CCC[C@@H]2C[N@@H+]1Cc1cc(F)cc(F)c1O ZINC000894531805 637092832 /nfs/dbraw/zinc/09/28/32/637092832.db2.gz DIMTVRZUYRTFMJ-LQJRIPTKSA-N 1 2 311.328 2.444 20 10 DECDLO COC(=O)[C@@H]1[C@H]2CCC[C@@H]2C[N@H+]1Cc1cc(F)cc(F)c1O ZINC000894531805 637092834 /nfs/dbraw/zinc/09/28/34/637092834.db2.gz DIMTVRZUYRTFMJ-LQJRIPTKSA-N 1 2 311.328 2.444 20 10 DECDLO CN(C)C(=O)[C@@H]1CC[N@H+](Cc2cc(Cl)cc(F)c2O)C1 ZINC000840958983 650394842 /nfs/dbraw/zinc/39/48/42/650394842.db2.gz XBVKBGGRRVYQKV-SECBINFHSA-N 1 2 300.761 2.095 20 10 DECDLO CN(C)C(=O)[C@@H]1CC[N@@H+](Cc2cc(Cl)cc(F)c2O)C1 ZINC000840958983 650394844 /nfs/dbraw/zinc/39/48/44/650394844.db2.gz XBVKBGGRRVYQKV-SECBINFHSA-N 1 2 300.761 2.095 20 10 DECDLO C[NH+]1CCN(c2ccc(C[NH2+]C[C@H]([NH3+])c3ccccc3)cc2)CC1 ZINC000841036900 650411068 /nfs/dbraw/zinc/41/10/68/650411068.db2.gz NVASARVDWMYTBJ-FQEVSTJZSA-N 1 2 324.472 2.228 20 10 DECDLO CC[C@H](CN1CCOCC1)[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000896617885 638609180 /nfs/dbraw/zinc/60/91/80/638609180.db2.gz LAMJYKYQTKPNIT-GFCCVEGCSA-N 1 2 316.804 2.385 20 10 DECDLO Oc1cc(F)c(Cl)cc1C[NH2+]CC1CC2(C1)OCCO2 ZINC000896908985 639062236 /nfs/dbraw/zinc/06/22/36/639062236.db2.gz MXXXBIUMFACUEE-UHFFFAOYSA-N 1 2 301.745 2.427 20 10 DECDLO C[C@H]([NH2+]CC(C)(C)N1CCOCC1)c1cc(F)cc(F)c1O ZINC000756369934 639655525 /nfs/dbraw/zinc/65/55/25/639655525.db2.gz DOPDFMMJNXPTAP-NSHDSACASA-N 1 2 314.376 2.432 20 10 DECDLO Cc1nc2n(n1)C[C@H]([NH2+][C@@H](C)c1cc(F)cc(F)c1O)CC2 ZINC000756535020 639670287 /nfs/dbraw/zinc/67/02/87/639670287.db2.gz MWENNVISQDVRSP-GZMMTYOYSA-N 1 2 308.332 2.236 20 10 DECDLO COC(=O)c1ccc(O)c([C@@H](C)[NH2+]Cc2nnc(C)s2)c1 ZINC000757637284 639861915 /nfs/dbraw/zinc/86/19/15/639861915.db2.gz HFADPBURZWERSX-MRVPVSSYSA-N 1 2 307.375 2.190 20 10 DECDLO CCC[C@H]1CN(C(=O)C2=CC(=O)CS2)CC[N@@H+]1CCOC ZINC000767153700 640949988 /nfs/dbraw/zinc/94/99/88/640949988.db2.gz UQHZPEKAXPEIRA-LBPRGKRZSA-N 1 2 312.435 2.027 20 10 DECDLO CCC[C@H]1CN(C(=O)C2=CC(=O)CS2)CC[N@H+]1CCOC ZINC000767153700 640949994 /nfs/dbraw/zinc/94/99/94/640949994.db2.gz UQHZPEKAXPEIRA-LBPRGKRZSA-N 1 2 312.435 2.027 20 10 DECDLO Cc1cc(O)c(C[NH+]2CCN(C)CCN(C)CC2)cc1Cl ZINC000897858886 640954045 /nfs/dbraw/zinc/95/40/45/640954045.db2.gz NXFHRXWUDBPMFB-UHFFFAOYSA-N 1 2 311.857 2.033 20 10 DECDLO CNC(=O)[C@@H]1CCC[N@H+](Cc2cc(Cl)cc(F)c2O)C1 ZINC000775698329 642081746 /nfs/dbraw/zinc/08/17/46/642081746.db2.gz OYBQMZKKIWHPCN-SECBINFHSA-N 1 2 300.761 2.143 20 10 DECDLO CNC(=O)[C@@H]1CCC[N@@H+](Cc2cc(Cl)cc(F)c2O)C1 ZINC000775698329 642081749 /nfs/dbraw/zinc/08/17/49/642081749.db2.gz OYBQMZKKIWHPCN-SECBINFHSA-N 1 2 300.761 2.143 20 10 DECDLO CCNC(=O)C[N@H+](C)Cc1cc(C)cc(Br)c1O ZINC000781899176 642796286 /nfs/dbraw/zinc/79/62/86/642796286.db2.gz HBSPOJOMXUQPLF-UHFFFAOYSA-N 1 2 315.211 2.031 20 10 DECDLO CCNC(=O)C[N@@H+](C)Cc1cc(C)cc(Br)c1O ZINC000781899176 642796290 /nfs/dbraw/zinc/79/62/90/642796290.db2.gz HBSPOJOMXUQPLF-UHFFFAOYSA-N 1 2 315.211 2.031 20 10 DECDLO NC(=O)[C@@H]1[C@H]2CCC[C@H]2C[N@@H+]1Cc1cc(Cl)cc(F)c1O ZINC000787422519 643493891 /nfs/dbraw/zinc/49/38/91/643493891.db2.gz DZYZZDFSURRUIY-QWRKXWFKSA-N 1 2 312.772 2.271 20 10 DECDLO NC(=O)[C@@H]1[C@H]2CCC[C@H]2C[N@H+]1Cc1cc(Cl)cc(F)c1O ZINC000787422519 643493896 /nfs/dbraw/zinc/49/38/96/643493896.db2.gz DZYZZDFSURRUIY-QWRKXWFKSA-N 1 2 312.772 2.271 20 10 DECDLO CC[C@H](C)[C@H]([NH2+][C@H]1CCN(c2ccc(OC)cc2)C1)C(=O)OC ZINC000905781446 644032678 /nfs/dbraw/zinc/03/26/78/644032678.db2.gz XORIFCALNFLFSE-ZQIUZPCESA-N 1 2 320.433 2.451 20 10 DECDLO CNC(=O)[C@@]1(C)CC[N@H+](Cc2cc(Cl)cc(F)c2O)C1 ZINC000797606038 644901261 /nfs/dbraw/zinc/90/12/61/644901261.db2.gz XXPMRQMQGHJWSQ-AWEZNQCLSA-N 1 2 300.761 2.143 20 10 DECDLO CNC(=O)[C@@]1(C)CC[N@@H+](Cc2cc(Cl)cc(F)c2O)C1 ZINC000797606038 644901267 /nfs/dbraw/zinc/90/12/67/644901267.db2.gz XXPMRQMQGHJWSQ-AWEZNQCLSA-N 1 2 300.761 2.143 20 10 DECDLO CCN(C)c1ccc(C[NH+]2CCC(c3n[nH]c(=O)[nH]3)CC2)cc1 ZINC000815109220 646970230 /nfs/dbraw/zinc/97/02/30/646970230.db2.gz WWMAWKTUYZJBKS-UHFFFAOYSA-N 1 2 315.421 2.346 20 10 DECDLO O=C(C[NH+]1CCCC1)NCc1cc(Cl)cc(Cl)c1O ZINC000822949991 648321479 /nfs/dbraw/zinc/32/14/79/648321479.db2.gz WEKXHYHHLFFKAH-UHFFFAOYSA-N 1 2 303.189 2.411 20 10 DECDLO COc1ccc(N2CCC[N@H+](CC(=O)OCC(C)C)CC2)cc1 ZINC000181436541 648656798 /nfs/dbraw/zinc/65/67/98/648656798.db2.gz BISZBEMLQXMSNX-UHFFFAOYSA-N 1 2 320.433 2.407 20 10 DECDLO COc1ccc(N2CCC[N@@H+](CC(=O)OCC(C)C)CC2)cc1 ZINC000181436541 648656800 /nfs/dbraw/zinc/65/68/00/648656800.db2.gz BISZBEMLQXMSNX-UHFFFAOYSA-N 1 2 320.433 2.407 20 10 DECDLO COc1c(O)c(C[N@@H+]2CCO[C@](C)(C3CC3)C2)ccc1[N+](=O)[O-] ZINC000826877177 648941554 /nfs/dbraw/zinc/94/15/54/648941554.db2.gz BWALUXKIJMFNLY-INIZCTEOSA-N 1 2 322.361 2.310 20 10 DECDLO COc1c(O)c(C[N@H+]2CCO[C@](C)(C3CC3)C2)ccc1[N+](=O)[O-] ZINC000826877177 648941555 /nfs/dbraw/zinc/94/15/55/648941555.db2.gz BWALUXKIJMFNLY-INIZCTEOSA-N 1 2 322.361 2.310 20 10 DECDLO Cc1nnc(C[N@@H+](C)Cc2ccc(Br)cc2O)o1 ZINC000827039139 648963015 /nfs/dbraw/zinc/96/30/15/648963015.db2.gz ICDDSKGQNYPOAM-UHFFFAOYSA-N 1 2 312.167 2.478 20 10 DECDLO Cc1nnc(C[N@H+](C)Cc2ccc(Br)cc2O)o1 ZINC000827039139 648963018 /nfs/dbraw/zinc/96/30/18/648963018.db2.gz ICDDSKGQNYPOAM-UHFFFAOYSA-N 1 2 312.167 2.478 20 10 DECDLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)NCc1c(O)ccc2c1CCCC2 ZINC000847590599 651404487 /nfs/dbraw/zinc/40/44/87/651404487.db2.gz BHNPXFGGSCIABD-LBPRGKRZSA-N 1 2 313.401 2.489 20 10 DECDLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)NCc1c(O)ccc2c1CCCC2 ZINC000847590599 651404488 /nfs/dbraw/zinc/40/44/88/651404488.db2.gz BHNPXFGGSCIABD-LBPRGKRZSA-N 1 2 313.401 2.489 20 10 DECDLO Cc1ccc(O)c(CNC(=O)NCCCNc2cccc[nH+]2)c1 ZINC000858231810 652285412 /nfs/dbraw/zinc/28/54/12/652285412.db2.gz WSFAHYHMQRGXEZ-UHFFFAOYSA-N 1 2 314.389 2.397 20 10 DECDLO C[C@H]([NH2+]CC(=O)NCc1ccc(N(C)C)cc1)c1cscn1 ZINC000852418221 652398793 /nfs/dbraw/zinc/39/87/93/652398793.db2.gz RLRSUDGNIZUQLM-LBPRGKRZSA-N 1 2 318.446 2.176 20 10 DECDLO COc1ccc(N2CC[C@H](Nc3[nH+]cnc4c3cnn4C)C2)cc1 ZINC000853759617 652600386 /nfs/dbraw/zinc/60/03/86/652600386.db2.gz XZZUSGUTFZUXBN-LBPRGKRZSA-N 1 2 324.388 2.063 20 10 DECDLO C[C@@H]([NH2+]Cc1nncs1)c1ccc(N2CCOCC2)cc1 ZINC000930210974 694113490 /nfs/dbraw/zinc/11/34/90/694113490.db2.gz RCIWXCSPOGTQBJ-GFCCVEGCSA-N 1 2 304.419 2.226 20 10 DECDLO COC(=O)c1cc(OCc2ccc[nH+]c2N)ccc1N(C)C ZINC000871794094 688870789 /nfs/dbraw/zinc/87/07/89/688870789.db2.gz MQPWNTVLJQXCDQ-UHFFFAOYSA-N 1 2 301.346 2.095 20 10 DECDLO Cc1ccc(C[N@@H+]2CCNC(=O)[C@H]2c2cccs2)c(O)c1 ZINC000876765364 689930330 /nfs/dbraw/zinc/93/03/30/689930330.db2.gz UIBWQRPDZSFVKH-OAHLLOKOSA-N 1 2 302.399 2.435 20 10 DECDLO Cc1ccc(C[N@H+]2CCNC(=O)[C@H]2c2cccs2)c(O)c1 ZINC000876765364 689930332 /nfs/dbraw/zinc/93/03/32/689930332.db2.gz UIBWQRPDZSFVKH-OAHLLOKOSA-N 1 2 302.399 2.435 20 10 DECDLO Oc1c(C[NH+]2CCC([C@@H](O)c3ncc[nH]3)CC2)ccc(F)c1F ZINC000877479717 690126287 /nfs/dbraw/zinc/12/62/87/690126287.db2.gz WXFSCALTKFHRAQ-OAHLLOKOSA-N 1 2 323.343 2.339 20 10 DECDLO C[C@H]([NH2+]Cc1ccc(N2CCC(O)CC2)cc1)c1csnn1 ZINC000877590152 690160627 /nfs/dbraw/zinc/16/06/27/690160627.db2.gz RXKVEHAVSPNZIL-LBPRGKRZSA-N 1 2 318.446 2.350 20 10 DECDLO C[C@@H]([NH2+]Cc1ccc(N2CCC(O)CC2)cc1)c1csnn1 ZINC000877590151 690160737 /nfs/dbraw/zinc/16/07/37/690160737.db2.gz RXKVEHAVSPNZIL-GFCCVEGCSA-N 1 2 318.446 2.350 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@H+]2CC[C@@H]3[C@H]2CCCN3C)c1O ZINC000880129751 690809328 /nfs/dbraw/zinc/80/93/28/690809328.db2.gz AIEZMPPJDNQSQT-HZPDHXFCSA-N 1 2 306.381 2.402 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@@H+]2CC[C@@H]3[C@H]2CCCN3C)c1O ZINC000880129751 690809333 /nfs/dbraw/zinc/80/93/33/690809333.db2.gz AIEZMPPJDNQSQT-HZPDHXFCSA-N 1 2 306.381 2.402 20 10 DECDLO CCOc1cccc(C[NH2+]Cc2nc(CSC)n[nH]2)c1O ZINC000886327756 692057523 /nfs/dbraw/zinc/05/75/23/692057523.db2.gz RAFHDMNMCVXYFU-UHFFFAOYSA-N 1 2 308.407 2.062 20 10 DECDLO CN(C)C(=O)OC1CC[NH+](Cc2cc(F)cc(F)c2O)CC1 ZINC000894862880 692989343 /nfs/dbraw/zinc/98/93/43/692989343.db2.gz KPLCUHYZZMGNBW-UHFFFAOYSA-N 1 2 314.332 2.333 20 10 DECDLO CON1CCC([NH2+]Cc2cccc(Br)c2O)CC1 ZINC000692085152 783070535 /nfs/dbraw/zinc/07/05/35/783070535.db2.gz NDVROKGGCPZELR-UHFFFAOYSA-N 1 2 315.211 2.270 20 10 DECDLO CSc1cc(NCCc2cc(O)c(O)cc2O)nc(C)[nH+]1 ZINC001168009834 779299504 /nfs/dbraw/zinc/29/95/04/779299504.db2.gz KFYDJTYHVZAVJF-UHFFFAOYSA-N 1 2 307.375 2.278 20 10 DECDLO Oc1c(F)cc(Cl)cc1C[NH2+]CCN1CCSCC1 ZINC001177790328 794752664 /nfs/dbraw/zinc/75/26/64/794752664.db2.gz BQHMYTWRUWLEOZ-UHFFFAOYSA-N 1 2 304.818 2.323 20 10 DECDLO COC(=O)C[C@@H]1C[N@H+](Cc2ccc(N3CCCC3)cc2)CCO1 ZINC001116442840 794956721 /nfs/dbraw/zinc/95/67/21/794956721.db2.gz SCHSNOBLXHVXOH-QGZVFWFLSA-N 1 2 318.417 2.051 20 10 DECDLO COC(=O)C[C@@H]1C[N@@H+](Cc2ccc(N3CCCC3)cc2)CCO1 ZINC001116442840 794956722 /nfs/dbraw/zinc/95/67/22/794956722.db2.gz SCHSNOBLXHVXOH-QGZVFWFLSA-N 1 2 318.417 2.051 20 10 DECDLO O=C(/C=C/c1ccc(O)c(O)c1)NCc1[nH]c2c([nH+]1)CCCC2 ZINC001178921913 795032134 /nfs/dbraw/zinc/03/21/34/795032134.db2.gz DDQLYZGNQMVGII-SOFGYWHQSA-N 1 2 313.357 2.029 20 10 DECDLO CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C[C@@H]([NH3+])C(F)F ZINC001122025832 795718727 /nfs/dbraw/zinc/71/87/27/795718727.db2.gz JGCGYNDPWURBOR-CQSZACIVSA-N 1 2 313.392 2.472 20 10 DECDLO CNc1cc(CNC(=O)NCc2ccc(N(C)C)cc2)cc[nH+]1 ZINC001123477508 795918842 /nfs/dbraw/zinc/91/88/42/795918842.db2.gz ZFUGRGQSAYLNHT-UHFFFAOYSA-N 1 2 313.405 2.189 20 10 DECDLO COC[C@H]1CCC[N@@H+]1Cc1c(O)ccc2c(C)cc(=O)oc21 ZINC001139126824 796327194 /nfs/dbraw/zinc/32/71/94/796327194.db2.gz RJXAAPUTTDUKNB-GFCCVEGCSA-N 1 2 303.358 2.418 20 10 DECDLO COC[C@H]1CCC[N@H+]1Cc1c(O)ccc2c(C)cc(=O)oc21 ZINC001139126824 796327197 /nfs/dbraw/zinc/32/71/97/796327197.db2.gz RJXAAPUTTDUKNB-GFCCVEGCSA-N 1 2 303.358 2.418 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1C[C@@H](O)CC[C@H]1C ZINC001139127473 796328861 /nfs/dbraw/zinc/32/88/61/796328861.db2.gz WPBPANNPJIBGGU-NEPJUHHUSA-N 1 2 303.358 2.152 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1C[C@@H](O)CC[C@H]1C ZINC001139127473 796328868 /nfs/dbraw/zinc/32/88/68/796328868.db2.gz WPBPANNPJIBGGU-NEPJUHHUSA-N 1 2 303.358 2.152 20 10 DECDLO Cn1cc2c(n1)CC[N@@H+](Cc1c(O)cccc1Br)C2 ZINC001140100873 796477325 /nfs/dbraw/zinc/47/73/25/796477325.db2.gz DTFDYZGPRFXRAB-UHFFFAOYSA-N 1 2 322.206 2.447 20 10 DECDLO Cn1cc2c(n1)CC[N@H+](Cc1c(O)cccc1Br)C2 ZINC001140100873 796477328 /nfs/dbraw/zinc/47/73/28/796477328.db2.gz DTFDYZGPRFXRAB-UHFFFAOYSA-N 1 2 322.206 2.447 20 10 DECDLO Cc1nccnc1O[C@H]1CC[N@H+](Cc2c(O)cc(F)cc2F)C1 ZINC001140585486 796541816 /nfs/dbraw/zinc/54/18/16/796541816.db2.gz KHNPRSXXZGVPCS-LBPRGKRZSA-N 1 2 321.327 2.422 20 10 DECDLO Cc1nccnc1O[C@H]1CC[N@@H+](Cc2c(O)cc(F)cc2F)C1 ZINC001140585486 796541819 /nfs/dbraw/zinc/54/18/19/796541819.db2.gz KHNPRSXXZGVPCS-LBPRGKRZSA-N 1 2 321.327 2.422 20 10 DECDLO CCn1nnc2c1CC[N@H+](Cc1ccc(C)cc1O)[C@@H]2COC ZINC001140951992 796606349 /nfs/dbraw/zinc/60/63/49/796606349.db2.gz AWSVBRRWXCFBHV-OAHLLOKOSA-N 1 2 316.405 2.058 20 10 DECDLO CCn1nnc2c1CC[N@@H+](Cc1ccc(C)cc1O)[C@@H]2COC ZINC001140951992 796606351 /nfs/dbraw/zinc/60/63/51/796606351.db2.gz AWSVBRRWXCFBHV-OAHLLOKOSA-N 1 2 316.405 2.058 20 10 DECDLO C[C@@H](CC(=O)NCc1ccc2cccnc2c1O)n1cc[nH+]c1 ZINC001162612292 799130859 /nfs/dbraw/zinc/13/08/59/799130859.db2.gz GMSOENIHSYEKPN-LBPRGKRZSA-N 1 2 310.357 2.404 20 10 DECDLO N[C@]1(C(F)(F)F)CC[N@H+](Cc2cc(Cl)c(O)cc2O)C1 ZINC001206237517 800494798 /nfs/dbraw/zinc/49/47/98/800494798.db2.gz JCCOVPCBHQZEMM-LLVKDONJSA-N 1 2 310.703 2.217 20 10 DECDLO N[C@]1(C(F)(F)F)CC[N@@H+](Cc2cc(Cl)c(O)cc2O)C1 ZINC001206237517 800494799 /nfs/dbraw/zinc/49/47/99/800494799.db2.gz JCCOVPCBHQZEMM-LLVKDONJSA-N 1 2 310.703 2.217 20 10 DECDLO Cc1cccc(C[N@@H+]2CCN(C(=O)OC(C)(C)C)C(=O)C2)c1O ZINC001231593913 801691926 /nfs/dbraw/zinc/69/19/26/801691926.db2.gz OFFBJOSFCLWNJM-UHFFFAOYSA-N 1 2 320.389 2.280 20 10 DECDLO Cc1cccc(C[N@H+]2CCN(C(=O)OC(C)(C)C)C(=O)C2)c1O ZINC001231593913 801691933 /nfs/dbraw/zinc/69/19/33/801691933.db2.gz OFFBJOSFCLWNJM-UHFFFAOYSA-N 1 2 320.389 2.280 20 10 DECDLO COC(=O)c1c(C[N@H+](C)Cc2ccncn2)c2ccccc2n1C ZINC001232411102 801872968 /nfs/dbraw/zinc/87/29/68/801872968.db2.gz ZREFYBNHMKFXBZ-UHFFFAOYSA-N 1 2 324.384 2.387 20 10 DECDLO COC(=O)c1c(C[N@@H+](C)Cc2ccncn2)c2ccccc2n1C ZINC001232411102 801872972 /nfs/dbraw/zinc/87/29/72/801872972.db2.gz ZREFYBNHMKFXBZ-UHFFFAOYSA-N 1 2 324.384 2.387 20 10 DECDLO OC[C@@H]1CCC[N@@H+]1Cc1c(O)cc(Br)cc1F ZINC001233028054 802006065 /nfs/dbraw/zinc/00/60/65/802006065.db2.gz HTXMFYNQOHFNJC-VIFPVBQESA-N 1 2 304.159 2.251 20 10 DECDLO OC[C@@H]1CCC[N@H+]1Cc1c(O)cc(Br)cc1F ZINC001233028054 802006067 /nfs/dbraw/zinc/00/60/67/802006067.db2.gz HTXMFYNQOHFNJC-VIFPVBQESA-N 1 2 304.159 2.251 20 10 DECDLO C[C@@]1(CO)CC[N@H+](Cc2c(O)cc(Br)cc2F)C1 ZINC001233028926 802007505 /nfs/dbraw/zinc/00/75/05/802007505.db2.gz VWUXBXRJSAINPO-CYBMUJFWSA-N 1 2 318.186 2.498 20 10 DECDLO C[C@@]1(CO)CC[N@@H+](Cc2c(O)cc(Br)cc2F)C1 ZINC001233028926 802007511 /nfs/dbraw/zinc/00/75/11/802007511.db2.gz VWUXBXRJSAINPO-CYBMUJFWSA-N 1 2 318.186 2.498 20 10 DECDLO CC(C)CC[C@H](CO)[NH2+][C@H](C)c1cccc(-c2nn[nH]n2)c1O ZINC001603278655 1069930282 /nfs/dbraw/zinc/93/02/82/1069930282.db2.gz RZEGMLNYZKUPGD-VXGBXAGGSA-N 1 2 319.409 2.020 20 10 DECDLO C[C@@H](C[NH2+][C@@H](C)c1cccc(-c2nn[nH]n2)c1O)c1ccccn1 ZINC001603552236 1069985557 /nfs/dbraw/zinc/98/55/57/1069985557.db2.gz UUIGQCYOKRQVPL-RYUDHWBXSA-N 1 2 324.388 2.422 20 10 DECDLO CC[C@@H]([NH2+]CC[C@H](C)CCO)c1cccc(-c2nn[nH]n2)c1O ZINC001604053414 1070187066 /nfs/dbraw/zinc/18/70/66/1070187066.db2.gz CBPOHHFDMOHHFA-SMDDNHRTSA-N 1 2 319.409 2.022 20 10 DECDLO CC[C@H]([NH2+]CCC[C@H](C)CO)c1cccc(-c2nn[nH]n2)c1O ZINC001604056590 1070191418 /nfs/dbraw/zinc/19/14/18/1070191418.db2.gz VCQNXUCEMMUBQM-FZMZJTMJSA-N 1 2 319.409 2.022 20 10 DECDLO CCOCCC[NH2+][C@@H](CC)c1cccc(-c2nn[nH]n2)c1O ZINC001604431098 1070385413 /nfs/dbraw/zinc/38/54/13/1070385413.db2.gz PRVAMGXKPGLLNW-ZDUSSCGKSA-N 1 2 305.382 2.040 20 10 DECDLO CO[C@@H]1C[C@H]([NH2+][C@H](C)c2cccc(-c3nn[nH]n3)c2O)C1(C)C ZINC001605025396 1070580175 /nfs/dbraw/zinc/58/01/75/1070580175.db2.gz UXADRESSZBXFKE-JIMOISOXSA-N 1 2 317.393 2.036 20 10 DECDLO CO[C@@H]1C[C@@H]([NH2+][C@H](C)c2cccc(-c3nn[nH]n3)c2O)C1(C)C ZINC001605025397 1070580469 /nfs/dbraw/zinc/58/04/69/1070580469.db2.gz UXADRESSZBXFKE-OASPWFOLSA-N 1 2 317.393 2.036 20 10 DECDLO NC(=O)[C@@H](F)C1CC[NH+](Cc2cccc(Cl)c2O)CC1 ZINC001462550816 1058848180 /nfs/dbraw/zinc/84/81/80/1058848180.db2.gz YKCOOJKKOYOZDQ-LBPRGKRZSA-N 1 2 300.761 2.081 20 10 DECDLO C[C@]1(CO)CC[N@H+](Cc2cc(F)cc(Br)c2O)C1 ZINC001235295697 1079010619 /nfs/dbraw/zinc/01/06/19/1079010619.db2.gz DTMQMQWFJOAHIU-ZDUSSCGKSA-N 1 2 318.186 2.498 20 10 DECDLO C[C@]1(CO)CC[N@@H+](Cc2cc(F)cc(Br)c2O)C1 ZINC001235295697 1079010628 /nfs/dbraw/zinc/01/06/28/1079010628.db2.gz DTMQMQWFJOAHIU-ZDUSSCGKSA-N 1 2 318.186 2.498 20 10 DECDLO CC(C)C[C@H](C(=O)NCc1c(O)cccc1O)n1cc[nH+]c1 ZINC001558536066 1075097791 /nfs/dbraw/zinc/09/77/91/1075097791.db2.gz RVUPLXHOZPILRG-CYBMUJFWSA-N 1 2 303.362 2.198 20 10 DECDLO C[C@@H](CN1CCCC1=O)[NH2+]Cc1cc(Cl)cc(F)c1O ZINC001620739392 1076109388 /nfs/dbraw/zinc/10/93/88/1076109388.db2.gz PJNSXDBEZWWMKQ-VIFPVBQESA-N 1 2 300.761 2.285 20 10 DECDLO CC[C@@H]([NH2+]C[C@]1(C)CCOC1)c1cccc(-c2nn[nH]n2)c1O ZINC001590462069 1076631540 /nfs/dbraw/zinc/63/15/40/1076631540.db2.gz ALNILPOQXTVSFD-CJNGLKHVSA-N 1 2 317.393 2.040 20 10 DECDLO CC[C@@H]([NH2+]C[C@@]1(C)CCOC1)c1cccc(-c2nn[nH]n2)c1O ZINC001590462070 1076631603 /nfs/dbraw/zinc/63/16/03/1076631603.db2.gz ALNILPOQXTVSFD-CZUORRHYSA-N 1 2 317.393 2.040 20 10 DECDLO CC[C@H]([NH2+]CC1(CC)COC1)c1cccc(-c2nn[nH]n2)c1O ZINC001590462827 1076631628 /nfs/dbraw/zinc/63/16/28/1076631628.db2.gz FXBMUSMTSWWOMT-ZDUSSCGKSA-N 1 2 317.393 2.040 20 10 DECDLO CC[C@H]([NH2+]C[C@@H](C)CCOC)c1cccc(-c2nn[nH]n2)c1O ZINC001590464871 1076632464 /nfs/dbraw/zinc/63/24/64/1076632464.db2.gz QSDGRFKTFZEDSG-FZMZJTMJSA-N 1 2 319.409 2.286 20 10 DECDLO CC[C@H]([NH2+]C[C@]1(C)CCCO1)c1cccc(-c2nn[nH]n2)c1O ZINC001590465123 1076633432 /nfs/dbraw/zinc/63/34/32/1076633432.db2.gz SPEMQAWVEZLJSQ-BBRMVZONSA-N 1 2 317.393 2.182 20 10 DECDLO Oc1c(F)cccc1C[N@@H+]1Cc2ccc(-c3nn[nH]n3)cc2C1 ZINC001593539080 1077019067 /nfs/dbraw/zinc/01/90/67/1077019067.db2.gz RLXOSOVDKFFCDB-UHFFFAOYSA-N 1 2 311.320 2.227 20 10 DECDLO Oc1c(F)cccc1C[N@H+]1Cc2ccc(-c3nn[nH]n3)cc2C1 ZINC001593539080 1077019070 /nfs/dbraw/zinc/01/90/70/1077019070.db2.gz RLXOSOVDKFFCDB-UHFFFAOYSA-N 1 2 311.320 2.227 20 10 DECDLO Oc1cc(Cl)c(Cl)cc1C[N@@H+]1CCN2CCOC[C@@H]2C1 ZINC001236792222 1079927027 /nfs/dbraw/zinc/92/70/27/1079927027.db2.gz CUWGWPJNRSXYQQ-NSHDSACASA-N 1 2 317.216 2.215 20 10 DECDLO Oc1cc(Cl)c(Cl)cc1C[N@H+]1CCN2CCOC[C@@H]2C1 ZINC001236792222 1079927031 /nfs/dbraw/zinc/92/70/31/1079927031.db2.gz CUWGWPJNRSXYQQ-NSHDSACASA-N 1 2 317.216 2.215 20 10 DECDLO CC(=O)N1CC[NH+](Cc2cc(C(F)(F)F)ccc2O)CC1 ZINC001237134737 1080443785 /nfs/dbraw/zinc/44/37/85/1080443785.db2.gz AFGJSNXEMUWMKY-UHFFFAOYSA-N 1 2 302.296 2.075 20 10 DECDLO C[C@@H](NC(=O)NCc1ccc[nH+]c1N)c1ccc(N(C)C)cc1 ZINC001671851939 1081543449 /nfs/dbraw/zinc/54/34/49/1081543449.db2.gz NDWTXCITHJGBRQ-GFCCVEGCSA-N 1 2 313.405 2.290 20 10 DECDLO CCOc1ccc(N2C[C@H]3CC[C@@H](C2)[N@H+]3COCCOC)cc1 ZINC001276925679 1083682600 /nfs/dbraw/zinc/68/26/00/1083682600.db2.gz GVRFCGDKGUTULJ-CALCHBBNSA-N 1 2 320.433 2.359 20 10 DECDLO CCOc1ccc(N2C[C@H]3CC[C@@H](C2)[N@@H+]3COCCOC)cc1 ZINC001276925679 1083682604 /nfs/dbraw/zinc/68/26/04/1083682604.db2.gz GVRFCGDKGUTULJ-CALCHBBNSA-N 1 2 320.433 2.359 20 10 DECDLO C[N@@H+](Cc1cc(Br)cc(F)c1O)CC1COC1 ZINC001235068157 1084295731 /nfs/dbraw/zinc/29/57/31/1084295731.db2.gz DIFRLFPBQZVXBP-UHFFFAOYSA-N 1 2 304.159 2.372 20 10 DECDLO C[N@H+](Cc1cc(Br)cc(F)c1O)CC1COC1 ZINC001235068157 1084295739 /nfs/dbraw/zinc/29/57/39/1084295739.db2.gz DIFRLFPBQZVXBP-UHFFFAOYSA-N 1 2 304.159 2.372 20 10 DECDLO CC(C)(C)c1cccc(C[N@@H+]2CCn3cnc(CO)c3C2)c1O ZINC001235501790 1084449054 /nfs/dbraw/zinc/44/90/54/1084449054.db2.gz MVCCJSIKVRUYCK-UHFFFAOYSA-N 1 2 315.417 2.394 20 10 DECDLO CC(C)(C)c1cccc(C[N@H+]2CCn3cnc(CO)c3C2)c1O ZINC001235501790 1084449057 /nfs/dbraw/zinc/44/90/57/1084449057.db2.gz MVCCJSIKVRUYCK-UHFFFAOYSA-N 1 2 315.417 2.394 20 10 DECDLO C[N@@H+]1CCC12CN(Cc1cc(Br)c(F)cc1O)C2 ZINC001275054880 1091531706 /nfs/dbraw/zinc/53/17/06/1091531706.db2.gz NTCHPUWNPZXLOU-UHFFFAOYSA-N 1 2 315.186 2.184 20 10 DECDLO C[N@H+]1CCC12CN(Cc1cc(Br)c(F)cc1O)C2 ZINC001275054880 1091531711 /nfs/dbraw/zinc/53/17/11/1091531711.db2.gz NTCHPUWNPZXLOU-UHFFFAOYSA-N 1 2 315.186 2.184 20 10 DECDLO CCN(CC)c1ccc(C[NH2+][C@H](C)c2nnnn2C)cc1F ZINC001308542366 1147479734 /nfs/dbraw/zinc/47/97/34/1147479734.db2.gz GRHGWYVWQCLEFA-LLVKDONJSA-N 1 2 306.389 2.046 20 10 DECDLO CC(=O)c1cc(F)cc(C[NH2+]C(C)(C)c2noc(C)n2)c1O ZINC000079431822 355309059 /nfs/dbraw/zinc/30/90/59/355309059.db2.gz RJAAFJQIYCFZFD-UHFFFAOYSA-N 1 2 307.325 2.450 20 10 DECDLO Nc1[nH+]cnc(NCc2ccc(N3CCOCC3)cc2)c1Cl ZINC000273153468 130093074 /nfs/dbraw/zinc/09/30/74/130093074.db2.gz XTGUWIGMQLGODL-UHFFFAOYSA-N 1 2 319.796 2.161 20 10 DECDLO Nc1nc[nH+]c(NCc2ccc(N3CCOCC3)cc2)c1Cl ZINC000273153468 130093076 /nfs/dbraw/zinc/09/30/76/130093076.db2.gz XTGUWIGMQLGODL-UHFFFAOYSA-N 1 2 319.796 2.161 20 10 DECDLO COc1cc(Cl)cc(C[N@@H+]2CCN(C(C)=O)C[C@@H]2C)c1O ZINC000273712682 130156323 /nfs/dbraw/zinc/15/63/23/130156323.db2.gz GKXVNPZVHJFYFG-JTQLQIEISA-N 1 2 312.797 2.107 20 10 DECDLO COc1cc(Cl)cc(C[N@H+]2CCN(C(C)=O)C[C@@H]2C)c1O ZINC000273712682 130156325 /nfs/dbraw/zinc/15/63/25/130156325.db2.gz GKXVNPZVHJFYFG-JTQLQIEISA-N 1 2 312.797 2.107 20 10 DECDLO CC(=O)c1cc(Cl)cc(C[N@H+]2CCC[C@H]2C(=O)N(C)C)c1O ZINC000177240163 402384668 /nfs/dbraw/zinc/38/46/68/402384668.db2.gz JVVAUKDUXZUURV-AWEZNQCLSA-N 1 2 324.808 2.301 20 10 DECDLO CC(=O)c1cc(Cl)cc(C[N@@H+]2CCC[C@H]2C(=O)N(C)C)c1O ZINC000177240163 402384670 /nfs/dbraw/zinc/38/46/70/402384670.db2.gz JVVAUKDUXZUURV-AWEZNQCLSA-N 1 2 324.808 2.301 20 10 DECDLO COc1cc(Cl)cc(C[N@@H+]2CCO[C@]3(CCOC3)C2)c1O ZINC000187533582 402503690 /nfs/dbraw/zinc/50/36/90/402503690.db2.gz LCAOMXIIBPRZNG-OAHLLOKOSA-N 1 2 313.781 2.046 20 10 DECDLO COc1cc(Cl)cc(C[N@H+]2CCO[C@]3(CCOC3)C2)c1O ZINC000187533582 402503692 /nfs/dbraw/zinc/50/36/92/402503692.db2.gz LCAOMXIIBPRZNG-OAHLLOKOSA-N 1 2 313.781 2.046 20 10 DECDLO CCN(Cc1ccc(N(C)C)cc1)c1[nH+]cnc2c1cnn2C ZINC000178785820 402539793 /nfs/dbraw/zinc/53/97/93/402539793.db2.gz GIBLDCITAAUXKC-UHFFFAOYSA-N 1 2 310.405 2.456 20 10 DECDLO OC[C@H](C[NH2+]Cc1cc(Cl)cc(Cl)c1O)[C@@H]1CCOC1 ZINC000280337511 402989834 /nfs/dbraw/zinc/98/98/34/402989834.db2.gz QZZFCQZHJYWRPK-KOLCDFICSA-N 1 2 320.216 2.434 20 10 DECDLO COC(=O)[C@@H]1C[C@@H](C)CC[N@@H+]1Cc1cc(OC)c(OC)cc1O ZINC000274951282 403098574 /nfs/dbraw/zinc/09/85/74/403098574.db2.gz SKRHPWIVGWYUTC-AAEUAGOBSA-N 1 2 323.389 2.183 20 10 DECDLO COC(=O)[C@@H]1C[C@@H](C)CC[N@H+]1Cc1cc(OC)c(OC)cc1O ZINC000274951282 403098576 /nfs/dbraw/zinc/09/85/76/403098576.db2.gz SKRHPWIVGWYUTC-AAEUAGOBSA-N 1 2 323.389 2.183 20 10 DECDLO COC(=O)C[N@@H+](Cc1cc(Cl)ccc1O)C[C@H](O)C(C)C ZINC000293029604 403387707 /nfs/dbraw/zinc/38/77/07/403387707.db2.gz WADHUOXMVJFWNL-AWEZNQCLSA-N 1 2 315.797 2.038 20 10 DECDLO COC(=O)C[N@H+](Cc1cc(Cl)ccc1O)C[C@H](O)C(C)C ZINC000293029604 403387710 /nfs/dbraw/zinc/38/77/10/403387710.db2.gz WADHUOXMVJFWNL-AWEZNQCLSA-N 1 2 315.797 2.038 20 10 DECDLO Cc1cc(C[N@H+](CCS(C)(=O)=O)C2CC2)ccc1N(C)C ZINC000293783978 403562967 /nfs/dbraw/zinc/56/29/67/403562967.db2.gz MAHMFYBLZSNZQV-UHFFFAOYSA-N 1 2 310.463 2.070 20 10 DECDLO Cc1cc(C[N@@H+](CCS(C)(=O)=O)C2CC2)ccc1N(C)C ZINC000293783978 403562968 /nfs/dbraw/zinc/56/29/68/403562968.db2.gz MAHMFYBLZSNZQV-UHFFFAOYSA-N 1 2 310.463 2.070 20 10 DECDLO CC[C@H]([NH2+][C@@H]1COC[C@H]1O)c1cc(Cl)cc(Cl)c1O ZINC000296029892 404058490 /nfs/dbraw/zinc/05/84/90/404058490.db2.gz STLIEVHVQPACQH-QJPTWQEYSA-N 1 2 306.189 2.499 20 10 DECDLO CCOCc1nc([C@H](C)[NH2+]Cc2ccc3c(c2)CCO3)no1 ZINC000291018262 404371593 /nfs/dbraw/zinc/37/15/93/404371593.db2.gz XOQIOSZLCNQYRZ-NSHDSACASA-N 1 2 303.362 2.392 20 10 DECDLO COC(=O)[C@H]1C[C@@H](C)CC[N@@H+]1Cc1cc(OC)c(OC)cc1O ZINC000274951287 277137919 /nfs/dbraw/zinc/13/79/19/277137919.db2.gz SKRHPWIVGWYUTC-WCQYABFASA-N 1 2 323.389 2.183 20 10 DECDLO COC(=O)[C@H]1C[C@@H](C)CC[N@H+]1Cc1cc(OC)c(OC)cc1O ZINC000274951287 277137920 /nfs/dbraw/zinc/13/79/20/277137920.db2.gz SKRHPWIVGWYUTC-WCQYABFASA-N 1 2 323.389 2.183 20 10 DECDLO Oc1cc2c(cc1C[N@@H+]1CCOC[C@@H]1c1ccco1)OCO2 ZINC000378343226 534449699 /nfs/dbraw/zinc/44/96/99/534449699.db2.gz SCOJKELYOHEDEX-GFCCVEGCSA-N 1 2 303.314 2.287 20 10 DECDLO Oc1cc2c(cc1C[N@H+]1CCOC[C@@H]1c1ccco1)OCO2 ZINC000378343226 534449706 /nfs/dbraw/zinc/44/97/06/534449706.db2.gz SCOJKELYOHEDEX-GFCCVEGCSA-N 1 2 303.314 2.287 20 10 DECDLO Cc1nonc1C[N@@H+](Cc1ccccc1O)C[C@H]1CCCO1 ZINC000265139533 526703954 /nfs/dbraw/zinc/70/39/54/526703954.db2.gz PTHXMDMUEVTPNP-CQSZACIVSA-N 1 2 303.362 2.265 20 10 DECDLO Cc1nonc1C[N@H+](Cc1ccccc1O)C[C@H]1CCCO1 ZINC000265139533 526703962 /nfs/dbraw/zinc/70/39/62/526703962.db2.gz PTHXMDMUEVTPNP-CQSZACIVSA-N 1 2 303.362 2.265 20 10 DECDLO CCO[C@@H]1C[C@@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2O)[C@]12CCCO2 ZINC000272721502 535410812 /nfs/dbraw/zinc/41/08/12/535410812.db2.gz XOVPTQVBOZDCID-BZUAXINKSA-N 1 2 322.361 2.117 20 10 DECDLO CNc1cc(N2CCCN(c3ccc(OC)cc3)CC2)nc[nH+]1 ZINC000891934411 624669251 /nfs/dbraw/zinc/66/92/51/624669251.db2.gz SJHUKBKPFCJLJL-UHFFFAOYSA-N 1 2 313.405 2.244 20 10 DECDLO CNc1cc(N2CCCN(c3ccc(OC)cc3)CC2)[nH+]cn1 ZINC000891934411 624669254 /nfs/dbraw/zinc/66/92/54/624669254.db2.gz SJHUKBKPFCJLJL-UHFFFAOYSA-N 1 2 313.405 2.244 20 10 DECDLO Cc1[nH+]c[nH]c1CC(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C ZINC000840555328 650320800 /nfs/dbraw/zinc/32/08/00/650320800.db2.gz NUIRLDIFLYGTSG-CYBMUJFWSA-N 1 2 314.433 2.382 20 10 DECDLO COc1cccc(CNC(=O)NCc2c[nH+]c(C)cc2C)c1O ZINC000838720403 637638855 /nfs/dbraw/zinc/63/88/55/637638855.db2.gz PWWRAXJPFFZYDA-UHFFFAOYSA-N 1 2 315.373 2.412 20 10 DECDLO Cc1cc(N(C)C)ccc1CNc1ccc(N(C)CCO)c[nH+]1 ZINC000840880353 650370065 /nfs/dbraw/zinc/37/00/65/650370065.db2.gz VTGPNEPQYXXFPV-UHFFFAOYSA-N 1 2 314.433 2.497 20 10 DECDLO CN(C)c1cc(F)c(C[N@@H+]2CCNC(=O)CC2(C)C)cc1F ZINC000895400847 638004870 /nfs/dbraw/zinc/00/48/70/638004870.db2.gz XNKPGMNTTPCVMM-UHFFFAOYSA-N 1 2 311.376 2.131 20 10 DECDLO CN(C)c1cc(F)c(C[N@H+]2CCNC(=O)CC2(C)C)cc1F ZINC000895400847 638004875 /nfs/dbraw/zinc/00/48/75/638004875.db2.gz XNKPGMNTTPCVMM-UHFFFAOYSA-N 1 2 311.376 2.131 20 10 DECDLO Oc1cccc(F)c1CNc1cc(N2CCSCC2)nc[nH+]1 ZINC000895833546 638225077 /nfs/dbraw/zinc/22/50/77/638225077.db2.gz ZKCDGSYSJLCRER-UHFFFAOYSA-N 1 2 320.393 2.487 20 10 DECDLO Oc1cccc(F)c1CNc1cc(N2CCSCC2)[nH+]cn1 ZINC000895833546 638225082 /nfs/dbraw/zinc/22/50/82/638225082.db2.gz ZKCDGSYSJLCRER-UHFFFAOYSA-N 1 2 320.393 2.487 20 10 DECDLO COc1ccc([N@H+](CCCN2C(=O)CNC2=O)CC(C)C)cc1 ZINC000746170043 638319009 /nfs/dbraw/zinc/31/90/09/638319009.db2.gz LRDKWXKOUVNUCM-UHFFFAOYSA-N 1 2 319.405 2.100 20 10 DECDLO COc1ccc([N@@H+](CCCN2C(=O)CNC2=O)CC(C)C)cc1 ZINC000746170043 638319016 /nfs/dbraw/zinc/31/90/16/638319016.db2.gz LRDKWXKOUVNUCM-UHFFFAOYSA-N 1 2 319.405 2.100 20 10 DECDLO O=C1N[C@@H](C2CC[NH+](Cc3cccc(Cl)c3O)CC2)CO1 ZINC000897022100 639134832 /nfs/dbraw/zinc/13/48/32/639134832.db2.gz DBGUXVNEOIZGBB-CYBMUJFWSA-N 1 2 310.781 2.366 20 10 DECDLO COC(=O)/C(C)=C/C[NH+]1CCN(c2ccc(OC)c(F)c2)CC1 ZINC000753857400 639349874 /nfs/dbraw/zinc/34/98/74/639349874.db2.gz LHXPQTZMGDLQRC-AWNIVKPZSA-N 1 2 322.380 2.076 20 10 DECDLO COCCN1CCC[C@@H]1C[NH2+][C@H](C)c1cc(F)cc(F)c1O ZINC000756531833 639669612 /nfs/dbraw/zinc/66/96/12/639669612.db2.gz BEHOGKPZBCKIQD-DGCLKSJQSA-N 1 2 314.376 2.432 20 10 DECDLO COCCN1CC[C@@H]([NH2+][C@H](C)c2cc(F)cc(F)c2O)C1 ZINC000756549756 639673091 /nfs/dbraw/zinc/67/30/91/639673091.db2.gz HFNDBIREWZUFAJ-ZYHUDNBSSA-N 1 2 300.349 2.042 20 10 DECDLO CCOC(=O)C[N@H+](Cc1cc(OC)c(OC)cc1O)C1CCC1 ZINC000768530963 641093359 /nfs/dbraw/zinc/09/33/59/641093359.db2.gz QIRZGHLYXPCWJN-UHFFFAOYSA-N 1 2 323.389 2.327 20 10 DECDLO CCOC(=O)C[N@@H+](Cc1cc(OC)c(OC)cc1O)C1CCC1 ZINC000768530963 641093361 /nfs/dbraw/zinc/09/33/61/641093361.db2.gz QIRZGHLYXPCWJN-UHFFFAOYSA-N 1 2 323.389 2.327 20 10 DECDLO C[C@@H](Cn1cc[nH+]c1)NC(=O)N[C@@H](C)c1ccc(N(C)C)cc1 ZINC000773238774 641747208 /nfs/dbraw/zinc/74/72/08/641747208.db2.gz XBBRBHIAWPDJTB-KBPBESRZSA-N 1 2 315.421 2.398 20 10 DECDLO COc1c(O)c(CN2CC[N@H+](C)C[C@@H]2C(C)C)ccc1[N+](=O)[O-] ZINC000775058421 642002097 /nfs/dbraw/zinc/00/20/97/642002097.db2.gz YRTVXQJZKZVVDT-CQSZACIVSA-N 1 2 323.393 2.081 20 10 DECDLO COc1c(O)c(CN2CC[N@@H+](C)C[C@@H]2C(C)C)ccc1[N+](=O)[O-] ZINC000775058421 642002099 /nfs/dbraw/zinc/00/20/99/642002099.db2.gz YRTVXQJZKZVVDT-CQSZACIVSA-N 1 2 323.393 2.081 20 10 DECDLO COc1c(O)c(C[N@@H+]2CCN(C)C[C@@H]2C(C)C)ccc1[N+](=O)[O-] ZINC000775058421 642002103 /nfs/dbraw/zinc/00/21/03/642002103.db2.gz YRTVXQJZKZVVDT-CQSZACIVSA-N 1 2 323.393 2.081 20 10 DECDLO COc1c(O)c(C[N@H+]2CCN(C)C[C@@H]2C(C)C)ccc1[N+](=O)[O-] ZINC000775058421 642002108 /nfs/dbraw/zinc/00/21/08/642002108.db2.gz YRTVXQJZKZVVDT-CQSZACIVSA-N 1 2 323.393 2.081 20 10 DECDLO COc1c(O)c(C[N@H+](C)Cc2ccncc2)ccc1[N+](=O)[O-] ZINC000775059968 642002175 /nfs/dbraw/zinc/00/21/75/642002175.db2.gz CFPBXESXVBSNMI-UHFFFAOYSA-N 1 2 303.318 2.336 20 10 DECDLO COc1c(O)c(C[N@@H+](C)Cc2ccncc2)ccc1[N+](=O)[O-] ZINC000775059968 642002180 /nfs/dbraw/zinc/00/21/80/642002180.db2.gz CFPBXESXVBSNMI-UHFFFAOYSA-N 1 2 303.318 2.336 20 10 DECDLO CC(C)(C)NC(=O)N1CC[NH+](Cc2cc(F)ccc2O)CC1 ZINC000775982629 642119056 /nfs/dbraw/zinc/11/90/56/642119056.db2.gz BTZDGESUDDYSHQ-UHFFFAOYSA-N 1 2 309.385 2.157 20 10 DECDLO C[C@@H]1C[C@@H]1N1C[C@H]([NH2+]Cc2cc(Cl)cc(F)c2O)CC1=O ZINC000776221809 642145214 /nfs/dbraw/zinc/14/52/14/642145214.db2.gz ULSYXSZCYCQMET-DYLAAIIWSA-N 1 2 312.772 2.284 20 10 DECDLO CN(C)c1ccc2c(c1)OCCN2C(=O)c1cccc2[nH+]ccn21 ZINC000776969899 642220491 /nfs/dbraw/zinc/22/04/91/642220491.db2.gz COFRLFSRMPYUDE-UHFFFAOYSA-N 1 2 322.368 2.440 20 10 DECDLO COc1ccc(O)c([C@H](C)NC(=O)[C@H]2CCc3[nH+]ccn3C2)c1 ZINC000787131910 643456908 /nfs/dbraw/zinc/45/69/08/643456908.db2.gz UHFZVMKKLSTCHH-RYUDHWBXSA-N 1 2 315.373 2.037 20 10 DECDLO COCC[N@H+](Cc1cc(Cl)cc(F)c1O)[C@H]1CCOC1 ZINC000787333693 643483730 /nfs/dbraw/zinc/48/37/30/643483730.db2.gz AFSXMTTUIVDLRS-LBPRGKRZSA-N 1 2 303.761 2.422 20 10 DECDLO COCC[N@@H+](Cc1cc(Cl)cc(F)c1O)[C@H]1CCOC1 ZINC000787333693 643483733 /nfs/dbraw/zinc/48/37/33/643483733.db2.gz AFSXMTTUIVDLRS-LBPRGKRZSA-N 1 2 303.761 2.422 20 10 DECDLO NC(=O)C[N@H+](Cc1c(O)ccc(Cl)c1F)C1CCCC1 ZINC000792163383 644081830 /nfs/dbraw/zinc/08/18/30/644081830.db2.gz YRMORHUHDAVLSQ-UHFFFAOYSA-N 1 2 300.761 2.415 20 10 DECDLO NC(=O)C[N@@H+](Cc1c(O)ccc(Cl)c1F)C1CCCC1 ZINC000792163383 644081832 /nfs/dbraw/zinc/08/18/32/644081832.db2.gz YRMORHUHDAVLSQ-UHFFFAOYSA-N 1 2 300.761 2.415 20 10 DECDLO COC(=O)[C@@H](C)[N@H+](C)Cc1cc(C)cc(Br)c1O ZINC000793325402 644234884 /nfs/dbraw/zinc/23/48/84/644234884.db2.gz QRXQJMVNPBFHCI-SECBINFHSA-N 1 2 316.195 2.456 20 10 DECDLO COC(=O)[C@@H](C)[N@@H+](C)Cc1cc(C)cc(Br)c1O ZINC000793325402 644234888 /nfs/dbraw/zinc/23/48/88/644234888.db2.gz QRXQJMVNPBFHCI-SECBINFHSA-N 1 2 316.195 2.456 20 10 DECDLO COC(=O)[C@@H](C)[N@H+](C)Cc1cccc(Br)c1O ZINC000793324103 644235177 /nfs/dbraw/zinc/23/51/77/644235177.db2.gz HUUHPNNDCNLJJV-MRVPVSSYSA-N 1 2 302.168 2.148 20 10 DECDLO COC(=O)[C@@H](C)[N@@H+](C)Cc1cccc(Br)c1O ZINC000793324103 644235184 /nfs/dbraw/zinc/23/51/84/644235184.db2.gz HUUHPNNDCNLJJV-MRVPVSSYSA-N 1 2 302.168 2.148 20 10 DECDLO CC[C@@H]1C(=O)NCC[N@H+]1Cc1cc(OC)cc(C(C)(C)C)c1O ZINC000164304601 646434212 /nfs/dbraw/zinc/43/42/12/646434212.db2.gz BMZINQUDWMXIJX-OAHLLOKOSA-N 1 2 320.433 2.409 20 10 DECDLO CC[C@@H]1C(=O)NCC[N@@H+]1Cc1cc(OC)cc(C(C)(C)C)c1O ZINC000164304601 646434215 /nfs/dbraw/zinc/43/42/15/646434215.db2.gz BMZINQUDWMXIJX-OAHLLOKOSA-N 1 2 320.433 2.409 20 10 DECDLO CCCCNc1cc(NCCc2ccc(O)c(O)c2)nc(N)[nH+]1 ZINC000811810890 646580969 /nfs/dbraw/zinc/58/09/69/646580969.db2.gz HNJKPHFPRNSPBQ-UHFFFAOYSA-N 1 2 317.393 2.337 20 10 DECDLO CCCCNc1cc(NCCc2ccc(O)c(O)c2)[nH+]c(N)n1 ZINC000811810890 646580971 /nfs/dbraw/zinc/58/09/71/646580971.db2.gz HNJKPHFPRNSPBQ-UHFFFAOYSA-N 1 2 317.393 2.337 20 10 DECDLO CCN(C)c1ccc(C[N@@H+]2CCO[C@@H](C(=O)C3CC3)C2)cc1 ZINC000815094294 646967708 /nfs/dbraw/zinc/96/77/08/646967708.db2.gz IEOIKXLDCOJZMK-QGZVFWFLSA-N 1 2 302.418 2.323 20 10 DECDLO CCN(C)c1ccc(C[N@H+]2CCO[C@@H](C(=O)C3CC3)C2)cc1 ZINC000815094294 646967710 /nfs/dbraw/zinc/96/77/10/646967710.db2.gz IEOIKXLDCOJZMK-QGZVFWFLSA-N 1 2 302.418 2.323 20 10 DECDLO CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)Cn1cc[nH+]c1 ZINC000915215742 647495851 /nfs/dbraw/zinc/49/58/51/647495851.db2.gz HVLJALRBLAXJPF-UHFFFAOYSA-N 1 2 300.406 2.386 20 10 DECDLO CCN(C)C(=O)C[N@H+](Cc1ccco1)Cc1ccccc1O ZINC000732202458 647549488 /nfs/dbraw/zinc/54/94/88/647549488.db2.gz RAVUEOVVOMYMBB-UHFFFAOYSA-N 1 2 302.374 2.466 20 10 DECDLO CCN(C)C(=O)C[N@@H+](Cc1ccco1)Cc1ccccc1O ZINC000732202458 647549490 /nfs/dbraw/zinc/54/94/90/647549490.db2.gz RAVUEOVVOMYMBB-UHFFFAOYSA-N 1 2 302.374 2.466 20 10 DECDLO COc1ccc(O)c([C@@H](C)NC(=O)[C@@H]2C[C@H]2c2c[nH]c[nH+]2)c1 ZINC000821064677 647982746 /nfs/dbraw/zinc/98/27/46/647982746.db2.gz FTXFSGXONQICMH-OASPWFOLSA-N 1 2 301.346 2.105 20 10 DECDLO COc1ccc(O)c([C@@H](C)NC(=O)[C@@H]2C[C@H]2c2c[nH+]c[nH]2)c1 ZINC000821064677 647982749 /nfs/dbraw/zinc/98/27/49/647982749.db2.gz FTXFSGXONQICMH-OASPWFOLSA-N 1 2 301.346 2.105 20 10 DECDLO CCOC(=O)C[N@@H+](Cc1ccccc1O)C[C@@H]1CCC=CO1 ZINC000822512008 648222964 /nfs/dbraw/zinc/22/29/64/648222964.db2.gz RGSWKCCWHUKRCB-HNNXBMFYSA-N 1 2 305.374 2.450 20 10 DECDLO CCOC(=O)C[N@H+](Cc1ccccc1O)C[C@@H]1CCC=CO1 ZINC000822512008 648222967 /nfs/dbraw/zinc/22/29/67/648222967.db2.gz RGSWKCCWHUKRCB-HNNXBMFYSA-N 1 2 305.374 2.450 20 10 DECDLO COC(=O)C[N@H+](Cc1ccc(Br)cc1O)C1CC1 ZINC000824920452 648672644 /nfs/dbraw/zinc/67/26/44/648672644.db2.gz NXSTXIMMHSIYMS-UHFFFAOYSA-N 1 2 314.179 2.292 20 10 DECDLO COC(=O)C[N@@H+](Cc1ccc(Br)cc1O)C1CC1 ZINC000824920452 648672646 /nfs/dbraw/zinc/67/26/46/648672646.db2.gz NXSTXIMMHSIYMS-UHFFFAOYSA-N 1 2 314.179 2.292 20 10 DECDLO COC[C@]1(CO)CC[N@H+](Cc2cc(Cl)cc(F)c2O)C1 ZINC000825158734 648714061 /nfs/dbraw/zinc/71/40/61/648714061.db2.gz XTAUADIFZOISLA-CQSZACIVSA-N 1 2 303.761 2.016 20 10 DECDLO COC[C@]1(CO)CC[N@@H+](Cc2cc(Cl)cc(F)c2O)C1 ZINC000825158734 648714064 /nfs/dbraw/zinc/71/40/64/648714064.db2.gz XTAUADIFZOISLA-CQSZACIVSA-N 1 2 303.761 2.016 20 10 DECDLO Cc1cc(O)c(C[NH+]2CCN([C@@H]3CCOC3)CC2)cc1Cl ZINC000827125830 648976294 /nfs/dbraw/zinc/97/62/94/648976294.db2.gz RYWVMGXAFKANKQ-CQSZACIVSA-N 1 2 310.825 2.261 20 10 DECDLO Cc1cc(Cl)cc(C[NH+]2CCN(c3nccn3C)CC2)c1O ZINC000827884460 649099503 /nfs/dbraw/zinc/09/95/03/649099503.db2.gz CCWHRNNEJOQSOW-UHFFFAOYSA-N 1 2 320.824 2.410 20 10 DECDLO COc1ccc(N(C)CC[N@H+](C)Cn2cc[nH]c2=S)cc1 ZINC000844725568 651161179 /nfs/dbraw/zinc/16/11/79/651161179.db2.gz NAIGRTOOBYCYBS-UHFFFAOYSA-N 1 2 306.435 2.206 20 10 DECDLO COc1ccc(N(C)CC[N@@H+](C)Cn2cc[nH]c2=S)cc1 ZINC000844725568 651161180 /nfs/dbraw/zinc/16/11/80/651161180.db2.gz NAIGRTOOBYCYBS-UHFFFAOYSA-N 1 2 306.435 2.206 20 10 DECDLO COc1ccc(N(C)CC[N@H+](C)Cc2nccnc2OC)cc1 ZINC000846051045 651304559 /nfs/dbraw/zinc/30/45/59/651304559.db2.gz BBNYKWAOKYXWFE-UHFFFAOYSA-N 1 2 316.405 2.062 20 10 DECDLO COc1ccc(N(C)CC[N@@H+](C)Cc2nccnc2OC)cc1 ZINC000846051045 651304560 /nfs/dbraw/zinc/30/45/60/651304560.db2.gz BBNYKWAOKYXWFE-UHFFFAOYSA-N 1 2 316.405 2.062 20 10 DECDLO CCN1OC[C@@H]([N@H+](C)Cc2ccc(N3CCCCC3)cc2)C1=O ZINC000851716482 652213005 /nfs/dbraw/zinc/21/30/05/652213005.db2.gz NFNAPYBJHWKOJR-QGZVFWFLSA-N 1 2 317.433 2.271 20 10 DECDLO CCN1OC[C@@H]([N@@H+](C)Cc2ccc(N3CCCCC3)cc2)C1=O ZINC000851716482 652213012 /nfs/dbraw/zinc/21/30/12/652213012.db2.gz NFNAPYBJHWKOJR-QGZVFWFLSA-N 1 2 317.433 2.271 20 10 DECDLO OCC1(CC[NH2+]Cc2cccc(Br)c2O)CC1 ZINC000395936291 685461032 /nfs/dbraw/zinc/46/10/32/685461032.db2.gz NYCFUQOUOXHAIG-UHFFFAOYSA-N 1 2 300.196 2.407 20 10 DECDLO COC(=O)[C@@H]1C[N@H+](Cc2ccc(N3CCCCC3)cc2)CCO1 ZINC000093081679 684048042 /nfs/dbraw/zinc/04/80/42/684048042.db2.gz LDBLVTPOHSPVBC-KRWDZBQOSA-N 1 2 318.417 2.051 20 10 DECDLO COC(=O)[C@@H]1C[N@@H+](Cc2ccc(N3CCCCC3)cc2)CCO1 ZINC000093081679 684048047 /nfs/dbraw/zinc/04/80/47/684048047.db2.gz LDBLVTPOHSPVBC-KRWDZBQOSA-N 1 2 318.417 2.051 20 10 DECDLO C[C@H]([NH3+])[C@H]1CN(Cc2cc(Cl)cc(Cl)c2O)CCO1 ZINC000132560730 684210678 /nfs/dbraw/zinc/21/06/78/684210678.db2.gz RIYKDKADOPLCHY-QPUJVOFHSA-N 1 2 305.205 2.247 20 10 DECDLO O=C(NCc1ccc2cccnc2c1O)[C@@H]1CCc2[nH+]ccn2C1 ZINC000862026039 686224374 /nfs/dbraw/zinc/22/43/74/686224374.db2.gz FJCBISIMGWQQOB-CQSZACIVSA-N 1 2 322.368 2.016 20 10 DECDLO O=C(NCc1ccc2cccnc2c1O)[C@H]1CCc2[nH+]ccn2C1 ZINC000862026038 686224500 /nfs/dbraw/zinc/22/45/00/686224500.db2.gz FJCBISIMGWQQOB-AWEZNQCLSA-N 1 2 322.368 2.016 20 10 DECDLO Oc1c(C[NH+]2CCC(O[C@H]3CCOC3)CC2)ccc(F)c1F ZINC000876784175 689936077 /nfs/dbraw/zinc/93/60/77/689936077.db2.gz ZLFGSFCCJHUHON-ZDUSSCGKSA-N 1 2 313.344 2.440 20 10 DECDLO CCOCCO[C@H]1CC[N@H+](Cc2ccc(F)c(F)c2O)C1 ZINC000876815456 689945401 /nfs/dbraw/zinc/94/54/01/689945401.db2.gz YELNAGOFXWEMOT-LBPRGKRZSA-N 1 2 301.333 2.298 20 10 DECDLO CCOCCO[C@H]1CC[N@@H+](Cc2ccc(F)c(F)c2O)C1 ZINC000876815456 689945404 /nfs/dbraw/zinc/94/54/04/689945404.db2.gz YELNAGOFXWEMOT-LBPRGKRZSA-N 1 2 301.333 2.298 20 10 DECDLO C[C@H]1C[N@H+](Cc2ccc(F)c(F)c2O)CC2(CCOCC2)O1 ZINC000877487496 690128744 /nfs/dbraw/zinc/12/87/44/690128744.db2.gz WYEUALBUIRYMDN-NSHDSACASA-N 1 2 313.344 2.440 20 10 DECDLO C[C@H]1C[N@@H+](Cc2ccc(F)c(F)c2O)CC2(CCOCC2)O1 ZINC000877487496 690128746 /nfs/dbraw/zinc/12/87/46/690128746.db2.gz WYEUALBUIRYMDN-NSHDSACASA-N 1 2 313.344 2.440 20 10 DECDLO COC(=O)[C@H]1CSCC[N@H+](Cc2ccc(F)c(F)c2O)C1 ZINC000877593349 690161444 /nfs/dbraw/zinc/16/14/44/690161444.db2.gz STKBIQQLQFDWPZ-SNVBAGLBSA-N 1 2 317.357 2.008 20 10 DECDLO COC(=O)[C@H]1CSCC[N@@H+](Cc2ccc(F)c(F)c2O)C1 ZINC000877593349 690161446 /nfs/dbraw/zinc/16/14/46/690161446.db2.gz STKBIQQLQFDWPZ-SNVBAGLBSA-N 1 2 317.357 2.008 20 10 DECDLO CC(C)[C@H](C[NH2+][C@H](C)c1c([O-])cccc1F)N1CC[NH+](C)CC1 ZINC000886500215 692094398 /nfs/dbraw/zinc/09/43/98/692094398.db2.gz LHMVSWZOSYMLMN-ZBFHGGJFSA-N 1 2 323.456 2.454 20 10 DECDLO COCC1C[NH+](Cc2cc(Br)c(F)cc2O)C1 ZINC001144298329 790846173 /nfs/dbraw/zinc/84/61/73/790846173.db2.gz BMWARWYAPGXOFS-UHFFFAOYSA-N 1 2 304.159 2.372 20 10 DECDLO CC[S@@](=O)CC[NH2+]Cc1cc(Br)cc(F)c1O ZINC000715790970 792510930 /nfs/dbraw/zinc/51/09/30/792510930.db2.gz DLTPQMCDUTYTKD-QGZVFWFLSA-N 1 2 324.215 2.152 20 10 DECDLO CC1(C[NH2+]Cc2cc(Br)cc(F)c2O)COC1 ZINC000715759299 792511357 /nfs/dbraw/zinc/51/13/57/792511357.db2.gz LHECWTQDWBIZBR-UHFFFAOYSA-N 1 2 304.159 2.420 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CC[C@@]12CCOC2 ZINC001139133799 796332428 /nfs/dbraw/zinc/33/24/28/796332428.db2.gz QUDLXZRSWTXWLK-KRWDZBQOSA-N 1 2 301.342 2.172 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CC[C@@]12CCOC2 ZINC001139133799 796332432 /nfs/dbraw/zinc/33/24/32/796332432.db2.gz QUDLXZRSWTXWLK-KRWDZBQOSA-N 1 2 301.342 2.172 20 10 DECDLO Oc1cc(F)cc(F)c1C[N@@H+]1CC[C@H](Oc2ncccn2)C1 ZINC001140585237 796541659 /nfs/dbraw/zinc/54/16/59/796541659.db2.gz AOYZIUUFUWMUQV-NSHDSACASA-N 1 2 307.300 2.114 20 10 DECDLO Oc1cc(F)cc(F)c1C[N@H+]1CC[C@H](Oc2ncccn2)C1 ZINC001140585237 796541662 /nfs/dbraw/zinc/54/16/62/796541662.db2.gz AOYZIUUFUWMUQV-NSHDSACASA-N 1 2 307.300 2.114 20 10 DECDLO COC(=O)[C@H](Cc1ccccc1)[N@H+](C)Cc1cc(O)ccc1O ZINC001141160662 796642617 /nfs/dbraw/zinc/64/26/17/796642617.db2.gz GTTBSTVYDOXVLG-INIZCTEOSA-N 1 2 315.369 2.314 20 10 DECDLO COC(=O)[C@H](Cc1ccccc1)[N@@H+](C)Cc1cc(O)ccc1O ZINC001141160662 796642622 /nfs/dbraw/zinc/64/26/22/796642622.db2.gz GTTBSTVYDOXVLG-INIZCTEOSA-N 1 2 315.369 2.314 20 10 DECDLO Cc1[nH]c2c([nH+]1)CCN(C(=O)c1cc(O)c(O)c(Cl)c1)CC2 ZINC001193605160 797601870 /nfs/dbraw/zinc/60/18/70/797601870.db2.gz CIIIEJXUWQSDAZ-UHFFFAOYSA-N 1 2 321.764 2.024 20 10 DECDLO Nc1ccc(CNc2cc(N3CCSCC3)nc[nH+]2)cc1 ZINC001162787912 799173567 /nfs/dbraw/zinc/17/35/67/799173567.db2.gz UKHKWZBDEPYYQK-UHFFFAOYSA-N 1 2 301.419 2.224 20 10 DECDLO Nc1ccc(CNc2cc(N3CCSCC3)[nH+]cn2)cc1 ZINC001162787912 799173569 /nfs/dbraw/zinc/17/35/69/799173569.db2.gz UKHKWZBDEPYYQK-UHFFFAOYSA-N 1 2 301.419 2.224 20 10 DECDLO COc1ncnc2c1CC[N@H+](Cc1cc(Cl)ccc1O)C2 ZINC001203657131 800100815 /nfs/dbraw/zinc/10/08/15/800100815.db2.gz FQOOIYOPYYUESX-UHFFFAOYSA-N 1 2 305.765 2.403 20 10 DECDLO COc1ncnc2c1CC[N@@H+](Cc1cc(Cl)ccc1O)C2 ZINC001203657131 800100820 /nfs/dbraw/zinc/10/08/20/800100820.db2.gz FQOOIYOPYYUESX-UHFFFAOYSA-N 1 2 305.765 2.403 20 10 DECDLO COC(=O)C[N@H+](Cc1cc(O)c(O)c(OC)c1)C1CCCC1 ZINC001204344800 800206979 /nfs/dbraw/zinc/20/69/79/800206979.db2.gz DKEUMFXEQOJDJD-UHFFFAOYSA-N 1 2 309.362 2.024 20 10 DECDLO COC(=O)C[N@@H+](Cc1cc(O)c(O)c(OC)c1)C1CCCC1 ZINC001204344800 800206985 /nfs/dbraw/zinc/20/69/85/800206985.db2.gz DKEUMFXEQOJDJD-UHFFFAOYSA-N 1 2 309.362 2.024 20 10 DECDLO COc1cc(C[N@H+](C)Cc2cccc3c2OCO3)cc(O)c1O ZINC001204351568 800207988 /nfs/dbraw/zinc/20/79/88/800207988.db2.gz USPBQPPVSZZHOT-UHFFFAOYSA-N 1 2 317.341 2.467 20 10 DECDLO COc1cc(C[N@@H+](C)Cc2cccc3c2OCO3)cc(O)c1O ZINC001204351568 800207990 /nfs/dbraw/zinc/20/79/90/800207990.db2.gz USPBQPPVSZZHOT-UHFFFAOYSA-N 1 2 317.341 2.467 20 10 DECDLO CN(C)c1cc(F)c(C[N@@H+]2CCC[C@H]2C2OCCO2)cc1F ZINC001207793282 800835739 /nfs/dbraw/zinc/83/57/39/800835739.db2.gz GQWUTQUNOKAWBY-AWEZNQCLSA-N 1 2 312.360 2.368 20 10 DECDLO CN(C)c1cc(F)c(C[N@H+]2CCC[C@H]2C2OCCO2)cc1F ZINC001207793282 800835743 /nfs/dbraw/zinc/83/57/43/800835743.db2.gz GQWUTQUNOKAWBY-AWEZNQCLSA-N 1 2 312.360 2.368 20 10 DECDLO Oc1cc(O)c(C[N@@H+]2CCN3CC(F)(F)C[C@H]3C2)cc1Cl ZINC001232262845 801833285 /nfs/dbraw/zinc/83/32/85/801833285.db2.gz SSHVORMOPJPCLK-JTQLQIEISA-N 1 2 318.751 2.276 20 10 DECDLO Oc1cc(O)c(C[N@H+]2CCN3CC(F)(F)C[C@H]3C2)cc1Cl ZINC001232262845 801833291 /nfs/dbraw/zinc/83/32/91/801833291.db2.gz SSHVORMOPJPCLK-JTQLQIEISA-N 1 2 318.751 2.276 20 10 DECDLO C[C@@H]1CC[N@H+](Cc2c(O)cc(Br)cc2F)C[C@@H]1O ZINC001233029069 802009476 /nfs/dbraw/zinc/00/94/76/802009476.db2.gz YWCBEKWHKLDRQE-OQPBUACISA-N 1 2 318.186 2.497 20 10 DECDLO C[C@@H]1CC[N@@H+](Cc2c(O)cc(Br)cc2F)C[C@@H]1O ZINC001233029069 802009483 /nfs/dbraw/zinc/00/94/83/802009483.db2.gz YWCBEKWHKLDRQE-OQPBUACISA-N 1 2 318.186 2.497 20 10 DECDLO CC(C)SCC[NH2+][C@H](C)c1cccc(-c2nn[nH]n2)c1O ZINC001603376715 1069958523 /nfs/dbraw/zinc/95/85/23/1069958523.db2.gz DQCNKYWKCYRQOM-SNVBAGLBSA-N 1 2 307.423 2.365 20 10 DECDLO C[C@H]([NH2+]C[C@@H]1CCO[C@H](C)C1)c1cccc(-c2nn[nH]n2)c1O ZINC001603851265 1070122011 /nfs/dbraw/zinc/12/20/11/1070122011.db2.gz WGHCEJLFKNVYGA-GRYCIOLGSA-N 1 2 317.393 2.038 20 10 DECDLO CC[C@H](C[C@H](C)O)[NH2+][C@H](CC)c1cccc(-c2nn[nH]n2)c1O ZINC001604014494 1070176379 /nfs/dbraw/zinc/17/63/79/1070176379.db2.gz ABAGMXUMMGIBCT-MISXGVKJSA-N 1 2 319.409 2.163 20 10 DECDLO Oc1c(F)cc(Cl)cc1C[NH2+]C[C@@H](O)C1CCOCC1 ZINC001461218423 1058614332 /nfs/dbraw/zinc/61/43/32/1058614332.db2.gz QVZZTVAZGASHSM-CYBMUJFWSA-N 1 2 303.761 2.062 20 10 DECDLO C[NH+]1CCN(Cc2cc(F)cc(Br)c2O)CC1 ZINC001235297616 1084375886 /nfs/dbraw/zinc/37/58/86/1084375886.db2.gz ONVNLWVGGAEJHX-UHFFFAOYSA-N 1 2 303.175 2.041 20 10 DECDLO C[C@H]([NH2+]CC[C@@H]1CC1(F)F)c1cccc(-c2nn[nH]n2)c1O ZINC001589962914 1076536942 /nfs/dbraw/zinc/53/69/42/1076536942.db2.gz VFIAUTCVZMGHEW-DTWKUNHWSA-N 1 2 309.320 2.268 20 10 DECDLO CC[C@@H]([NH2+]CCCSC)c1cccc(-c2nn[nH]n2)c1O ZINC001590464799 1076632407 /nfs/dbraw/zinc/63/24/07/1076632407.db2.gz FBRCINFUYORPFK-GFCCVEGCSA-N 1 2 307.423 2.366 20 10 DECDLO CC[C@H]([NH2+]CCc1ccoc1)c1cccc(-c2nn[nH]n2)c1O ZINC001590470625 1076635185 /nfs/dbraw/zinc/63/51/85/1076635185.db2.gz ROZPKRZDJRSSAD-AWEZNQCLSA-N 1 2 313.361 2.449 20 10 DECDLO Cc1ccc(CC[NH2+][C@H](C)c2cccc(-c3nn[nH]n3)c2O)cn1 ZINC001592152238 1076859622 /nfs/dbraw/zinc/85/96/22/1076859622.db2.gz SYMUJJOEYYONND-GFCCVEGCSA-N 1 2 324.388 2.169 20 10 DECDLO Cc1ccc(CC[NH2+][C@@H](C)c2cccc(-c3nn[nH]n3)c2O)cn1 ZINC001592152239 1076860231 /nfs/dbraw/zinc/86/02/31/1076860231.db2.gz SYMUJJOEYYONND-LBPRGKRZSA-N 1 2 324.388 2.169 20 10 DECDLO Oc1c(F)cccc1C[N@@H+]1Cc2cccc(-c3nn[nH]n3)c2C1 ZINC001593539356 1077019873 /nfs/dbraw/zinc/01/98/73/1077019873.db2.gz ZHKUQKQMPNWWOS-UHFFFAOYSA-N 1 2 311.320 2.227 20 10 DECDLO Oc1c(F)cccc1C[N@H+]1Cc2cccc(-c3nn[nH]n3)c2C1 ZINC001593539356 1077019876 /nfs/dbraw/zinc/01/98/76/1077019876.db2.gz ZHKUQKQMPNWWOS-UHFFFAOYSA-N 1 2 311.320 2.227 20 10 DECDLO NC(=O)[C@@H](F)C1CC[NH+](Cc2c(O)ccc(Cl)c2F)CC1 ZINC001665576333 1081042612 /nfs/dbraw/zinc/04/26/12/1081042612.db2.gz DSCDIDMHSMPOJA-LBPRGKRZSA-N 1 2 318.751 2.220 20 10 DECDLO COc1ccc(C[N@@H+]2CCC[C@]3(CCNC3=O)C2)c(O)c1Cl ZINC001236802937 1138433846 /nfs/dbraw/zinc/43/38/46/1138433846.db2.gz WTGCMDLKWPCWOM-INIZCTEOSA-N 1 2 324.808 2.156 20 10 DECDLO COc1ccc(C[N@H+]2CCC[C@]3(CCNC3=O)C2)c(O)c1Cl ZINC001236802937 1138433856 /nfs/dbraw/zinc/43/38/56/1138433856.db2.gz WTGCMDLKWPCWOM-INIZCTEOSA-N 1 2 324.808 2.156 20 10 DECDLO CCOC(=O)[C@H]1CCCC[N@@H+]1Cc1cc(OC)cc(OC)c1O ZINC001237675973 1138748610 /nfs/dbraw/zinc/74/86/10/1138748610.db2.gz IJQXUNIYVZYILE-CQSZACIVSA-N 1 2 323.389 2.327 20 10 DECDLO CCOC(=O)[C@H]1CCCC[N@H+]1Cc1cc(OC)cc(OC)c1O ZINC001237675973 1138748624 /nfs/dbraw/zinc/74/86/24/1138748624.db2.gz IJQXUNIYVZYILE-CQSZACIVSA-N 1 2 323.389 2.327 20 10 DECDLO CCS(=O)(=O)CC[N@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001319707427 1140675974 /nfs/dbraw/zinc/67/59/74/1140675974.db2.gz QZBNOCAKUVHHHX-UHFFFAOYSA-N 1 2 310.463 2.153 20 10 DECDLO CCS(=O)(=O)CC[N@@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001319707427 1140675996 /nfs/dbraw/zinc/67/59/96/1140675996.db2.gz QZBNOCAKUVHHHX-UHFFFAOYSA-N 1 2 310.463 2.153 20 10 DECDLO CC(=O)[C@@H]1C[N@H+](Cc2ccc3c(c2O)C=CC(C)(C)O3)CCO1 ZINC001249263707 1141865968 /nfs/dbraw/zinc/86/59/68/1141865968.db2.gz STEZDFXKZSYPDK-INIZCTEOSA-N 1 2 317.385 2.366 20 10 DECDLO CC(=O)[C@@H]1C[N@@H+](Cc2ccc3c(c2O)C=CC(C)(C)O3)CCO1 ZINC001249263707 1141865969 /nfs/dbraw/zinc/86/59/69/1141865969.db2.gz STEZDFXKZSYPDK-INIZCTEOSA-N 1 2 317.385 2.366 20 10 DECDLO COC(=O)[C@H](C)[N@H+](C)Cc1cc(C)c(Br)cc1O ZINC001250128187 1142085404 /nfs/dbraw/zinc/08/54/04/1142085404.db2.gz AGKKSGJRDGNUDF-VIFPVBQESA-N 1 2 316.195 2.456 20 10 DECDLO COC(=O)[C@H](C)[N@@H+](C)Cc1cc(C)c(Br)cc1O ZINC001250128187 1142085416 /nfs/dbraw/zinc/08/54/16/1142085416.db2.gz AGKKSGJRDGNUDF-VIFPVBQESA-N 1 2 316.195 2.456 20 10 DECDLO CCN(CC)c1ccc(CNC(=O)C[C@@H]([NH3+])C(F)F)cc1F ZINC001263099181 1144355616 /nfs/dbraw/zinc/35/56/16/1144355616.db2.gz AKIFWWIYMUQNPQ-GFCCVEGCSA-N 1 2 317.355 2.271 20 10 DECDLO CN(C)c1ccc(CNC(=O)C[N@H+](C)Cc2ccco2)cc1 ZINC000007218965 354001415 /nfs/dbraw/zinc/00/14/15/354001415.db2.gz ZZXLOVPXYCANHW-UHFFFAOYSA-N 1 2 301.390 2.094 20 10 DECDLO CN(C)c1ccc(CNC(=O)C[N@@H+](C)Cc2ccco2)cc1 ZINC000007218965 354001420 /nfs/dbraw/zinc/00/14/20/354001420.db2.gz ZZXLOVPXYCANHW-UHFFFAOYSA-N 1 2 301.390 2.094 20 10 DECDLO COC(=O)C[N@@H+](Cc1cc(Cl)ccc1O)C[C@H]1CCCO1 ZINC000264705974 291080871 /nfs/dbraw/zinc/08/08/71/291080871.db2.gz LCYCYNDBXLCWEC-CYBMUJFWSA-N 1 2 313.781 2.200 20 10 DECDLO COC(=O)C[N@H+](Cc1cc(Cl)ccc1O)C[C@H]1CCCO1 ZINC000264705974 291080872 /nfs/dbraw/zinc/08/08/72/291080872.db2.gz LCYCYNDBXLCWEC-CYBMUJFWSA-N 1 2 313.781 2.200 20 10 DECDLO COCCOCCOCCC[NH2+]Cc1cccc(Cl)c1O ZINC000274461582 130237417 /nfs/dbraw/zinc/23/74/17/130237417.db2.gz VECICBDPDWAAQV-UHFFFAOYSA-N 1 2 317.813 2.205 20 10 DECDLO O=C(C[NH2+]Cc1cc(Cl)cc(Cl)c1O)NCC(F)F ZINC000280182763 402972951 /nfs/dbraw/zinc/97/29/51/402972951.db2.gz CLOKYKVRJAIZLK-UHFFFAOYSA-N 1 2 313.131 2.170 20 10 DECDLO C[C@H]([NH2+]Cc1cc(Cl)cc(Cl)c1O)C(=O)NCCF ZINC000282573160 403156688 /nfs/dbraw/zinc/15/66/88/403156688.db2.gz FOZWDZJCPWFOPU-ZETCQYMHSA-N 1 2 309.168 2.263 20 10 DECDLO COc1ccc2c(c1)CCCC[N@H+]2C[C@H]1CCS(=O)(=O)C1 ZINC000279651362 286388859 /nfs/dbraw/zinc/38/88/59/286388859.db2.gz BKDNBKXGBJVWOQ-CYBMUJFWSA-N 1 2 309.431 2.273 20 10 DECDLO COc1ccc2c(c1)CCCC[N@@H+]2C[C@H]1CCS(=O)(=O)C1 ZINC000279651362 286388860 /nfs/dbraw/zinc/38/88/60/286388860.db2.gz BKDNBKXGBJVWOQ-CYBMUJFWSA-N 1 2 309.431 2.273 20 10 DECDLO O=C(NCc1ccc(N2CCCC2)cc1)[C@H]1CCc2[nH+]ccn2C1 ZINC000363181454 404105965 /nfs/dbraw/zinc/10/59/65/404105965.db2.gz ZKZJYMNEYORWNM-INIZCTEOSA-N 1 2 324.428 2.362 20 10 DECDLO O=C(NC1CC1)[C@H]1CCC[N@H+]1Cc1c(O)ccc(Cl)c1F ZINC000191241102 225107324 /nfs/dbraw/zinc/10/73/24/225107324.db2.gz ZQIMGOUPEHHZHN-GFCCVEGCSA-N 1 2 312.772 2.428 20 10 DECDLO O=C(NC1CC1)[C@H]1CCC[N@@H+]1Cc1c(O)ccc(Cl)c1F ZINC000191241102 225107327 /nfs/dbraw/zinc/10/73/27/225107327.db2.gz ZQIMGOUPEHHZHN-GFCCVEGCSA-N 1 2 312.772 2.428 20 10 DECDLO C[C@H]([NH2+][C@H]1C[C@@H](O)C1)c1cc(Br)c(F)cc1O ZINC000834907193 649859059 /nfs/dbraw/zinc/85/90/59/649859059.db2.gz YIQZTTBLLPVMIO-BIIVOSGPSA-N 1 2 304.159 2.468 20 10 DECDLO COc1cccc(C[N@@H+]2CCNC(=O)[C@H]2c2cccs2)c1O ZINC000371334160 295297714 /nfs/dbraw/zinc/29/77/14/295297714.db2.gz XOQUOEIECUZWRY-CQSZACIVSA-N 1 2 318.398 2.135 20 10 DECDLO COc1cccc(C[N@H+]2CCNC(=O)[C@H]2c2cccs2)c1O ZINC000371334160 295297718 /nfs/dbraw/zinc/29/77/18/295297718.db2.gz XOQUOEIECUZWRY-CQSZACIVSA-N 1 2 318.398 2.135 20 10 DECDLO CN(C)c1noc(C[NH2+]C/C=C/c2ccc(N(C)C)cc2)n1 ZINC000835047657 649871331 /nfs/dbraw/zinc/87/13/31/649871331.db2.gz TWTLYKURTZWHNZ-AATRIKPKSA-N 1 2 301.394 2.005 20 10 DECDLO CN(C)c1ccc(/C=C\C[N@@H+]2CCOC[C@@]23CCOC3)cc1 ZINC000835052086 649872493 /nfs/dbraw/zinc/87/24/93/649872493.db2.gz NTJVSLNZGXACMP-JXCVUKRWSA-N 1 2 302.418 2.257 20 10 DECDLO CN(C)c1ccc(/C=C\C[N@H+]2CCOC[C@@]23CCOC3)cc1 ZINC000835052086 649872496 /nfs/dbraw/zinc/87/24/96/649872496.db2.gz NTJVSLNZGXACMP-JXCVUKRWSA-N 1 2 302.418 2.257 20 10 DECDLO CC[C@H](CO)Nc1cc(NCc2ccc(N(C)C)cc2)[nH+]cn1 ZINC000891579281 624482969 /nfs/dbraw/zinc/48/29/69/624482969.db2.gz WTJSXUWYVGNURN-CQSZACIVSA-N 1 2 315.421 2.338 20 10 DECDLO CC[C@H](CO)Nc1cc(NCc2ccc(N(C)C)cc2)nc[nH+]1 ZINC000891579281 624482970 /nfs/dbraw/zinc/48/29/70/624482970.db2.gz WTJSXUWYVGNURN-CQSZACIVSA-N 1 2 315.421 2.338 20 10 DECDLO COC(=O)[C@@H]1[C@@H]2CCC[C@H]2C[N@@H+]1Cc1cc(F)cc(F)c1O ZINC000894531803 637092715 /nfs/dbraw/zinc/09/27/15/637092715.db2.gz DIMTVRZUYRTFMJ-BHYNMZESSA-N 1 2 311.328 2.444 20 10 DECDLO COC(=O)[C@@H]1[C@@H]2CCC[C@H]2C[N@H+]1Cc1cc(F)cc(F)c1O ZINC000894531803 637092722 /nfs/dbraw/zinc/09/27/22/637092722.db2.gz DIMTVRZUYRTFMJ-BHYNMZESSA-N 1 2 311.328 2.444 20 10 DECDLO C[C@H](O)C1([NH2+]Cc2cc(Br)cc(F)c2O)CC1 ZINC000895336230 637939669 /nfs/dbraw/zinc/93/96/69/637939669.db2.gz QTVPJVQPVLAJPH-ZETCQYMHSA-N 1 2 304.159 2.297 20 10 DECDLO COCCc1noc(C[N@H+](C)Cc2ccc(N(C)C)cc2C)n1 ZINC000840917859 650382201 /nfs/dbraw/zinc/38/22/01/650382201.db2.gz OTFMMTWTCORUGJ-UHFFFAOYSA-N 1 2 318.421 2.265 20 10 DECDLO COCCc1noc(C[N@@H+](C)Cc2ccc(N(C)C)cc2C)n1 ZINC000840917859 650382202 /nfs/dbraw/zinc/38/22/02/650382202.db2.gz OTFMMTWTCORUGJ-UHFFFAOYSA-N 1 2 318.421 2.265 20 10 DECDLO CCOC(=O)c1cccc(C[NH2+]Cc2c(O)cccc2F)n1 ZINC000896641626 638622185 /nfs/dbraw/zinc/62/21/85/638622185.db2.gz OBFKMZZNYYZEIZ-UHFFFAOYSA-N 1 2 304.321 2.393 20 10 DECDLO COc1cccc(CNC(=O)Nc2cc(C)[nH+]cc2C)c1O ZINC000767943327 641034712 /nfs/dbraw/zinc/03/47/12/641034712.db2.gz POWBPWDVKODHAQ-UHFFFAOYSA-N 1 2 301.346 2.156 20 10 DECDLO CCOc1ccc(C[N@@H+]2CCN(CC(C)C)C(=O)C2)c(O)c1 ZINC000779200012 642471858 /nfs/dbraw/zinc/47/18/58/642471858.db2.gz QAGLYUAPAWKWHR-UHFFFAOYSA-N 1 2 306.406 2.091 20 10 DECDLO CCOc1ccc(C[N@H+]2CCN(CC(C)C)C(=O)C2)c(O)c1 ZINC000779200012 642471861 /nfs/dbraw/zinc/47/18/61/642471861.db2.gz QAGLYUAPAWKWHR-UHFFFAOYSA-N 1 2 306.406 2.091 20 10 DECDLO C[C@@H](C(=O)OCC(=O)c1ccc(O)c(O)c1)[NH+]1[C@H](C)CC[C@H]1C ZINC000783781571 643052287 /nfs/dbraw/zinc/05/22/87/643052287.db2.gz YRFSNEZUZKYBRD-UTUOFQBUSA-N 1 2 321.373 2.085 20 10 DECDLO COC(=O)C[N@H+](CCC[C@H](C)O)Cc1cc(Cl)ccc1O ZINC000789347495 643719809 /nfs/dbraw/zinc/71/98/09/643719809.db2.gz FURVPBIBJGYHPK-NSHDSACASA-N 1 2 315.797 2.182 20 10 DECDLO COC(=O)C[N@@H+](CCC[C@H](C)O)Cc1cc(Cl)ccc1O ZINC000789347495 643719812 /nfs/dbraw/zinc/71/98/12/643719812.db2.gz FURVPBIBJGYHPK-NSHDSACASA-N 1 2 315.797 2.182 20 10 DECDLO O=c1cc2c(n[nH]1)CC[N@@H+](Cc1c(O)ccc(Cl)c1F)C2 ZINC000792173828 644084604 /nfs/dbraw/zinc/08/46/04/644084604.db2.gz DGKOIVJHHZYVBT-UHFFFAOYSA-N 1 2 309.728 2.239 20 10 DECDLO O=c1cc2c(n[nH]1)CC[N@H+](Cc1c(O)ccc(Cl)c1F)C2 ZINC000792173828 644084608 /nfs/dbraw/zinc/08/46/08/644084608.db2.gz DGKOIVJHHZYVBT-UHFFFAOYSA-N 1 2 309.728 2.239 20 10 DECDLO Oc1cc2c(cc1C[N@@H+]1Cc3cccc(F)c3C1)[C@@H](O)CO2 ZINC000840162203 646199677 /nfs/dbraw/zinc/19/96/77/646199677.db2.gz PPDBUPDXTCDSKA-INIZCTEOSA-N 1 2 301.317 2.473 20 10 DECDLO Oc1cc2c(cc1C[N@H+]1Cc3cccc(F)c3C1)[C@@H](O)CO2 ZINC000840162203 646199679 /nfs/dbraw/zinc/19/96/79/646199679.db2.gz PPDBUPDXTCDSKA-INIZCTEOSA-N 1 2 301.317 2.473 20 10 DECDLO Cc1cc(Br)c(O)c(C[N@@H+](C)CCN(C)C)c1 ZINC000809730001 646269431 /nfs/dbraw/zinc/26/94/31/646269431.db2.gz WHBZSGVOZIFANI-UHFFFAOYSA-N 1 2 301.228 2.457 20 10 DECDLO Cc1cc(Br)c(O)c(C[N@H+](C)CCN(C)C)c1 ZINC000809730001 646269433 /nfs/dbraw/zinc/26/94/33/646269433.db2.gz WHBZSGVOZIFANI-UHFFFAOYSA-N 1 2 301.228 2.457 20 10 DECDLO CCCNC(=O)CC[NH2+]Cc1cccc(Br)c1O ZINC000045073089 646457259 /nfs/dbraw/zinc/45/72/59/646457259.db2.gz PXBTXTPKEOVRHB-UHFFFAOYSA-N 1 2 315.211 2.161 20 10 DECDLO CC[N@H+](CC(=O)NCc1ccc(N(C)C)cc1)Cc1ccoc1 ZINC000153551312 647508217 /nfs/dbraw/zinc/50/82/17/647508217.db2.gz CIPNVVWWINUYQE-UHFFFAOYSA-N 1 2 315.417 2.484 20 10 DECDLO CC[N@@H+](CC(=O)NCc1ccc(N(C)C)cc1)Cc1ccoc1 ZINC000153551312 647508221 /nfs/dbraw/zinc/50/82/21/647508221.db2.gz CIPNVVWWINUYQE-UHFFFAOYSA-N 1 2 315.417 2.484 20 10 DECDLO OCCCN1CCC[C@@H]([NH2+]Cc2cc(Cl)cc(F)c2O)C1 ZINC000824583508 648616852 /nfs/dbraw/zinc/61/68/52/648616852.db2.gz NTPCMOKSVPIWMM-CYBMUJFWSA-N 1 2 316.804 2.121 20 10 DECDLO Oc1ccc(Cl)c(F)c1CN1CC[NH+]([C@H]2CCOC2)CC1 ZINC000827120756 648975319 /nfs/dbraw/zinc/97/53/19/648975319.db2.gz VSKUBEHQRDFTSN-NSHDSACASA-N 1 2 314.788 2.091 20 10 DECDLO C[N@H+](Cc1cn(Cc2cccnc2)nn1)Cc1ccccc1O ZINC000183005672 649027582 /nfs/dbraw/zinc/02/75/82/649027582.db2.gz MLWPCDVVPNKGHI-UHFFFAOYSA-N 1 2 309.373 2.059 20 10 DECDLO C[N@@H+](Cc1cn(Cc2cccnc2)nn1)Cc1ccccc1O ZINC000183005672 649027584 /nfs/dbraw/zinc/02/75/84/649027584.db2.gz MLWPCDVVPNKGHI-UHFFFAOYSA-N 1 2 309.373 2.059 20 10 DECDLO CC[C@H](C(=O)N[C@H](C)c1ccccc1O)[N@@H+]1CCO[C@H](CC)C1 ZINC000827946682 649109368 /nfs/dbraw/zinc/10/93/68/649109368.db2.gz OLOCEEWFLPSXDB-IIAWOOMASA-N 1 2 320.433 2.459 20 10 DECDLO CC[C@H](C(=O)N[C@H](C)c1ccccc1O)[N@H+]1CCO[C@H](CC)C1 ZINC000827946682 649109372 /nfs/dbraw/zinc/10/93/72/649109372.db2.gz OLOCEEWFLPSXDB-IIAWOOMASA-N 1 2 320.433 2.459 20 10 DECDLO C[C@H]([NH2+]Cc1nc([C@@H]2CCCO2)n[nH]1)c1cc(F)ccc1O ZINC000848558179 651470550 /nfs/dbraw/zinc/47/05/50/651470550.db2.gz OSBJQFGGHMIWAY-ZANVPECISA-N 1 2 306.341 2.352 20 10 DECDLO CCN(Cc1ccc(N(C)C)cc1)C(=O)NCCn1cc[nH+]c1 ZINC000043312046 683900304 /nfs/dbraw/zinc/90/03/04/683900304.db2.gz CTIDZPSMDOXSNK-UHFFFAOYSA-N 1 2 315.421 2.181 20 10 DECDLO CCOC(=O)CN(Cc1[nH]c(C)c(C)[nH+]1)Cc1ccccc1O ZINC000862398072 686292245 /nfs/dbraw/zinc/29/22/45/686292245.db2.gz VYYLQKJOEWEULA-UHFFFAOYSA-N 1 2 317.389 2.297 20 10 DECDLO COC(=O)[C@H](C[C@H]1CCCOC1)[NH2+]Cc1cc(C)c(C)cc1O ZINC000862515951 686313177 /nfs/dbraw/zinc/31/31/77/686313177.db2.gz GPNOORPWTWRBBH-ZBFHGGJFSA-N 1 2 321.417 2.457 20 10 DECDLO CC[C@@H](C(=O)NCc1cc(C)ccc1O)[N@@H+]1CCO[C@@H](CC)C1 ZINC000862756213 686368899 /nfs/dbraw/zinc/36/88/99/686368899.db2.gz UAERMAATTIZKFO-HOTGVXAUSA-N 1 2 320.433 2.206 20 10 DECDLO CC[C@@H](C(=O)NCc1cc(C)ccc1O)[N@H+]1CCO[C@@H](CC)C1 ZINC000862756213 686368907 /nfs/dbraw/zinc/36/89/07/686368907.db2.gz UAERMAATTIZKFO-HOTGVXAUSA-N 1 2 320.433 2.206 20 10 DECDLO CCOC(=O)C[N@H+](CC)Cc1ccc(N2CCC(O)CC2)cc1 ZINC000876633716 689883952 /nfs/dbraw/zinc/88/39/52/689883952.db2.gz WRVMDSMAUYBLFD-UHFFFAOYSA-N 1 2 320.433 2.033 20 10 DECDLO CCOC(=O)C[N@@H+](CC)Cc1ccc(N2CCC(O)CC2)cc1 ZINC000876633716 689883955 /nfs/dbraw/zinc/88/39/55/689883955.db2.gz WRVMDSMAUYBLFD-UHFFFAOYSA-N 1 2 320.433 2.033 20 10 DECDLO Cn1cc(C[C@@H]2CC[N@H+](Cc3ccc(F)c(F)c3O)C2)cn1 ZINC000876796810 689940345 /nfs/dbraw/zinc/94/03/45/689940345.db2.gz JHSMJLFWIQZETK-NSHDSACASA-N 1 2 307.344 2.469 20 10 DECDLO Cn1cc(C[C@@H]2CC[N@@H+](Cc3ccc(F)c(F)c3O)C2)cn1 ZINC000876796810 689940348 /nfs/dbraw/zinc/94/03/48/689940348.db2.gz JHSMJLFWIQZETK-NSHDSACASA-N 1 2 307.344 2.469 20 10 DECDLO CC(C)[C@H]([NH2+]Cc1ccc(F)c(F)c1O)C(=O)N1CCCC1 ZINC000877046566 690006961 /nfs/dbraw/zinc/00/69/61/690006961.db2.gz PLNMPSJBNHTFKD-AWEZNQCLSA-N 1 2 312.360 2.407 20 10 DECDLO C[C@@H]1CN(CCC[NH2+]Cc2cc(F)cc(F)c2O)C[C@H](C)O1 ZINC000882882107 691378441 /nfs/dbraw/zinc/37/84/41/691378441.db2.gz UMEDKXMBYRZTHZ-TXEJJXNPSA-N 1 2 314.376 2.259 20 10 DECDLO C[C@@H]([NH2+][C@@H]1CC(=O)N(CC2CC2)C1)c1cc(F)cc(F)c1O ZINC000883395187 691496446 /nfs/dbraw/zinc/49/64/46/691496446.db2.gz PBQOPFJKXCNJIN-BXKDBHETSA-N 1 2 310.344 2.332 20 10 DECDLO COc1ccc(O)c([C@H](C)[NH2+]Cc2nc(CSC)n[nH]2)c1 ZINC000886757334 692183580 /nfs/dbraw/zinc/18/35/80/692183580.db2.gz DENDMNFFHFCFLX-VIFPVBQESA-N 1 2 308.407 2.233 20 10 DECDLO Oc1c(CN2CC[NH2+]CC(F)(F)C2)cccc1C(F)(F)F ZINC001211348281 777037048 /nfs/dbraw/zinc/03/70/48/777037048.db2.gz WRTBQQQYNAFODM-UHFFFAOYSA-N 1 2 310.266 2.452 20 10 DECDLO Oc1cc(F)c(Br)cc1C[N@H+]1CCC[C@H](O)C1 ZINC001144298816 790848403 /nfs/dbraw/zinc/84/84/03/790848403.db2.gz JSVQTIDYRDDOKT-VIFPVBQESA-N 1 2 304.159 2.251 20 10 DECDLO Oc1cc(F)c(Br)cc1C[N@@H+]1CCC[C@H](O)C1 ZINC001144298816 790848417 /nfs/dbraw/zinc/84/84/17/790848417.db2.gz JSVQTIDYRDDOKT-VIFPVBQESA-N 1 2 304.159 2.251 20 10 DECDLO CC(=O)NCCC1=CCN(c2nc(C)[nH+]c3c2CCCC3)CC1 ZINC001089802082 783456460 /nfs/dbraw/zinc/45/64/60/783456460.db2.gz DLUZHABLVALLRL-UHFFFAOYSA-N 1 2 314.433 2.327 20 10 DECDLO C[C@H](CCO)C[NH2+]Cc1cc(Br)cc(F)c1O ZINC000715778466 792511439 /nfs/dbraw/zinc/51/14/39/792511439.db2.gz MFEVIAYFKGVSQL-MRVPVSSYSA-N 1 2 306.175 2.402 20 10 DECDLO CC[C@H]1CC[C@H]([NH2+][C@@H](Cc2ccc(O)c(O)c2)C(=O)OC)C1 ZINC001173259420 793651331 /nfs/dbraw/zinc/65/13/31/793651331.db2.gz DQUWTTOONPQMCR-UBHSHLNASA-N 1 2 307.390 2.350 20 10 DECDLO CCOC(=O)[C@@H](C)[N@H+](Cc1ccc(OC)c(OC)c1O)C1CC1 ZINC001120040533 795396674 /nfs/dbraw/zinc/39/66/74/795396674.db2.gz ZPAKQAHVKQBQGT-LLVKDONJSA-N 1 2 323.389 2.325 20 10 DECDLO CCOC(=O)[C@@H](C)[N@@H+](Cc1ccc(OC)c(OC)c1O)C1CC1 ZINC001120040533 795396683 /nfs/dbraw/zinc/39/66/83/795396683.db2.gz ZPAKQAHVKQBQGT-LLVKDONJSA-N 1 2 323.389 2.325 20 10 DECDLO CC1(C)C[N@H+](Cc2cc(F)c(F)cc2O)C[C@@]2(CCOC2)O1 ZINC001181174712 795434554 /nfs/dbraw/zinc/43/45/54/795434554.db2.gz CKOXAZXDPKTCQK-MRXNPFEDSA-N 1 2 313.344 2.440 20 10 DECDLO CC1(C)C[N@@H+](Cc2cc(F)c(F)cc2O)C[C@@]2(CCOC2)O1 ZINC001181174712 795434558 /nfs/dbraw/zinc/43/45/58/795434558.db2.gz CKOXAZXDPKTCQK-MRXNPFEDSA-N 1 2 313.344 2.440 20 10 DECDLO CCOC[C@H]1C[N@H+](Cc2c(O)cccc2F)Cc2cnn(C)c21 ZINC001137834713 796143631 /nfs/dbraw/zinc/14/36/31/796143631.db2.gz QMEGGTXZIMQOCQ-CYBMUJFWSA-N 1 2 319.380 2.401 20 10 DECDLO CCOC[C@H]1C[N@@H+](Cc2c(O)cccc2F)Cc2cnn(C)c21 ZINC001137834713 796143637 /nfs/dbraw/zinc/14/36/37/796143637.db2.gz QMEGGTXZIMQOCQ-CYBMUJFWSA-N 1 2 319.380 2.401 20 10 DECDLO Cc1cc(C)nc(N2CC[NH+](Cc3c(O)cccc3F)CC2)n1 ZINC001137837863 796144163 /nfs/dbraw/zinc/14/41/63/796144163.db2.gz XKRVZZMCTUGOOC-UHFFFAOYSA-N 1 2 316.380 2.260 20 10 DECDLO CC(C)N1CC[N@H+](Cc2ccc3c(c2)CCCN3C)CC1=O ZINC001138356360 796204447 /nfs/dbraw/zinc/20/44/47/796204447.db2.gz MNPKQMWURHQPAW-UHFFFAOYSA-N 1 2 301.434 2.122 20 10 DECDLO CC(C)N1CC[N@@H+](Cc2ccc3c(c2)CCCN3C)CC1=O ZINC001138356360 796204451 /nfs/dbraw/zinc/20/44/51/796204451.db2.gz MNPKQMWURHQPAW-UHFFFAOYSA-N 1 2 301.434 2.122 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CCC[C@](C)(O)C1 ZINC001139129156 796329699 /nfs/dbraw/zinc/32/96/99/796329699.db2.gz OQLDOFFLPCAXGB-KRWDZBQOSA-N 1 2 303.358 2.154 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CCC[C@](C)(O)C1 ZINC001139129156 796329704 /nfs/dbraw/zinc/32/97/04/796329704.db2.gz OQLDOFFLPCAXGB-KRWDZBQOSA-N 1 2 303.358 2.154 20 10 DECDLO COC(=O)[C@@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1c(O)cc(F)cc1F)C2 ZINC001140584566 796541775 /nfs/dbraw/zinc/54/17/75/796541775.db2.gz WXRNDORJEBLEDM-UMNHJUIQSA-N 1 2 311.328 2.444 20 10 DECDLO CC(=O)[C@@H]1CCC[N@@H+]1Cc1ccc(N2CCOCC2)cc1F ZINC001140666929 796553217 /nfs/dbraw/zinc/55/32/17/796553217.db2.gz FMJBVQIECFEGFY-KRWDZBQOSA-N 1 2 306.381 2.216 20 10 DECDLO CC(=O)[C@@H]1CCC[N@H+]1Cc1ccc(N2CCOCC2)cc1F ZINC001140666929 796553220 /nfs/dbraw/zinc/55/32/20/796553220.db2.gz FMJBVQIECFEGFY-KRWDZBQOSA-N 1 2 306.381 2.216 20 10 DECDLO Cc1c(O)ccc(C[N@@H+]2CC[C@@](O)(C(F)(F)F)[C@@H](F)C2)c1O ZINC001140744070 796566669 /nfs/dbraw/zinc/56/66/69/796566669.db2.gz KRLFRSFHDRJYRB-AAEUAGOBSA-N 1 2 323.286 2.243 20 10 DECDLO Cc1c(O)ccc(C[N@H+]2CC[C@@](O)(C(F)(F)F)[C@@H](F)C2)c1O ZINC001140744070 796566671 /nfs/dbraw/zinc/56/66/71/796566671.db2.gz KRLFRSFHDRJYRB-AAEUAGOBSA-N 1 2 323.286 2.243 20 10 DECDLO Oc1ccccc1C[N@@H+]1CCCn2c(Cn3cccc3)nnc2C1 ZINC001203553048 800079770 /nfs/dbraw/zinc/07/97/70/800079770.db2.gz ZMEIVUFSPGFDHL-UHFFFAOYSA-N 1 2 323.400 2.239 20 10 DECDLO Oc1ccccc1C[N@H+]1CCCn2c(Cn3cccc3)nnc2C1 ZINC001203553048 800079776 /nfs/dbraw/zinc/07/97/76/800079776.db2.gz ZMEIVUFSPGFDHL-UHFFFAOYSA-N 1 2 323.400 2.239 20 10 DECDLO CC(C)(C)OC(=O)NCC1(C)C[NH+](Cc2ccc(O)c(O)c2)C1 ZINC001203878849 800139591 /nfs/dbraw/zinc/13/95/91/800139591.db2.gz DRGJRMGUMMVGJA-UHFFFAOYSA-N 1 2 322.405 2.444 20 10 DECDLO O=C([O-])c1ccc(O)c(C[N@@H+]2CC[C@H](Oc3cc[nH+]cc3)C2)c1 ZINC001231566062 801688418 /nfs/dbraw/zinc/68/84/18/801688418.db2.gz OVXMTTPIRSKFOB-HNNXBMFYSA-N 1 2 314.341 2.139 20 10 DECDLO O=C([O-])c1ccc(O)c(C[N@H+]2CC[C@H](Oc3cc[nH+]cc3)C2)c1 ZINC001231566062 801688421 /nfs/dbraw/zinc/68/84/21/801688421.db2.gz OVXMTTPIRSKFOB-HNNXBMFYSA-N 1 2 314.341 2.139 20 10 DECDLO CCOC(=O)[C@@H]1CSCC[N@@H+]1Cc1c(C)cc(C)cc1O ZINC001231848784 801737513 /nfs/dbraw/zinc/73/75/13/801737513.db2.gz MDFIOGFSLXFHBG-AWEZNQCLSA-N 1 2 309.431 2.490 20 10 DECDLO CCOC(=O)[C@@H]1CSCC[N@H+]1Cc1c(C)cc(C)cc1O ZINC001231848784 801737514 /nfs/dbraw/zinc/73/75/14/801737514.db2.gz MDFIOGFSLXFHBG-AWEZNQCLSA-N 1 2 309.431 2.490 20 10 DECDLO COc1cc(N(C)C)ccc1C[NH+]1CCN(C(=O)C(C)C)CC1 ZINC001231854315 801738811 /nfs/dbraw/zinc/73/88/11/801738811.db2.gz COHSWLMYLKNNNV-UHFFFAOYSA-N 1 2 319.449 2.061 20 10 DECDLO Oc1cc(O)c(C[NH+]2CCN(c3cccnc3)CC2)cc1Cl ZINC001232260409 801830450 /nfs/dbraw/zinc/83/04/50/801830450.db2.gz PSVFTUUIVXZOGX-UHFFFAOYSA-N 1 2 319.792 2.468 20 10 DECDLO CN(C)c1ccc(C[N@@H+]2CCOC[C@H]2c2cccnc2)c(O)c1 ZINC001232841037 801970667 /nfs/dbraw/zinc/97/06/67/801970667.db2.gz QFKAQALVIXBPBQ-KRWDZBQOSA-N 1 2 313.401 2.427 20 10 DECDLO CN(C)c1ccc(C[N@H+]2CCOC[C@H]2c2cccnc2)c(O)c1 ZINC001232841037 801970672 /nfs/dbraw/zinc/97/06/72/801970672.db2.gz QFKAQALVIXBPBQ-KRWDZBQOSA-N 1 2 313.401 2.427 20 10 DECDLO Cc1ccnc(O[C@@H]2CC[N@H+](Cc3ccc(F)c(F)c3O)C2)n1 ZINC001233079422 802023628 /nfs/dbraw/zinc/02/36/28/802023628.db2.gz BKSWRHCMEZEADT-GFCCVEGCSA-N 1 2 321.327 2.422 20 10 DECDLO Oc1ccc(F)c(F)c1C[NH+]1CCN(c2cccnc2)CC1 ZINC001233332449 802077843 /nfs/dbraw/zinc/07/78/43/802077843.db2.gz LSLMRXVKUMKLFL-UHFFFAOYSA-N 1 2 305.328 2.388 20 10 DECDLO CCOC(=O)C[N@H+](C)Cc1cccc(OC(F)(F)F)c1O ZINC001233737227 802194359 /nfs/dbraw/zinc/19/43/59/802194359.db2.gz ZXZYKFBJSSDYRB-UHFFFAOYSA-N 1 2 307.268 2.286 20 10 DECDLO CCOC(=O)C[N@@H+](C)Cc1cccc(OC(F)(F)F)c1O ZINC001233737227 802194363 /nfs/dbraw/zinc/19/43/63/802194363.db2.gz ZXZYKFBJSSDYRB-UHFFFAOYSA-N 1 2 307.268 2.286 20 10 DECDLO CC(C)[C@H]([NH2+][C@H](C)c1cccc(-c2nn[nH]n2)c1O)C(C)(C)O ZINC001589974169 1076541062 /nfs/dbraw/zinc/54/10/62/1076541062.db2.gz PZHMQQAMOLYWTK-YGRLFVJLSA-N 1 2 319.409 2.018 20 10 DECDLO CC[C@@H]([NH2+][C@H](C)CSC)c1cccc(-c2nn[nH]n2)c1O ZINC001590461344 1076630750 /nfs/dbraw/zinc/63/07/50/1076630750.db2.gz BEYCZQQLOOLVFX-BXKDBHETSA-N 1 2 307.423 2.365 20 10 DECDLO CCOCCCC[NH2+][C@@H](CC)c1cccc(-c2nn[nH]n2)c1O ZINC001590811227 1076680106 /nfs/dbraw/zinc/68/01/06/1076680106.db2.gz RJCBNISZRTYXRS-AWEZNQCLSA-N 1 2 319.409 2.430 20 10 DECDLO Oc1c(F)cccc1C[NH+]1CC2(CCN2Cc2ccc[nH]2)C1 ZINC001276537720 1083485334 /nfs/dbraw/zinc/48/53/34/1083485334.db2.gz MCWDQXIEZGDZJX-UHFFFAOYSA-N 1 2 301.365 2.320 20 10 DECDLO C[C@@H]1[C@H](CO)CC[N@@H+]1Cc1cc(Br)cc(F)c1O ZINC001235057794 1084292179 /nfs/dbraw/zinc/29/21/79/1084292179.db2.gz SYCRNSGKNOPDKV-BDAKNGLRSA-N 1 2 318.186 2.497 20 10 DECDLO C[C@@H]1[C@H](CO)CC[N@H+]1Cc1cc(Br)cc(F)c1O ZINC001235057794 1084292189 /nfs/dbraw/zinc/29/21/89/1084292189.db2.gz SYCRNSGKNOPDKV-BDAKNGLRSA-N 1 2 318.186 2.497 20 10 DECDLO CN(CC[NH+](C)C)Cc1cc(F)cc(Br)c1O ZINC001235297563 1084376039 /nfs/dbraw/zinc/37/60/39/1084376039.db2.gz NKDNOHLYPUAFDD-UHFFFAOYSA-N 1 2 305.191 2.287 20 10 DECDLO CCOC(=O)[C@H]1C[N@H+](Cc2ccc(C(C)(C)C)cc2O)CCO1 ZINC001235684753 1084498112 /nfs/dbraw/zinc/49/81/12/1084498112.db2.gz JREGPKZCPBBVBH-MRXNPFEDSA-N 1 2 321.417 2.454 20 10 DECDLO CCOC(=O)[C@H]1C[N@@H+](Cc2ccc(C(C)(C)C)cc2O)CCO1 ZINC001235684753 1084498115 /nfs/dbraw/zinc/49/81/15/1084498115.db2.gz JREGPKZCPBBVBH-MRXNPFEDSA-N 1 2 321.417 2.454 20 10 DECDLO C[N@H+](CCC(N)=O)Cc1cc(Cl)cc(Br)c1O ZINC000708212705 1086677315 /nfs/dbraw/zinc/67/73/15/1086677315.db2.gz WYGKEOPLBYPHHM-UHFFFAOYSA-N 1 2 321.602 2.115 20 10 DECDLO C[N@@H+](CCC(N)=O)Cc1cc(Cl)cc(Br)c1O ZINC000708212705 1086677317 /nfs/dbraw/zinc/67/73/17/1086677317.db2.gz WYGKEOPLBYPHHM-UHFFFAOYSA-N 1 2 321.602 2.115 20 10 DECDLO CCOC(=O)[C@H]1C[N@H+](Cc2ccc(C(C)C)cc2O)CCO1 ZINC001237048876 1138489507 /nfs/dbraw/zinc/48/95/07/1138489507.db2.gz JLGJIMNGYFDOFL-MRXNPFEDSA-N 1 2 307.390 2.280 20 10 DECDLO CCOC(=O)[C@H]1C[N@@H+](Cc2ccc(C(C)C)cc2O)CCO1 ZINC001237048876 1138489516 /nfs/dbraw/zinc/48/95/16/1138489516.db2.gz JLGJIMNGYFDOFL-MRXNPFEDSA-N 1 2 307.390 2.280 20 10 DECDLO CN1CC[N@H+](Cc2c(O)ccc(Cl)c2Cl)CCC1=O ZINC001237082624 1138499770 /nfs/dbraw/zinc/49/97/70/1138499770.db2.gz SUEBSDMHBSPMHP-UHFFFAOYSA-N 1 2 303.189 2.363 20 10 DECDLO CN1CC[N@@H+](Cc2c(O)ccc(Cl)c2Cl)CCC1=O ZINC001237082624 1138499775 /nfs/dbraw/zinc/49/97/75/1138499775.db2.gz SUEBSDMHBSPMHP-UHFFFAOYSA-N 1 2 303.189 2.363 20 10 DECDLO Oc1ccc(F)c(Cl)c1C[NH+]1CCN(c2cnccn2)CC1 ZINC001237122705 1138507569 /nfs/dbraw/zinc/50/75/69/1138507569.db2.gz XBLPHAZOMWUMRA-UHFFFAOYSA-N 1 2 322.771 2.297 20 10 DECDLO CC(=O)N[C@@H]1CCC[N@H+](Cc2cc(F)c(Cl)cc2O)C1 ZINC001237936063 1138811785 /nfs/dbraw/zinc/81/17/85/1138811785.db2.gz IUFILABZQQOIAX-LLVKDONJSA-N 1 2 300.761 2.285 20 10 DECDLO CC(=O)N[C@@H]1CCC[N@@H+](Cc2cc(F)c(Cl)cc2O)C1 ZINC001237936063 1138811786 /nfs/dbraw/zinc/81/17/86/1138811786.db2.gz IUFILABZQQOIAX-LLVKDONJSA-N 1 2 300.761 2.285 20 10 DECDLO C[C@@H]([NH2+]CCC1(O)CCOCC1)c1ccc(F)c(F)c1O ZINC000287706328 296121345 /nfs/dbraw/zinc/12/13/45/296121345.db2.gz XGJDPEMSQIQKHG-SNVBAGLBSA-N 1 2 301.333 2.253 20 10 DECDLO C[C@H]([NH2+][C@@H]1C[N@@H+](C2CC2)C[C@@H]1C)c1cc([N+](=O)[O-])ccc1[O-] ZINC000273568026 299396485 /nfs/dbraw/zinc/39/64/85/299396485.db2.gz KCFJENGABHAMTK-ZIBATOQPSA-N 1 2 305.378 2.434 20 10 DECDLO C[C@H]([NH2+][C@@H]1C[N@H+](C2CC2)C[C@@H]1C)c1cc([N+](=O)[O-])ccc1[O-] ZINC000273568026 299396489 /nfs/dbraw/zinc/39/64/89/299396489.db2.gz KCFJENGABHAMTK-ZIBATOQPSA-N 1 2 305.378 2.434 20 10 DECDLO O=[N+]([O-])c1ccc(O)c(C[NH2+]C[C@@H](O)Cc2cccc(F)c2)c1 ZINC000294685928 224167990 /nfs/dbraw/zinc/16/79/90/224167990.db2.gz BKVYJCMIEWAMPD-HNNXBMFYSA-N 1 2 320.320 2.133 20 10 DECDLO C[C@@H]([NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1O)C(=O)NC(C)(C)C ZINC000273361967 130110942 /nfs/dbraw/zinc/11/09/42/130110942.db2.gz APHPNMLZUSAUTA-VHSXEESVSA-N 1 2 309.366 2.254 20 10 DECDLO C[C@@H]([NH2+]C[C@@](C)(O)C(F)(F)F)c1cc([N+](=O)[O-])ccc1O ZINC000273546777 130135089 /nfs/dbraw/zinc/13/50/89/130135089.db2.gz ZOAPDUGXTKRXKN-RDDDGLTNSA-N 1 2 308.256 2.264 20 10 DECDLO CC[N@H+](CC(=O)OC)Cc1cc(Br)ccc1O ZINC000076118553 401783516 /nfs/dbraw/zinc/78/35/16/401783516.db2.gz KGDKUXXQMDQHNY-UHFFFAOYSA-N 1 2 302.168 2.150 20 10 DECDLO CC[N@@H+](CC(=O)OC)Cc1cc(Br)ccc1O ZINC000076118553 401783517 /nfs/dbraw/zinc/78/35/17/401783517.db2.gz KGDKUXXQMDQHNY-UHFFFAOYSA-N 1 2 302.168 2.150 20 10 DECDLO O=S1(=O)CC[C@@H](C[NH2+]Cc2cc(Cl)cc(Cl)c2O)C1 ZINC000038082861 401921767 /nfs/dbraw/zinc/92/17/67/401921767.db2.gz RHVGTMSKBSTBAG-QMMMGPOBSA-N 1 2 324.229 2.223 20 10 DECDLO COc1c(O)c(C[N@@H+]2CCOC3(CCC3)C2)ccc1[N+](=O)[O-] ZINC000365815624 286187162 /nfs/dbraw/zinc/18/71/62/286187162.db2.gz GQCJHIVLLSDQGN-UHFFFAOYSA-N 1 2 308.334 2.064 20 10 DECDLO COc1c(O)c(C[N@H+]2CCOC3(CCC3)C2)ccc1[N+](=O)[O-] ZINC000365815624 286187163 /nfs/dbraw/zinc/18/71/63/286187163.db2.gz GQCJHIVLLSDQGN-UHFFFAOYSA-N 1 2 308.334 2.064 20 10 DECDLO CCN(CC)c1ccc(C[N@H+](C)CCS(C)(=O)=O)cc1F ZINC000155161718 402247064 /nfs/dbraw/zinc/24/70/64/402247064.db2.gz ZSKRDXGFSPQKPN-UHFFFAOYSA-N 1 2 316.442 2.148 20 10 DECDLO CCN(CC)c1ccc(C[N@@H+](C)CCS(C)(=O)=O)cc1F ZINC000155161718 402247066 /nfs/dbraw/zinc/24/70/66/402247066.db2.gz ZSKRDXGFSPQKPN-UHFFFAOYSA-N 1 2 316.442 2.148 20 10 DECDLO COC(=O)C[N@H+](CCOC(C)C)Cc1cc(Cl)ccc1O ZINC000109779883 402275748 /nfs/dbraw/zinc/27/57/48/402275748.db2.gz GOVAQXCDDDPNFC-UHFFFAOYSA-N 1 2 315.797 2.446 20 10 DECDLO COC(=O)C[N@@H+](CCOC(C)C)Cc1cc(Cl)ccc1O ZINC000109779883 402275752 /nfs/dbraw/zinc/27/57/52/402275752.db2.gz GOVAQXCDDDPNFC-UHFFFAOYSA-N 1 2 315.797 2.446 20 10 DECDLO C[C@H]([NH2+]CC(F)(F)CO)c1ccc(Br)cc1O ZINC000184713014 402294476 /nfs/dbraw/zinc/29/44/76/402294476.db2.gz LRWYCYDYNGUHSQ-ZETCQYMHSA-N 1 2 310.138 2.433 20 10 DECDLO CCNC(=O)N1CC[C@H]([NH2+][C@@H](C)c2ccc(F)c(F)c2O)C1 ZINC000187795791 402511510 /nfs/dbraw/zinc/51/15/10/402511510.db2.gz GMGZNCRWMJYBJK-UWVGGRQHSA-N 1 2 313.348 2.125 20 10 DECDLO COC(=O)[C@@H](C)[NH2+]Cc1cc(Br)cc(C)c1O ZINC000193097547 402764692 /nfs/dbraw/zinc/76/46/92/402764692.db2.gz HXKCTLQZUKNMJX-MRVPVSSYSA-N 1 2 302.168 2.114 20 10 DECDLO CC[C@H](CNCc1ccc([N+](=O)[O-])c(OC)c1O)[NH+]1CCCC1 ZINC000278951754 402889955 /nfs/dbraw/zinc/88/99/55/402889955.db2.gz ZNEVWWXIFDMUHL-CYBMUJFWSA-N 1 2 323.393 2.273 20 10 DECDLO CCN(Cc1ccc(N(C)C)cc1)C(=O)CCc1[nH]cc[nH+]1 ZINC000279262479 402923823 /nfs/dbraw/zinc/92/38/23/402923823.db2.gz UCJFWESMMDRLGI-UHFFFAOYSA-N 1 2 300.406 2.457 20 10 DECDLO COC(=O)[C@H](C)[N@H+](C)Cc1cc(Br)cc(C)c1O ZINC000280816447 403039767 /nfs/dbraw/zinc/03/97/67/403039767.db2.gz JRBMEZPQGOFLHG-VIFPVBQESA-N 1 2 316.195 2.456 20 10 DECDLO COC(=O)[C@H](C)[N@@H+](C)Cc1cc(Br)cc(C)c1O ZINC000280816447 403039769 /nfs/dbraw/zinc/03/97/69/403039769.db2.gz JRBMEZPQGOFLHG-VIFPVBQESA-N 1 2 316.195 2.456 20 10 DECDLO CCOC(=O)[C@@H](C)[N@H+](Cc1cc2c(cc1O)OCO2)C1CC1 ZINC000276247205 403157347 /nfs/dbraw/zinc/15/73/47/403157347.db2.gz UWAYTGBWNTVMRO-SNVBAGLBSA-N 1 2 307.346 2.037 20 10 DECDLO CCOC(=O)[C@@H](C)[N@@H+](Cc1cc2c(cc1O)OCO2)C1CC1 ZINC000276247205 403157349 /nfs/dbraw/zinc/15/73/49/403157349.db2.gz UWAYTGBWNTVMRO-SNVBAGLBSA-N 1 2 307.346 2.037 20 10 DECDLO CN1CCCN(C(=O)C=Cc2c[nH]c[nH+]2)c2cc(F)ccc21 ZINC000283623772 403210631 /nfs/dbraw/zinc/21/06/31/403210631.db2.gz AZGVFUSVKSRXJD-GQCTYLIASA-N 1 2 300.337 2.435 20 10 DECDLO CN1CC[C@@H]([N@H+](C)Cc2cc(Cl)cc(Cl)c2O)C1=O ZINC000271204240 403278342 /nfs/dbraw/zinc/27/83/42/403278342.db2.gz QVWGZWNMRGGBJK-LLVKDONJSA-N 1 2 303.189 2.362 20 10 DECDLO CN1CC[C@@H]([N@@H+](C)Cc2cc(Cl)cc(Cl)c2O)C1=O ZINC000271204240 403278344 /nfs/dbraw/zinc/27/83/44/403278344.db2.gz QVWGZWNMRGGBJK-LLVKDONJSA-N 1 2 303.189 2.362 20 10 DECDLO CC(=O)N1CC[N@H+](Cc2cc(Cl)c(F)cc2O)[C@@H](C)C1 ZINC000295066884 403749665 /nfs/dbraw/zinc/74/96/65/403749665.db2.gz AMDPUXCYXLPOOG-VIFPVBQESA-N 1 2 300.761 2.237 20 10 DECDLO CC(=O)N1CC[N@@H+](Cc2cc(Cl)c(F)cc2O)[C@@H](C)C1 ZINC000295066884 403749669 /nfs/dbraw/zinc/74/96/69/403749669.db2.gz AMDPUXCYXLPOOG-VIFPVBQESA-N 1 2 300.761 2.237 20 10 DECDLO Cc1c2ccccc2n(C)c1CNC(=O)NCCn1cc[nH+]c1 ZINC000349192567 404134357 /nfs/dbraw/zinc/13/43/57/404134357.db2.gz REVVHASGHPFHOP-UHFFFAOYSA-N 1 2 311.389 2.183 20 10 DECDLO COC(=O)[C@@H]1C[C@@H](OC)CC[N@@H+]1Cc1ccc(N(C)C)c(F)c1 ZINC000359993967 404811338 /nfs/dbraw/zinc/81/13/38/404811338.db2.gz AMQNOCXZZURYGW-BBRMVZONSA-N 1 2 324.396 2.044 20 10 DECDLO COC(=O)[C@@H]1C[C@@H](OC)CC[N@H+]1Cc1ccc(N(C)C)c(F)c1 ZINC000359993967 404811341 /nfs/dbraw/zinc/81/13/41/404811341.db2.gz AMQNOCXZZURYGW-BBRMVZONSA-N 1 2 324.396 2.044 20 10 DECDLO CC(C)[N@H+](CCS(C)(=O)=O)Cc1c(O)cccc1Cl ZINC000131687835 519650673 /nfs/dbraw/zinc/65/06/73/519650673.db2.gz ADJGGEXXZPUWNX-UHFFFAOYSA-N 1 2 305.827 2.301 20 10 DECDLO CC(C)[N@@H+](CCS(C)(=O)=O)Cc1c(O)cccc1Cl ZINC000131687835 519650675 /nfs/dbraw/zinc/65/06/75/519650675.db2.gz ADJGGEXXZPUWNX-UHFFFAOYSA-N 1 2 305.827 2.301 20 10 DECDLO C[C@@H](CS(C)(=O)=O)[N@H+](C)C/C=C/c1ccc(N(C)C)cc1 ZINC000835027183 649868589 /nfs/dbraw/zinc/86/85/89/649868589.db2.gz CYEJQMVMLZCUKW-UZYOAWRESA-N 1 2 310.463 2.131 20 10 DECDLO C[C@@H](CS(C)(=O)=O)[N@@H+](C)C/C=C/c1ccc(N(C)C)cc1 ZINC000835027183 649868591 /nfs/dbraw/zinc/86/85/91/649868591.db2.gz CYEJQMVMLZCUKW-UZYOAWRESA-N 1 2 310.463 2.131 20 10 DECDLO COc1cc(Cl)cc(C[N@@H+]2CCC[C@@]23CCOC3=O)c1O ZINC000190035525 522536939 /nfs/dbraw/zinc/53/69/39/522536939.db2.gz IANGDSGFQRSTTP-HNNXBMFYSA-N 1 2 311.765 2.336 20 10 DECDLO COc1cc(Cl)cc(C[N@H+]2CCC[C@@]23CCOC3=O)c1O ZINC000190035525 522536948 /nfs/dbraw/zinc/53/69/48/522536948.db2.gz IANGDSGFQRSTTP-HNNXBMFYSA-N 1 2 311.765 2.336 20 10 DECDLO Cc1ccc([C@@H](O)C[NH2+]Cc2cc([N+](=O)[O-])ccc2O)cc1 ZINC000237781000 525779877 /nfs/dbraw/zinc/77/98/77/525779877.db2.gz OYXJCVRMIFXYAA-INIZCTEOSA-N 1 2 302.330 2.432 20 10 DECDLO CN1CCCN(C(=O)C=Cc2c[nH]c[nH+]2)c2ccc(F)cc21 ZINC000492890872 536359296 /nfs/dbraw/zinc/35/92/96/536359296.db2.gz CDUNQXYUJMUTSL-XQRVVYSFSA-N 1 2 300.337 2.435 20 10 DECDLO CS(=O)(=O)[C@@H]1CCC[N@@H+](Cc2cc(Cl)ccc2O)C1 ZINC000311955044 625729393 /nfs/dbraw/zinc/72/93/93/625729393.db2.gz MGMMKFBNCYCBKW-GFCCVEGCSA-N 1 2 303.811 2.055 20 10 DECDLO COc1ccc(C[N@@H+]2CCC[C@H]2c2ncc[nH]2)c(O)c1OC ZINC000893571118 634777891 /nfs/dbraw/zinc/77/78/91/634777891.db2.gz JUYUXPKZMWMICU-LBPRGKRZSA-N 1 2 303.362 2.470 20 10 DECDLO COc1ccc(C[N@H+]2CCC[C@H]2c2ncc[nH]2)c(O)c1OC ZINC000893571118 634777894 /nfs/dbraw/zinc/77/78/94/634777894.db2.gz JUYUXPKZMWMICU-LBPRGKRZSA-N 1 2 303.362 2.470 20 10 DECDLO C[N@H+](Cc1ncc[nH]1)Cc1ccc(N2CCC(O)CC2)cc1 ZINC000894587271 637117784 /nfs/dbraw/zinc/11/77/84/637117784.db2.gz YBHDXOIXRDMVCU-UHFFFAOYSA-N 1 2 300.406 2.003 20 10 DECDLO C[N@@H+](Cc1ncc[nH]1)Cc1ccc(N2CCC(O)CC2)cc1 ZINC000894587271 637117791 /nfs/dbraw/zinc/11/77/91/637117791.db2.gz YBHDXOIXRDMVCU-UHFFFAOYSA-N 1 2 300.406 2.003 20 10 DECDLO CN(C)C(=O)O[C@@H]1CCC[N@H+](Cc2cc(F)cc(F)c2O)C1 ZINC000894878231 637283616 /nfs/dbraw/zinc/28/36/16/637283616.db2.gz VFBHKCDIGNLKJD-GFCCVEGCSA-N 1 2 314.332 2.333 20 10 DECDLO CN(C)C(=O)O[C@@H]1CCC[N@@H+](Cc2cc(F)cc(F)c2O)C1 ZINC000894878231 637283620 /nfs/dbraw/zinc/28/36/20/637283620.db2.gz VFBHKCDIGNLKJD-GFCCVEGCSA-N 1 2 314.332 2.333 20 10 DECDLO Oc1c(Br)cc(Cl)cc1C[NH2+]C[C@H]1COCO1 ZINC000894887130 637296177 /nfs/dbraw/zinc/29/61/77/637296177.db2.gz GRGXQFALSYTQNI-VIFPVBQESA-N 1 2 322.586 2.271 20 10 DECDLO CC1(C)CC(=O)NCC[N@@H+]1Cc1cc(Cl)c(F)cc1O ZINC000895400916 638004422 /nfs/dbraw/zinc/00/44/22/638004422.db2.gz ZZAMAXWHYVFKAP-UHFFFAOYSA-N 1 2 300.761 2.285 20 10 DECDLO CC1(C)CC(=O)NCC[N@H+]1Cc1cc(Cl)c(F)cc1O ZINC000895400916 638004428 /nfs/dbraw/zinc/00/44/28/638004428.db2.gz ZZAMAXWHYVFKAP-UHFFFAOYSA-N 1 2 300.761 2.285 20 10 DECDLO COC(=O)[C@@H](CC1CCOCC1)[NH2+]Cc1ccc(C)cc1O ZINC000895592206 638105919 /nfs/dbraw/zinc/10/59/19/638105919.db2.gz NDHFQPQVEOWQDC-OAHLLOKOSA-N 1 2 307.390 2.149 20 10 DECDLO COc1ccc(C[NH2+]Cc2nc(C(F)F)no2)c(O)c1OC ZINC000895719290 638164671 /nfs/dbraw/zinc/16/46/71/638164671.db2.gz MIXODOHNTPBXOO-UHFFFAOYSA-N 1 2 315.276 2.020 20 10 DECDLO Cc1cccn2cc(CCNC(=O)C3=CC(=O)CS3)[nH+]c12 ZINC000746694768 638370246 /nfs/dbraw/zinc/37/02/46/638370246.db2.gz ZUHUKWOKAZHRHC-UHFFFAOYSA-N 1 2 301.371 2.382 20 10 DECDLO C[C@H](NC(=O)C1=CC(=O)CS1)C1([NH+]2CCOCC2)CCCC1 ZINC000748351058 638545585 /nfs/dbraw/zinc/54/55/85/638545585.db2.gz NUVSWVIHMHLBPL-LBPRGKRZSA-N 1 2 324.446 2.217 20 10 DECDLO C[C@H]([NH2+]CC1(N(C)C)CCOCC1)c1cc(F)cc(F)c1O ZINC000756574078 639676597 /nfs/dbraw/zinc/67/65/97/639676597.db2.gz NBQXLSHAKKXDNM-NSHDSACASA-N 1 2 314.376 2.432 20 10 DECDLO CN(C)c1cc(COC(=O)/C=C/c2ccc(O)c(O)c2)cc[nH+]1 ZINC000767576032 640995306 /nfs/dbraw/zinc/99/53/06/640995306.db2.gz NWBAPXYPAVCOHC-GQCTYLIASA-N 1 2 314.341 2.315 20 10 DECDLO C[C@H](NC(=O)NCCCn1cc[nH+]c1)c1ccc(N(C)C)cc1 ZINC000774016230 641853298 /nfs/dbraw/zinc/85/32/98/641853298.db2.gz HRENADHCFGNDKH-AWEZNQCLSA-N 1 2 315.421 2.400 20 10 DECDLO O=C(C[NH2+]Cc1cc(Cl)cc(F)c1O)NCc1ccco1 ZINC000775934139 642114490 /nfs/dbraw/zinc/11/44/90/642114490.db2.gz XYUMRIJCLBTMSC-UHFFFAOYSA-N 1 2 312.728 2.184 20 10 DECDLO CC(C)CN1CC[N@H+](Cc2ccc(N(C)C)cc2)[C@@H](C)C1=O ZINC000779203024 642472106 /nfs/dbraw/zinc/47/21/06/642472106.db2.gz VQWGWUZCDPELKI-HNNXBMFYSA-N 1 2 303.450 2.441 20 10 DECDLO CC(C)CN1CC[N@@H+](Cc2ccc(N(C)C)cc2)[C@@H](C)C1=O ZINC000779203024 642472110 /nfs/dbraw/zinc/47/21/10/642472110.db2.gz VQWGWUZCDPELKI-HNNXBMFYSA-N 1 2 303.450 2.441 20 10 DECDLO CCn1cnc2c1CC[N@H+](Cc1cc(OC)c(C)cc1O)C2 ZINC000902550924 643072811 /nfs/dbraw/zinc/07/28/11/643072811.db2.gz MZBXOHURGDTCRE-UHFFFAOYSA-N 1 2 301.390 2.484 20 10 DECDLO CCn1cnc2c1CC[N@@H+](Cc1cc(OC)c(C)cc1O)C2 ZINC000902550924 643072814 /nfs/dbraw/zinc/07/28/14/643072814.db2.gz MZBXOHURGDTCRE-UHFFFAOYSA-N 1 2 301.390 2.484 20 10 DECDLO Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)CCn1cc[nH+]c1 ZINC000839918199 645296509 /nfs/dbraw/zinc/29/65/09/645296509.db2.gz KVXFOZMIKZOQJI-OAHLLOKOSA-N 1 2 314.433 2.395 20 10 DECDLO CC[N@H+](Cc1cc(Cl)c(F)cc1O)[C@H]1CCS(=O)(=O)C1 ZINC000816481209 647140207 /nfs/dbraw/zinc/14/02/07/647140207.db2.gz MOUIJSODDJFXBG-JTQLQIEISA-N 1 2 321.801 2.194 20 10 DECDLO CC[N@@H+](Cc1cc(Cl)c(F)cc1O)[C@H]1CCS(=O)(=O)C1 ZINC000816481209 647140209 /nfs/dbraw/zinc/14/02/09/647140209.db2.gz MOUIJSODDJFXBG-JTQLQIEISA-N 1 2 321.801 2.194 20 10 DECDLO C[N@@H+](Cc1cc(Cl)c(F)cc1O)C[C@H]1CCS(=O)(=O)C1 ZINC000816514262 647145430 /nfs/dbraw/zinc/14/54/30/647145430.db2.gz RJAVGQMYWGYVLU-SECBINFHSA-N 1 2 321.801 2.051 20 10 DECDLO C[N@H+](Cc1cc(Cl)c(F)cc1O)C[C@H]1CCS(=O)(=O)C1 ZINC000816514262 647145432 /nfs/dbraw/zinc/14/54/32/647145432.db2.gz RJAVGQMYWGYVLU-SECBINFHSA-N 1 2 321.801 2.051 20 10 DECDLO OCC[C@H]1CSCC[N@@H+]1Cc1cc(Cl)c(F)cc1O ZINC000816520645 647146310 /nfs/dbraw/zinc/14/63/10/647146310.db2.gz UPAFQZAXTJEKGX-JTQLQIEISA-N 1 2 305.802 2.485 20 10 DECDLO OCC[C@H]1CSCC[N@H+]1Cc1cc(Cl)c(F)cc1O ZINC000816520645 647146313 /nfs/dbraw/zinc/14/63/13/647146313.db2.gz UPAFQZAXTJEKGX-JTQLQIEISA-N 1 2 305.802 2.485 20 10 DECDLO C[C@@H](C[NH2+]Cc1cc(Cl)c(F)cc1O)CN1CCOCC1 ZINC000816553561 647151795 /nfs/dbraw/zinc/15/17/95/647151795.db2.gz ZPDJIBLIYRPINU-NSHDSACASA-N 1 2 316.804 2.243 20 10 DECDLO OC[C@@]1([C@@H]([NH2+]Cc2cccc(Cl)c2O)C2CC2)CCCO1 ZINC000816667249 647165061 /nfs/dbraw/zinc/16/50/61/647165061.db2.gz HNRSUSLQNVPAMG-JKSUJKDBSA-N 1 2 311.809 2.455 20 10 DECDLO CC(C)C[C@H](C(=O)NCCc1ccc(O)c(O)c1)n1cc[nH+]c1 ZINC000821060195 647980993 /nfs/dbraw/zinc/98/09/93/647980993.db2.gz FPQMEENCXCNZMJ-CQSZACIVSA-N 1 2 317.389 2.240 20 10 DECDLO Oc1c(Cl)cccc1C[N@@H+]1C[C@H](O)C[C@H]1[C@H]1CCCOC1 ZINC000824655711 648630196 /nfs/dbraw/zinc/63/01/96/648630196.db2.gz ZKZBQCXUUKINHU-GUTXKFCHSA-N 1 2 311.809 2.407 20 10 DECDLO Oc1c(Cl)cccc1C[N@H+]1C[C@H](O)C[C@H]1[C@H]1CCCOC1 ZINC000824655711 648630199 /nfs/dbraw/zinc/63/01/99/648630199.db2.gz ZKZBQCXUUKINHU-GUTXKFCHSA-N 1 2 311.809 2.407 20 10 DECDLO O=[S@](CC[NH2+]Cc1cccc(Cl)c1O)CC(F)(F)F ZINC000826868660 648940213 /nfs/dbraw/zinc/94/02/13/648940213.db2.gz UVWYINFOOSLSPS-LJQANCHMSA-N 1 2 315.744 2.446 20 10 DECDLO CN(C)c1ccc(/C=C\C[NH+]2CCN([C@@H]3CCOC3)CC2)cc1 ZINC000827126133 648976680 /nfs/dbraw/zinc/97/66/80/648976680.db2.gz WOWKEVQAWRWLAQ-ZRHASKPBSA-N 1 2 315.461 2.172 20 10 DECDLO C[C@H](NC(=O)[C@@H]1C[C@H]1c1c[nH+]cn1C)c1ccc(N(C)C)cc1 ZINC000832431236 649709985 /nfs/dbraw/zinc/70/99/85/649709985.db2.gz LYUROPWXSKDQED-APHBMKBZSA-N 1 2 312.417 2.467 20 10 DECDLO COC(=O)[C@@H]1C[N@H+](Cc2c(O)cc(C)cc2Cl)C[C@H](C)O1 ZINC000846060544 651305185 /nfs/dbraw/zinc/30/51/85/651305185.db2.gz PBZCCMSOYJOCQI-HZMBPMFUSA-N 1 2 313.781 2.116 20 10 DECDLO COC(=O)[C@@H]1C[N@@H+](Cc2c(O)cc(C)cc2Cl)C[C@H](C)O1 ZINC000846060544 651305186 /nfs/dbraw/zinc/30/51/86/651305186.db2.gz PBZCCMSOYJOCQI-HZMBPMFUSA-N 1 2 313.781 2.116 20 10 DECDLO CN(C)c1ccc(C[N@@H+]2CC(C)(C)O[C@@H]3COC[C@H]32)cc1F ZINC000846119220 651308982 /nfs/dbraw/zinc/30/89/82/651308982.db2.gz YRPMXHPYGQLKLJ-HZPDHXFCSA-N 1 2 308.397 2.270 20 10 DECDLO CN(C)c1ccc(C[N@H+]2CC(C)(C)O[C@@H]3COC[C@H]32)cc1F ZINC000846119220 651308983 /nfs/dbraw/zinc/30/89/83/651308983.db2.gz YRPMXHPYGQLKLJ-HZPDHXFCSA-N 1 2 308.397 2.270 20 10 DECDLO O=C(NCc1cc(Cl)ccc1O)[C@H]1CCn2cc[nH+]c2C1 ZINC000846475276 651332551 /nfs/dbraw/zinc/33/25/51/651332551.db2.gz FFJAUUAMXMIQMN-JTQLQIEISA-N 1 2 305.765 2.121 20 10 DECDLO Cc1cc(O)c(C[NH2+]Cc2nc([C@@H]3CCCO3)n[nH]2)cc1C ZINC000848563652 651471560 /nfs/dbraw/zinc/47/15/60/651471560.db2.gz XSOZDGSXDFIZMU-AWEZNQCLSA-N 1 2 302.378 2.268 20 10 DECDLO COc1ccc(O)c(C[N@@H+]2Cc3ccccc3N(C)C(=O)C2)c1 ZINC000857882969 652194724 /nfs/dbraw/zinc/19/47/24/652194724.db2.gz XLEORHDGJOVTGY-UHFFFAOYSA-N 1 2 312.369 2.379 20 10 DECDLO COc1ccc(O)c(C[N@H+]2Cc3ccccc3N(C)C(=O)C2)c1 ZINC000857882969 652194726 /nfs/dbraw/zinc/19/47/26/652194726.db2.gz XLEORHDGJOVTGY-UHFFFAOYSA-N 1 2 312.369 2.379 20 10 DECDLO CN(C)c1cc(F)c(C[N@@H+]2C[C@@H]3CCC[C@H]3[C@@H]2C(N)=O)cc1F ZINC000862338799 686278407 /nfs/dbraw/zinc/27/84/07/686278407.db2.gz UXEXAZYZNFXCND-KANYHAFZSA-N 1 2 323.387 2.117 20 10 DECDLO CN(C)c1cc(F)c(C[N@H+]2C[C@@H]3CCC[C@H]3[C@@H]2C(N)=O)cc1F ZINC000862338799 686278411 /nfs/dbraw/zinc/27/84/11/686278411.db2.gz UXEXAZYZNFXCND-KANYHAFZSA-N 1 2 323.387 2.117 20 10 DECDLO CCCNC(=O)C[N@H+](CCC)Cc1ccc(F)c(F)c1O ZINC000876625619 689879738 /nfs/dbraw/zinc/87/97/38/689879738.db2.gz ZVDNTUYEKITORE-UHFFFAOYSA-N 1 2 300.349 2.409 20 10 DECDLO CCCNC(=O)C[N@@H+](CCC)Cc1ccc(F)c(F)c1O ZINC000876625619 689879741 /nfs/dbraw/zinc/87/97/41/689879741.db2.gz ZVDNTUYEKITORE-UHFFFAOYSA-N 1 2 300.349 2.409 20 10 DECDLO CCOC(=O)[C@]1(C)C[N@H+](Cc2cc(Cl)ccc2O)CCO1 ZINC000877704918 690196953 /nfs/dbraw/zinc/19/69/53/690196953.db2.gz XMQCRKJKKZELSQ-HNNXBMFYSA-N 1 2 313.781 2.200 20 10 DECDLO CCOC(=O)[C@]1(C)C[N@@H+](Cc2cc(Cl)ccc2O)CCO1 ZINC000877704918 690196958 /nfs/dbraw/zinc/19/69/58/690196958.db2.gz XMQCRKJKKZELSQ-HNNXBMFYSA-N 1 2 313.781 2.200 20 10 DECDLO COC(=O)CCCc1nc(C[NH2+][C@@H](C)c2ccccc2O)no1 ZINC000879650977 690699212 /nfs/dbraw/zinc/69/92/12/690699212.db2.gz AXAUKDANCBSJTN-NSHDSACASA-N 1 2 319.361 2.122 20 10 DECDLO COCc1n[nH]c(C[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3C)n1 ZINC001333327659 1150034397 /nfs/dbraw/zinc/03/43/97/1150034397.db2.gz OKZYQZDLJOJYKU-GHMZBOCLSA-N 1 2 302.378 2.303 20 10 DECDLO COC(=[NH2+])c1cccc(NCCc2cc(O)c(O)cc2O)c1 ZINC001168013769 779327125 /nfs/dbraw/zinc/32/71/25/779327125.db2.gz JLFIVGRZRPHEFO-UHFFFAOYSA-N 1 2 302.330 2.430 20 10 DECDLO CC[N@H+](CCC(=O)OC)Cc1c(O)ccc2c(C)cc(=O)oc21 ZINC001139133676 787718736 /nfs/dbraw/zinc/71/87/36/787718736.db2.gz KZOFKEGIBZUYBT-UHFFFAOYSA-N 1 2 319.357 2.192 20 10 DECDLO CC[N@@H+](CCC(=O)OC)Cc1c(O)ccc2c(C)cc(=O)oc21 ZINC001139133676 787718747 /nfs/dbraw/zinc/71/87/47/787718747.db2.gz KZOFKEGIBZUYBT-UHFFFAOYSA-N 1 2 319.357 2.192 20 10 DECDLO COC[C@@H](C[NH2+]Cc1cc(Br)cc(F)c1O)OC ZINC000715743861 792509545 /nfs/dbraw/zinc/50/95/45/792509545.db2.gz CHQZYNVSXXPJLD-SNVBAGLBSA-N 1 2 322.174 2.045 20 10 DECDLO Oc1c(F)cc(Br)cc1C[NH2+]C[C@@H](O)C1CC1 ZINC000715758074 792512008 /nfs/dbraw/zinc/51/20/08/792512008.db2.gz IDRBLZVLKGHIOI-LLVKDONJSA-N 1 2 304.159 2.154 20 10 DECDLO COC[C@@H]1Cn2ccnc2C[N@H+](Cc2c(O)cccc2F)C1 ZINC001137834542 796143908 /nfs/dbraw/zinc/14/39/08/796143908.db2.gz KFBICSRAWCHLAS-LBPRGKRZSA-N 1 2 305.353 2.006 20 10 DECDLO COC[C@@H]1Cn2ccnc2C[N@@H+](Cc2c(O)cccc2F)C1 ZINC001137834542 796143912 /nfs/dbraw/zinc/14/39/12/796143912.db2.gz KFBICSRAWCHLAS-LBPRGKRZSA-N 1 2 305.353 2.006 20 10 DECDLO CCOC[C@@H]1C[N@H+](Cc2c(O)cccc2F)Cc2cnn(C)c21 ZINC001137834714 796144314 /nfs/dbraw/zinc/14/43/14/796144314.db2.gz QMEGGTXZIMQOCQ-ZDUSSCGKSA-N 1 2 319.380 2.401 20 10 DECDLO CCOC[C@@H]1C[N@@H+](Cc2c(O)cccc2F)Cc2cnn(C)c21 ZINC001137834714 796144316 /nfs/dbraw/zinc/14/43/16/796144316.db2.gz QMEGGTXZIMQOCQ-ZDUSSCGKSA-N 1 2 319.380 2.401 20 10 DECDLO COc1ccc(N2CC[NH+](Cc3cc(O)cc(O)c3)CC2)cc1 ZINC001138323212 796194634 /nfs/dbraw/zinc/19/46/34/796194634.db2.gz MXBSEOQARYVOLM-UHFFFAOYSA-N 1 2 314.385 2.429 20 10 DECDLO CCN(CC)c1ccc(C[NH+]2CCN(C(C)=O)CC2)c(OC)c1 ZINC001138385869 796208846 /nfs/dbraw/zinc/20/88/46/796208846.db2.gz BGZKJNZOVCCCMA-UHFFFAOYSA-N 1 2 319.449 2.206 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+](C)C1CCOCC1 ZINC001139126384 796327355 /nfs/dbraw/zinc/32/73/55/796327355.db2.gz FJRJPUCMKIKMSW-UHFFFAOYSA-N 1 2 303.358 2.418 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+](C)C1CCOCC1 ZINC001139126384 796327360 /nfs/dbraw/zinc/32/73/60/796327360.db2.gz FJRJPUCMKIKMSW-UHFFFAOYSA-N 1 2 303.358 2.418 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CCC[C@H](O)CC1 ZINC001139127476 796329047 /nfs/dbraw/zinc/32/90/47/796329047.db2.gz WQSLEKVIWXBTLI-LBPRGKRZSA-N 1 2 303.358 2.154 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CCC[C@H](O)CC1 ZINC001139127476 796329051 /nfs/dbraw/zinc/32/90/51/796329051.db2.gz WQSLEKVIWXBTLI-LBPRGKRZSA-N 1 2 303.358 2.154 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1C[C@@H](C)OC[C@@H]1C ZINC001139133659 796330976 /nfs/dbraw/zinc/33/09/76/796330976.db2.gz KVWVIHLOMDEJIY-NWDGAFQWSA-N 1 2 303.358 2.416 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1C[C@@H](C)OC[C@@H]1C ZINC001139133659 796330978 /nfs/dbraw/zinc/33/09/78/796330978.db2.gz KVWVIHLOMDEJIY-NWDGAFQWSA-N 1 2 303.358 2.416 20 10 DECDLO COC(=O)c1cnc2c(c1)C[N@@H+](Cc1cc(F)ccc1O)CC2 ZINC001140055954 796471473 /nfs/dbraw/zinc/47/14/73/796471473.db2.gz BKYSQLGPBHNPHU-UHFFFAOYSA-N 1 2 316.332 2.271 20 10 DECDLO COC(=O)c1cnc2c(c1)C[N@H+](Cc1cc(F)ccc1O)CC2 ZINC001140055954 796471477 /nfs/dbraw/zinc/47/14/77/796471477.db2.gz BKYSQLGPBHNPHU-UHFFFAOYSA-N 1 2 316.332 2.271 20 10 DECDLO CCOC(=O)[C@@H]1C[N@H+](Cc2cccc(C(C)(C)C)c2O)CCO1 ZINC001143111075 796803158 /nfs/dbraw/zinc/80/31/58/796803158.db2.gz WPUNCVGOLNPIMC-HNNXBMFYSA-N 1 2 321.417 2.454 20 10 DECDLO CCOC(=O)[C@@H]1C[N@@H+](Cc2cccc(C(C)(C)C)c2O)CCO1 ZINC001143111075 796803161 /nfs/dbraw/zinc/80/31/61/796803161.db2.gz WPUNCVGOLNPIMC-HNNXBMFYSA-N 1 2 321.417 2.454 20 10 DECDLO Cc1cnc(N2CC[NH+](Cc3ccc(O)c(O)c3)CC2)s1 ZINC001203882892 798234965 /nfs/dbraw/zinc/23/49/65/798234965.db2.gz WLVOFSGRXIPBEN-UHFFFAOYSA-N 1 2 305.403 2.185 20 10 DECDLO COc1ccc(O)c(C[NH+]2CC(N(C)C(=O)OC(C)(C)C)C2)c1 ZINC001203665478 800102501 /nfs/dbraw/zinc/10/25/01/800102501.db2.gz LPZDIEZKVMPUKX-UHFFFAOYSA-N 1 2 322.405 2.452 20 10 DECDLO Oc1cc(O)c(C[N@@H+]2CCOC3(CCOCC3)C2)cc1Cl ZINC001232262581 801831491 /nfs/dbraw/zinc/83/14/91/801831491.db2.gz KQHUERWHQNHHRL-UHFFFAOYSA-N 1 2 313.781 2.133 20 10 DECDLO Oc1cc(O)c(C[N@H+]2CCOC3(CCOCC3)C2)cc1Cl ZINC001232262581 801831501 /nfs/dbraw/zinc/83/15/01/801831501.db2.gz KQHUERWHQNHHRL-UHFFFAOYSA-N 1 2 313.781 2.133 20 10 DECDLO CCOc1ccc(N2CCN(Cc3c[nH+]c(C)[nH]3)CC2)cc1 ZINC001232464845 801893148 /nfs/dbraw/zinc/89/31/48/801893148.db2.gz FCQPMPYGVQYJCA-UHFFFAOYSA-N 1 2 300.406 2.439 20 10 DECDLO Cc1cnc(O[C@@H]2CC[N@H+](Cc3ccc(F)c(F)c3O)C2)nc1 ZINC001233079804 802023658 /nfs/dbraw/zinc/02/36/58/802023658.db2.gz LBGQMRNDHVRUQZ-GFCCVEGCSA-N 1 2 321.327 2.422 20 10 DECDLO CN1C[C@@]2(CC1=O)CCCC[N@@H+]2Cc1c(O)ccc(F)c1F ZINC001233333298 802079277 /nfs/dbraw/zinc/07/92/77/802079277.db2.gz QTWBRJBXYKEFDU-INIZCTEOSA-N 1 2 310.344 2.257 20 10 DECDLO CN1C[C@@]2(CC1=O)CCCC[N@H+]2Cc1c(O)ccc(F)c1F ZINC001233333298 802079283 /nfs/dbraw/zinc/07/92/83/802079283.db2.gz QTWBRJBXYKEFDU-INIZCTEOSA-N 1 2 310.344 2.257 20 10 DECDLO Oc1ccc(F)c(F)c1C[N@H+]1C[C@@H]2COC[C@H](C1)C2(F)F ZINC001233336139 802079708 /nfs/dbraw/zinc/07/97/08/802079708.db2.gz ZXRXVSJMRCWXGA-DTORHVGOSA-N 1 2 305.271 2.384 20 10 DECDLO Cc1ccc(C(=O)NCC[NH2+]Cc2cc(F)cc(F)c2O)cc1 ZINC001461161600 1058598807 /nfs/dbraw/zinc/59/88/07/1058598807.db2.gz UNTXZUNSEKNVOC-UHFFFAOYSA-N 1 2 320.339 2.498 20 10 DECDLO CCOC(=O)/C=C/C[NH+]1CCN(c2ccc(OCC)cc2)CC1 ZINC001644993463 1078871941 /nfs/dbraw/zinc/87/19/41/1078871941.db2.gz LFWGOSIQCUNRJP-AATRIKPKSA-N 1 2 318.417 2.327 20 10 DECDLO CO[C@@](C)(C[NH2+][C@@H](C)c1cccc(-c2nn[nH]n2)c1O)C1CC1 ZINC001591317590 1076721319 /nfs/dbraw/zinc/72/13/19/1076721319.db2.gz GNVVPXVCXUVMAA-QFYYESIMSA-N 1 2 317.393 2.038 20 10 DECDLO O=C([O-])C[N@@H+](CCCn1cc[nH+]c1)Cc1cc(Cl)ccc1O ZINC001608745584 1077688555 /nfs/dbraw/zinc/68/85/55/1077688555.db2.gz YFVIUIPKRRLTEI-UHFFFAOYSA-N 1 2 323.780 2.219 20 10 DECDLO O=C([O-])C[N@H+](CCCn1cc[nH+]c1)Cc1cc(Cl)ccc1O ZINC001608745584 1077688557 /nfs/dbraw/zinc/68/85/57/1077688557.db2.gz YFVIUIPKRRLTEI-UHFFFAOYSA-N 1 2 323.780 2.219 20 10 DECDLO CCOC(=O)[C@@H]1C[N@H+](Cc2cc(C(C)C)ccc2O)CCO1 ZINC001659047501 1080227181 /nfs/dbraw/zinc/22/71/81/1080227181.db2.gz FLQHQKMXTRBHJO-INIZCTEOSA-N 1 2 307.390 2.280 20 10 DECDLO CCOC(=O)[C@@H]1C[N@@H+](Cc2cc(C(C)C)ccc2O)CCO1 ZINC001659047501 1080227190 /nfs/dbraw/zinc/22/71/90/1080227190.db2.gz FLQHQKMXTRBHJO-INIZCTEOSA-N 1 2 307.390 2.280 20 10 DECDLO C[C@H]1C[N@H+](Cc2cc(F)cc(Br)c2O)CC[C@@H]1O ZINC001235297498 1084377543 /nfs/dbraw/zinc/37/75/43/1084377543.db2.gz MMZYKLXOVUBRNP-UFBFGSQYSA-N 1 2 318.186 2.497 20 10 DECDLO C[C@H]1C[N@@H+](Cc2cc(F)cc(Br)c2O)CC[C@@H]1O ZINC001235297498 1084377553 /nfs/dbraw/zinc/37/75/53/1084377553.db2.gz MMZYKLXOVUBRNP-UFBFGSQYSA-N 1 2 318.186 2.497 20 10 DECDLO COC(=O)C[C@H]1C[N@H+](Cc2ccc(C(C)C)cc2O)CCO1 ZINC001237047881 1138488912 /nfs/dbraw/zinc/48/89/12/1138488912.db2.gz ALLVNKBNZHQEJD-HNNXBMFYSA-N 1 2 307.390 2.280 20 10 DECDLO COC(=O)C[C@H]1C[N@@H+](Cc2ccc(C(C)C)cc2O)CCO1 ZINC001237047881 1138488927 /nfs/dbraw/zinc/48/89/27/1138488927.db2.gz ALLVNKBNZHQEJD-HNNXBMFYSA-N 1 2 307.390 2.280 20 10 DECDLO CCN(Cc1c(O)cccc1OC(F)(F)F)C1C[NH+](C)C1 ZINC001237116043 1138506951 /nfs/dbraw/zinc/50/69/51/1138506951.db2.gz WPKMLDUCECUMKF-UHFFFAOYSA-N 1 2 304.312 2.427 20 10 DECDLO OC[C@H]1C[C@@H](F)C[N@H+](Cc2c(O)cccc2OC(F)(F)F)C1 ZINC001237120582 1138508127 /nfs/dbraw/zinc/50/81/27/1138508127.db2.gz QPDXQRNAHXMRTN-VHSXEESVSA-N 1 2 323.286 2.443 20 10 DECDLO OC[C@H]1C[C@@H](F)C[N@@H+](Cc2c(O)cccc2OC(F)(F)F)C1 ZINC001237120582 1138508132 /nfs/dbraw/zinc/50/81/32/1138508132.db2.gz QPDXQRNAHXMRTN-VHSXEESVSA-N 1 2 323.286 2.443 20 10 DECDLO Oc1ccc(F)c(Cl)c1C[N@@H+]1CCO[C@@]2(CCOC2)C1 ZINC001237123112 1138508582 /nfs/dbraw/zinc/50/85/82/1138508582.db2.gz HGIYUBDPIVKDMS-AWEZNQCLSA-N 1 2 301.745 2.176 20 10 DECDLO Oc1ccc(F)c(Cl)c1C[N@H+]1CCO[C@@]2(CCOC2)C1 ZINC001237123112 1138508585 /nfs/dbraw/zinc/50/85/85/1138508585.db2.gz HGIYUBDPIVKDMS-AWEZNQCLSA-N 1 2 301.745 2.176 20 10 DECDLO Cc1cccc(O)c1C[N@@H+]1CCN(C(=O)OC(C)(C)C)C(=O)C1 ZINC001237488391 1138656341 /nfs/dbraw/zinc/65/63/41/1138656341.db2.gz WFJZDPSCGOGRRZ-UHFFFAOYSA-N 1 2 320.389 2.280 20 10 DECDLO Cc1cccc(O)c1C[N@H+]1CCN(C(=O)OC(C)(C)C)C(=O)C1 ZINC001237488391 1138656348 /nfs/dbraw/zinc/65/63/48/1138656348.db2.gz WFJZDPSCGOGRRZ-UHFFFAOYSA-N 1 2 320.389 2.280 20 10 DECDLO Oc1c(Cl)cc(F)cc1C[N@@H+]1CC[C@H](N2CCOCC2)C1 ZINC001237799603 1138791310 /nfs/dbraw/zinc/79/13/10/1138791310.db2.gz SDIMIILIVHRTNX-ZDUSSCGKSA-N 1 2 314.788 2.091 20 10 DECDLO Oc1c(Cl)cc(F)cc1C[N@H+]1CC[C@H](N2CCOCC2)C1 ZINC001237799603 1138791318 /nfs/dbraw/zinc/79/13/18/1138791318.db2.gz SDIMIILIVHRTNX-ZDUSSCGKSA-N 1 2 314.788 2.091 20 10 DECDLO O=C1NCC[C@@]12CCC[N@@H+](Cc1cc(F)cc(Cl)c1O)C2 ZINC001237801033 1138791905 /nfs/dbraw/zinc/79/19/05/1138791905.db2.gz PVVRKRYXLXSXSS-OAHLLOKOSA-N 1 2 312.772 2.287 20 10 DECDLO O=C1NCC[C@@]12CCC[N@H+](Cc1cc(F)cc(Cl)c1O)C2 ZINC001237801033 1138791914 /nfs/dbraw/zinc/79/19/14/1138791914.db2.gz PVVRKRYXLXSXSS-OAHLLOKOSA-N 1 2 312.772 2.287 20 10 DECDLO CCNC(=O)[C@@H]1CCC[N@@H+]1Cc1cc(F)c(Cl)cc1O ZINC001237941198 1138811466 /nfs/dbraw/zinc/81/14/66/1138811466.db2.gz ROOPQVUWOUTTRP-LBPRGKRZSA-N 1 2 300.761 2.285 20 10 DECDLO Cn1ccc2c1nccc2-c1ccc(C[NH+]2CCOCC2)nc1 ZINC001239593179 1139066614 /nfs/dbraw/zinc/06/66/14/1139066614.db2.gz FZGAGZWJOQVKKS-UHFFFAOYSA-N 1 2 308.385 2.468 20 10 DECDLO CCOC(=O)Cn1ccc2c1ncnc2-c1ccc2[nH+]ccn2c1 ZINC001240216830 1139299087 /nfs/dbraw/zinc/29/90/87/1139299087.db2.gz ONKQVKWSTJUXGY-UHFFFAOYSA-N 1 2 321.340 2.309 20 10 DECDLO CCN(CC)c1ccc(CN(C)C(=O)C[C@@H]([NH3+])C(F)F)cc1 ZINC001341641874 1143645984 /nfs/dbraw/zinc/64/59/84/1143645984.db2.gz AHYMWHZGKUNEKB-CQSZACIVSA-N 1 2 313.392 2.474 20 10 DECDLO Cc1ccc(C[NH2+]Cc2cc(Cl)cc(F)c2O)c(=O)n1C ZINC001308391819 1147470073 /nfs/dbraw/zinc/47/00/73/1147470073.db2.gz HKVOTMUBXSRPFJ-UHFFFAOYSA-N 1 2 310.756 2.482 20 10 DECDLO CCCOc1ccc(C[NH+]2CC(OCCOCC)C2)c(O)c1 ZINC000297559871 132022478 /nfs/dbraw/zinc/02/24/78/132022478.db2.gz HBDTWGYGEGNZFL-UHFFFAOYSA-N 1 2 309.406 2.418 20 10 DECDLO Cc1ccc(NC(=O)NCCc2ccc(O)c(O)c2)c(C)[nH+]1 ZINC000135174454 401929704 /nfs/dbraw/zinc/92/97/04/401929704.db2.gz WWHLIVMWRCIXMK-UHFFFAOYSA-N 1 2 301.346 2.474 20 10 DECDLO CCS(=O)(=O)C[C@@H](C)[NH2+][C@@H](C)c1ccc(F)c(F)c1O ZINC000187782067 402511399 /nfs/dbraw/zinc/51/13/99/402511399.db2.gz WLXVOIRDLUZSCT-BDAKNGLRSA-N 1 2 307.362 2.144 20 10 DECDLO CCC[N@H+](CC)CCNCc1ccc([N+](=O)[O-])c(OC)c1O ZINC000278532064 402867660 /nfs/dbraw/zinc/86/76/60/402867660.db2.gz VKWPYNMVOFOQCQ-UHFFFAOYSA-N 1 2 311.382 2.131 20 10 DECDLO CCC[N@@H+](CC)CCNCc1ccc([N+](=O)[O-])c(OC)c1O ZINC000278532064 402867661 /nfs/dbraw/zinc/86/76/61/402867661.db2.gz VKWPYNMVOFOQCQ-UHFFFAOYSA-N 1 2 311.382 2.131 20 10 DECDLO CCCN(CC)CC[NH2+]Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000278532064 402867663 /nfs/dbraw/zinc/86/76/63/402867663.db2.gz VKWPYNMVOFOQCQ-UHFFFAOYSA-N 1 2 311.382 2.131 20 10 DECDLO CCC[C@](C)([NH2+]Cc1cc(OC)c(OC)cc1O)C(=O)OC ZINC000272441624 402937722 /nfs/dbraw/zinc/93/77/22/402937722.db2.gz TZWLGBFFEWGRGE-INIZCTEOSA-N 1 2 311.378 2.231 20 10 DECDLO COC(=O)[C@H](Cc1ccccc1)[NH2+]Cc1cc(OC)ccc1O ZINC000276471892 403178557 /nfs/dbraw/zinc/17/85/57/403178557.db2.gz MVDULWRFPTZILR-INIZCTEOSA-N 1 2 315.369 2.275 20 10 DECDLO CS(=O)(=O)CC1CC[NH+](Cc2c(O)cccc2Cl)CC1 ZINC000292830387 403379982 /nfs/dbraw/zinc/37/99/82/403379982.db2.gz RAZVVXXTFFPWQN-UHFFFAOYSA-N 1 2 317.838 2.302 20 10 DECDLO COc1cc(Cl)cc(C[N@@H+]2CCC[C@](F)(CO)C2)c1O ZINC000289821952 404000676 /nfs/dbraw/zinc/00/06/76/404000676.db2.gz OFKUIAQHDIDCRU-CQSZACIVSA-N 1 2 303.761 2.351 20 10 DECDLO COc1cc(Cl)cc(C[N@H+]2CCC[C@](F)(CO)C2)c1O ZINC000289821952 404000681 /nfs/dbraw/zinc/00/06/81/404000681.db2.gz OFKUIAQHDIDCRU-CQSZACIVSA-N 1 2 303.761 2.351 20 10 DECDLO CCn1ncnc1C[N@@H+]1CCCN(c2ccc(OC)cc2)CC1 ZINC000193314592 225156304 /nfs/dbraw/zinc/15/63/04/225156304.db2.gz AQNNPFSTDAYDJG-UHFFFAOYSA-N 1 2 315.421 2.019 20 10 DECDLO CCn1ncnc1C[N@H+]1CCCN(c2ccc(OC)cc2)CC1 ZINC000193314592 225156306 /nfs/dbraw/zinc/15/63/06/225156306.db2.gz AQNNPFSTDAYDJG-UHFFFAOYSA-N 1 2 315.421 2.019 20 10 DECDLO COc1ccc2c(c1)CCCC[N@H+]2C[C@@H]1CCS(=O)(=O)C1 ZINC000279651366 295257988 /nfs/dbraw/zinc/25/79/88/295257988.db2.gz BKDNBKXGBJVWOQ-ZDUSSCGKSA-N 1 2 309.431 2.273 20 10 DECDLO COc1ccc2c(c1)CCCC[N@@H+]2C[C@@H]1CCS(=O)(=O)C1 ZINC000279651366 295257991 /nfs/dbraw/zinc/25/79/91/295257991.db2.gz BKDNBKXGBJVWOQ-ZDUSSCGKSA-N 1 2 309.431 2.273 20 10 DECDLO CS(=O)(=O)CCCCC[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000294758016 295493948 /nfs/dbraw/zinc/49/39/48/295493948.db2.gz RXTIIKLQAIRWFB-UHFFFAOYSA-N 1 2 323.817 2.489 20 10 DECDLO CCNC(=O)N1CC[NH+](C/C=C/c2ccc(N(C)C)cc2)CC1 ZINC000835025812 649868175 /nfs/dbraw/zinc/86/81/75/649868175.db2.gz NRDOXIZAHLJQGJ-AATRIKPKSA-N 1 2 316.449 2.113 20 10 DECDLO COC(=O)C[C@H]1C[N@H+](Cc2cc(Cl)cc(C)c2O)CCO1 ZINC000180287515 523353934 /nfs/dbraw/zinc/35/39/34/523353934.db2.gz HPDQUTSTNKRVNC-ZDUSSCGKSA-N 1 2 313.781 2.118 20 10 DECDLO COC(=O)C[C@H]1C[N@@H+](Cc2cc(Cl)cc(C)c2O)CCO1 ZINC000180287515 523353942 /nfs/dbraw/zinc/35/39/42/523353942.db2.gz HPDQUTSTNKRVNC-ZDUSSCGKSA-N 1 2 313.781 2.118 20 10 DECDLO COc1cc(N(C)C(=O)C=Cc2c[nH]c[nH+]2)cc(OC)c1OC ZINC000283958609 536822631 /nfs/dbraw/zinc/82/26/31/536822631.db2.gz LRXJVNAMMOLJSO-AATRIKPKSA-N 1 2 317.345 2.112 20 10 DECDLO C[C@@H](Cn1cc[nH+]c1)NC(=O)NCc1cccc(Cl)c1O ZINC000892027206 624749512 /nfs/dbraw/zinc/74/95/12/624749512.db2.gz APLYHBGAPMNDLK-JTQLQIEISA-N 1 2 308.769 2.130 20 10 DECDLO CC[C@H](CNCc1ccc(OC)c(OC)c1O)[NH+]1CCCC1 ZINC000892556034 625145657 /nfs/dbraw/zinc/14/56/57/625145657.db2.gz ZLISCFISVHSDMB-CQSZACIVSA-N 1 2 308.422 2.373 20 10 DECDLO CCOC(=O)[C@@H](C)[NH2+]C1CCN(c2ccc(OC)cc2)CC1 ZINC000734156607 633340643 /nfs/dbraw/zinc/34/06/43/633340643.db2.gz SZYVRECNGHSRIP-CYBMUJFWSA-N 1 2 306.406 2.205 20 10 DECDLO CCC[N@H+](Cc1cc(F)cc(F)c1O)[C@H]1CCS(=O)(=O)C1 ZINC000893894415 636062240 /nfs/dbraw/zinc/06/22/40/636062240.db2.gz XVIKCKRXEOLCLB-LBPRGKRZSA-N 1 2 319.373 2.070 20 10 DECDLO CCC[N@@H+](Cc1cc(F)cc(F)c1O)[C@H]1CCS(=O)(=O)C1 ZINC000893894415 636062241 /nfs/dbraw/zinc/06/22/41/636062241.db2.gz XVIKCKRXEOLCLB-LBPRGKRZSA-N 1 2 319.373 2.070 20 10 DECDLO COc1ccc(C[N@H+](C)[C@@H](C)c2nc(C)no2)c(O)c1OC ZINC000895221669 637805399 /nfs/dbraw/zinc/80/53/99/637805399.db2.gz SZNZCSUTNIUKPR-VIFPVBQESA-N 1 2 307.350 2.294 20 10 DECDLO COc1ccc(C[N@@H+](C)[C@@H](C)c2nc(C)no2)c(O)c1OC ZINC000895221669 637805402 /nfs/dbraw/zinc/80/54/02/637805402.db2.gz SZNZCSUTNIUKPR-VIFPVBQESA-N 1 2 307.350 2.294 20 10 DECDLO Cc1cc(O)c(C[NH2+]CCCN2CCC(O)CC2)c(Cl)c1 ZINC000840885013 650371188 /nfs/dbraw/zinc/37/11/88/650371188.db2.gz SJWMZHIAIPDHLG-UHFFFAOYSA-N 1 2 312.841 2.290 20 10 DECDLO OC[C@H]([NH2+]Cc1cc(Cl)cc(F)c1O)[C@H]1CCCOC1 ZINC000840961499 650395799 /nfs/dbraw/zinc/39/57/99/650395799.db2.gz BKBNFFVDEQTIFO-ZANVPECISA-N 1 2 303.761 2.062 20 10 DECDLO CC[C@@H](CO)Nc1cc(NCc2c(O)cccc2F)[nH+]cn1 ZINC000895832907 638224341 /nfs/dbraw/zinc/22/43/41/638224341.db2.gz QCYHDDMBIULVRJ-JTQLQIEISA-N 1 2 306.341 2.116 20 10 DECDLO CC[C@@H](CO)Nc1cc(NCc2c(O)cccc2F)nc[nH+]1 ZINC000895832907 638224342 /nfs/dbraw/zinc/22/43/42/638224342.db2.gz QCYHDDMBIULVRJ-JTQLQIEISA-N 1 2 306.341 2.116 20 10 DECDLO COC(=O)N[C@H]1CC[N@H+](Cc2cc(Cl)cc(F)c2O)C1 ZINC000895849435 638232286 /nfs/dbraw/zinc/23/22/86/638232286.db2.gz XXVOEVUFUBVLDR-JTQLQIEISA-N 1 2 302.733 2.115 20 10 DECDLO COC(=O)N[C@H]1CC[N@@H+](Cc2cc(Cl)cc(F)c2O)C1 ZINC000895849435 638232291 /nfs/dbraw/zinc/23/22/91/638232291.db2.gz XXVOEVUFUBVLDR-JTQLQIEISA-N 1 2 302.733 2.115 20 10 DECDLO COc1ccc(N2CC[NH+](Cc3ccnc(C#N)c3)CC2)cc1 ZINC000320514193 639088746 /nfs/dbraw/zinc/08/87/46/639088746.db2.gz ZHIVPSLSIRAXMS-UHFFFAOYSA-N 1 2 308.385 2.284 20 10 DECDLO C[C@H]([NH2+]CCN1CCSCC1)c1cc(F)cc(F)c1O ZINC000756576717 639677337 /nfs/dbraw/zinc/67/73/37/639677337.db2.gz OCPADLNDLHSCOY-JTQLQIEISA-N 1 2 302.390 2.370 20 10 DECDLO C[C@@H](CC(N)=O)[NH2+][C@@H](C)c1cc(Br)c(F)cc1O ZINC000756661199 639683698 /nfs/dbraw/zinc/68/36/98/639683698.db2.gz PUQOCRMYQQCBBI-BQBZGAKWSA-N 1 2 319.174 2.208 20 10 DECDLO CCN1CC[N@H+](Cc2ccc(N3CCCCC3)cc2)CC1=O ZINC000758015381 639907475 /nfs/dbraw/zinc/90/74/75/639907475.db2.gz OJQFLRVAVUPBBQ-UHFFFAOYSA-N 1 2 301.434 2.341 20 10 DECDLO CCN1CC[N@@H+](Cc2ccc(N3CCCCC3)cc2)CC1=O ZINC000758015381 639907480 /nfs/dbraw/zinc/90/74/80/639907480.db2.gz OJQFLRVAVUPBBQ-UHFFFAOYSA-N 1 2 301.434 2.341 20 10 DECDLO O=C(CCn1cc[nH+]c1)NCc1cccc(Br)c1O ZINC000765731127 640813712 /nfs/dbraw/zinc/81/37/12/640813712.db2.gz YEGKEHWMHAACDE-UHFFFAOYSA-N 1 2 324.178 2.058 20 10 DECDLO O=C1NCCN1CC1CC[NH+](Cc2cccc(Cl)c2O)CC1 ZINC000897582597 640822170 /nfs/dbraw/zinc/82/21/70/640822170.db2.gz DJRJZWUDLYRAPC-UHFFFAOYSA-N 1 2 323.824 2.283 20 10 DECDLO CN(C)C(=O)c1ccc(C[NH2+]Cc2cccc(Cl)c2O)[nH]1 ZINC000898218302 641051545 /nfs/dbraw/zinc/05/15/45/641051545.db2.gz DDYHBDXUVLHOFY-UHFFFAOYSA-N 1 2 307.781 2.365 20 10 DECDLO O=C(N1CCCC1)N1CC[NH+](Cc2c(O)cccc2Cl)CC1 ZINC000768225539 641060132 /nfs/dbraw/zinc/06/01/32/641060132.db2.gz HIPBOCSGQRZZJZ-UHFFFAOYSA-N 1 2 323.824 2.379 20 10 DECDLO CCN(C)c1ccc(C[N@@H+]2CC[C@H](OC)C[C@@H]2C(=O)OC)cc1 ZINC000773830159 641827690 /nfs/dbraw/zinc/82/76/90/641827690.db2.gz FAHJTSJYYCFGAF-DLBZAZTESA-N 1 2 320.433 2.295 20 10 DECDLO CCN(C)c1ccc(C[N@H+]2CC[C@H](OC)C[C@@H]2C(=O)OC)cc1 ZINC000773830159 641827693 /nfs/dbraw/zinc/82/76/93/641827693.db2.gz FAHJTSJYYCFGAF-DLBZAZTESA-N 1 2 320.433 2.295 20 10 DECDLO C[C@H](NC(=O)[C@@H]1CCn2c[nH+]cc2C1)c1ccc(N(C)C)cc1 ZINC000775402418 642039588 /nfs/dbraw/zinc/03/95/88/642039588.db2.gz ARMGPCAXBISNTD-DZGCQCFKSA-N 1 2 312.417 2.389 20 10 DECDLO COC(=O)[C@@H]1C[N@H+](Cc2cc(Cl)cc(F)c2O)C[C@H]1C ZINC000775723619 642085004 /nfs/dbraw/zinc/08/50/04/642085004.db2.gz JFKAWLSXQAHQHS-LDYMZIIASA-N 1 2 301.745 2.426 20 10 DECDLO COC(=O)[C@@H]1C[N@@H+](Cc2cc(Cl)cc(F)c2O)C[C@H]1C ZINC000775723619 642085010 /nfs/dbraw/zinc/08/50/10/642085010.db2.gz JFKAWLSXQAHQHS-LDYMZIIASA-N 1 2 301.745 2.426 20 10 DECDLO C[C@H]1CC[N@H+](CC(=O)N(C)Cc2ccc(N(C)C)cc2)C[C@H]1F ZINC000778235848 642357897 /nfs/dbraw/zinc/35/78/97/642357897.db2.gz JBXNBKZWEPDQAN-WMLDXEAASA-N 1 2 321.440 2.391 20 10 DECDLO C[C@H]1CC[N@@H+](CC(=O)N(C)Cc2ccc(N(C)C)cc2)C[C@H]1F ZINC000778235848 642357904 /nfs/dbraw/zinc/35/79/04/642357904.db2.gz JBXNBKZWEPDQAN-WMLDXEAASA-N 1 2 321.440 2.391 20 10 DECDLO CC[C@H](CN1CCOCC1)[NH2+][C@@H](C)c1cc(F)cc(F)c1O ZINC000903342818 643319825 /nfs/dbraw/zinc/31/98/25/643319825.db2.gz KXBXDSIGWGCUTF-WCQYABFASA-N 1 2 314.376 2.432 20 10 DECDLO CCCN1CCC[N@H+](Cc2ccc(N(C)C)c(F)c2)CC1=O ZINC000788269350 643585021 /nfs/dbraw/zinc/58/50/21/643585021.db2.gz QVMKYDMCUGUMAI-UHFFFAOYSA-N 1 2 307.413 2.336 20 10 DECDLO CCCN1CCC[N@@H+](Cc2ccc(N(C)C)c(F)c2)CC1=O ZINC000788269350 643585027 /nfs/dbraw/zinc/58/50/27/643585027.db2.gz QVMKYDMCUGUMAI-UHFFFAOYSA-N 1 2 307.413 2.336 20 10 DECDLO COCCO[C@H]1CC[N@H+](Cc2c(O)ccc(Cl)c2F)C1 ZINC000792180665 644085169 /nfs/dbraw/zinc/08/51/69/644085169.db2.gz RHGDFPNPNFLUNC-JTQLQIEISA-N 1 2 303.761 2.422 20 10 DECDLO COCCO[C@H]1CC[N@@H+](Cc2c(O)ccc(Cl)c2F)C1 ZINC000792180665 644085172 /nfs/dbraw/zinc/08/51/72/644085172.db2.gz RHGDFPNPNFLUNC-JTQLQIEISA-N 1 2 303.761 2.422 20 10 DECDLO CC(C)(C[NH2+]Cc1cc(Cl)cc(F)c1O)[C@]1(O)CCOC1 ZINC000843427884 650973018 /nfs/dbraw/zinc/97/30/18/650973018.db2.gz BEDIOLCYVSEANO-HNNXBMFYSA-N 1 2 317.788 2.452 20 10 DECDLO CC(C)OC[C@@H](CO)[N@H+](C)Cc1c(O)ccc(Cl)c1F ZINC000809768434 646281299 /nfs/dbraw/zinc/28/12/99/646281299.db2.gz LBJCMPRKYDVZMD-SNVBAGLBSA-N 1 2 305.777 2.402 20 10 DECDLO CC(C)OC[C@@H](CO)[N@@H+](C)Cc1c(O)ccc(Cl)c1F ZINC000809768434 646281300 /nfs/dbraw/zinc/28/13/00/646281300.db2.gz LBJCMPRKYDVZMD-SNVBAGLBSA-N 1 2 305.777 2.402 20 10 DECDLO C[C@H]([NH2+][C@H]1CCc2[nH+]c[nH]c2C1)c1cc([N+](=O)[O-])ccc1[O-] ZINC000810253843 646345330 /nfs/dbraw/zinc/34/53/30/646345330.db2.gz DYHRNPVIHQHPBU-UWVGGRQHSA-N 1 2 302.334 2.232 20 10 DECDLO O=C1OCCN1C[C@H]1CC[N@@H+](Cc2cccc(Cl)c2O)C1 ZINC000824454641 648590925 /nfs/dbraw/zinc/59/09/25/648590925.db2.gz JCAOFJOUAGDHOX-NSHDSACASA-N 1 2 310.781 2.320 20 10 DECDLO O=C1OCCN1C[C@H]1CC[N@H+](Cc2cccc(Cl)c2O)C1 ZINC000824454641 648590930 /nfs/dbraw/zinc/59/09/30/648590930.db2.gz JCAOFJOUAGDHOX-NSHDSACASA-N 1 2 310.781 2.320 20 10 DECDLO COc1cc(C[N@@H+]2CCNC(=O)[C@H]2C)c(O)c(C(C)(C)C)c1 ZINC000824645816 648629055 /nfs/dbraw/zinc/62/90/55/648629055.db2.gz QMGJNSKUSITSKD-LLVKDONJSA-N 1 2 306.406 2.019 20 10 DECDLO COc1cc(C[N@H+]2CCNC(=O)[C@H]2C)c(O)c(C(C)(C)C)c1 ZINC000824645816 648629057 /nfs/dbraw/zinc/62/90/57/648629057.db2.gz QMGJNSKUSITSKD-LLVKDONJSA-N 1 2 306.406 2.019 20 10 DECDLO CO[C@H](C[NH2+]Cc1cc(Cl)cc(F)c1O)[C@H]1CCOC1 ZINC000826821668 648931873 /nfs/dbraw/zinc/93/18/73/648931873.db2.gz AXTOLIMKZSJPSC-TVQRCGJNSA-N 1 2 303.761 2.326 20 10 DECDLO O=C1CC[C@H]2C[N@H+](Cc3cc(Cl)cc(F)c3O)CC[C@@H]2N1 ZINC000827133979 648979491 /nfs/dbraw/zinc/97/94/91/648979491.db2.gz YVENFIHHJVVRTE-ZANVPECISA-N 1 2 312.772 2.285 20 10 DECDLO O=C1CC[C@H]2C[N@@H+](Cc3cc(Cl)cc(F)c3O)CC[C@@H]2N1 ZINC000827133979 648979492 /nfs/dbraw/zinc/97/94/92/648979492.db2.gz YVENFIHHJVVRTE-ZANVPECISA-N 1 2 312.772 2.285 20 10 DECDLO Cc1cc(C[N@@H+]2CC(=O)N[C@H](C)C2)ccc1N1CCCCC1 ZINC000831768653 649640547 /nfs/dbraw/zinc/64/05/47/649640547.db2.gz ABPPNZSNWLNOBQ-OAHLLOKOSA-N 1 2 301.434 2.306 20 10 DECDLO Cc1cc(C[N@H+]2CC(=O)N[C@H](C)C2)ccc1N1CCCCC1 ZINC000831768653 649640548 /nfs/dbraw/zinc/64/05/48/649640548.db2.gz ABPPNZSNWLNOBQ-OAHLLOKOSA-N 1 2 301.434 2.306 20 10 DECDLO CCn1nc(C)c(C[N@H+](C)CCN(C)c2ccc(OC)cc2)n1 ZINC000844401244 651123504 /nfs/dbraw/zinc/12/35/04/651123504.db2.gz IUXIONWUAVUNEF-UHFFFAOYSA-N 1 2 317.437 2.183 20 10 DECDLO CCn1nc(C)c(C[N@@H+](C)CCN(C)c2ccc(OC)cc2)n1 ZINC000844401244 651123506 /nfs/dbraw/zinc/12/35/06/651123506.db2.gz IUXIONWUAVUNEF-UHFFFAOYSA-N 1 2 317.437 2.183 20 10 DECDLO C[C@H]([NH2+]C[C@@H]1CC(=O)N(C2CC2)C1)c1cc(F)cc(F)c1O ZINC000846205707 651315091 /nfs/dbraw/zinc/31/50/91/651315091.db2.gz KGQRQIZTKHHCDK-UWVGGRQHSA-N 1 2 310.344 2.332 20 10 DECDLO COc1ccc(N2CC[NH+](Cc3cc(C)no3)CC2)c(OC)c1 ZINC000846746016 651348917 /nfs/dbraw/zinc/34/89/17/651348917.db2.gz XALHICHEQKPHEP-UHFFFAOYSA-N 1 2 317.389 2.322 20 10 DECDLO Cc1cc(N(C)C)ccc1CNC(=O)[C@@H](C)Cc1c[nH]c[nH+]1 ZINC000847500718 651399011 /nfs/dbraw/zinc/39/90/11/651399011.db2.gz NUOSRGKYNBHYJK-ZDUSSCGKSA-N 1 2 300.406 2.279 20 10 DECDLO Cc1cc(N(C)C)ccc1CNC(=O)[C@@H](C)Cc1c[nH+]c[nH]1 ZINC000847500718 651399013 /nfs/dbraw/zinc/39/90/13/651399013.db2.gz NUOSRGKYNBHYJK-ZDUSSCGKSA-N 1 2 300.406 2.279 20 10 DECDLO CC1(C)[C@H](O)C[C@@H]1[NH2+]Cc1cccc(Br)c1O ZINC000128201788 684169419 /nfs/dbraw/zinc/16/94/19/684169419.db2.gz IRTOGYAZYGITKP-WDEREUQCSA-N 1 2 300.196 2.404 20 10 DECDLO CC[C@@H](C(=O)NCc1c(O)cccc1F)[N@@H+]1CCO[C@H](CC)C1 ZINC000928709018 693831244 /nfs/dbraw/zinc/83/12/44/693831244.db2.gz VTJWUJNJQFZWBD-DOMZBBRYSA-N 1 2 324.396 2.037 20 10 DECDLO CC[C@@H](C(=O)NCc1c(O)cccc1F)[N@H+]1CCO[C@H](CC)C1 ZINC000928709018 693831247 /nfs/dbraw/zinc/83/12/47/693831247.db2.gz VTJWUJNJQFZWBD-DOMZBBRYSA-N 1 2 324.396 2.037 20 10 DECDLO O=C(NCc1ccc2cccnc2c1O)[C@H]1CCc2c[nH+]cn2C1 ZINC000862026750 686225459 /nfs/dbraw/zinc/22/54/59/686225459.db2.gz ZEHYTXZGZHPTJB-AWEZNQCLSA-N 1 2 322.368 2.016 20 10 DECDLO COC(=O)C1CC[NH+](Cc2cc(F)c(N(C)C)cc2F)CC1 ZINC000862211065 686254853 /nfs/dbraw/zinc/25/48/53/686254853.db2.gz CKHSIYNTKOPPTE-UHFFFAOYSA-N 1 2 312.360 2.416 20 10 DECDLO OCCC[N@H+](Cc1ccccn1)Cc1ccc(F)c(F)c1O ZINC000877528106 690141617 /nfs/dbraw/zinc/14/16/17/690141617.db2.gz USHRFNNJSWDDPU-UHFFFAOYSA-N 1 2 308.328 2.450 20 10 DECDLO OCCC[N@@H+](Cc1ccccn1)Cc1ccc(F)c(F)c1O ZINC000877528106 690141618 /nfs/dbraw/zinc/14/16/18/690141618.db2.gz USHRFNNJSWDDPU-UHFFFAOYSA-N 1 2 308.328 2.450 20 10 DECDLO Oc1c(C[NH2+][C@@H]2COc3ccccc3[C@H]2O)ccc(F)c1F ZINC000877537598 690144877 /nfs/dbraw/zinc/14/48/77/690144877.db2.gz MXBOXGCDCGIKGV-MLGOLLRUSA-N 1 2 307.296 2.255 20 10 DECDLO COCC[N@@H+]1CCN(Cc2ccc(F)c(F)c2O)C(C)(C)C1 ZINC000877613970 690167483 /nfs/dbraw/zinc/16/74/83/690167483.db2.gz DZEDXMBSIBSAPB-UHFFFAOYSA-N 1 2 314.376 2.213 20 10 DECDLO COCC[N@H+]1CCN(Cc2ccc(F)c(F)c2O)C(C)(C)C1 ZINC000877613970 690167484 /nfs/dbraw/zinc/16/74/84/690167484.db2.gz DZEDXMBSIBSAPB-UHFFFAOYSA-N 1 2 314.376 2.213 20 10 DECDLO Oc1c(F)cc(F)cc1C[NH2+]Cc1nnc2n1CCCCC2 ZINC000882880330 691377781 /nfs/dbraw/zinc/37/77/81/691377781.db2.gz MQPRXKDVIPFZKU-UHFFFAOYSA-N 1 2 308.332 2.278 20 10 DECDLO C[C@H]([NH2+][C@@H]1C[C@H](O)C12CCOCC2)c1cc(F)cc(F)c1O ZINC000927154385 693561830 /nfs/dbraw/zinc/56/18/30/693561830.db2.gz FTUISJIFMPIUBK-FZZIBODNSA-N 1 2 313.344 2.251 20 10 DECDLO C[C@H]([NH2+][C@H]1C[C@@H](O)C12CCOCC2)c1cc(F)cc(F)c1O ZINC000927154387 693562043 /nfs/dbraw/zinc/56/20/43/693562043.db2.gz FTUISJIFMPIUBK-QCZZGDTMSA-N 1 2 313.344 2.251 20 10 DECDLO Cn1cc[nH+]c1C[C@H]1CCCN(C(=O)Cc2ccc(N)cc2)C1 ZINC001332151863 1149826414 /nfs/dbraw/zinc/82/64/14/1149826414.db2.gz IEYCUFPPRCUJSS-OAHLLOKOSA-N 1 2 312.417 2.026 20 10 DECDLO C[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)Cn1cc[nH+]c1 ZINC001136892979 790517827 /nfs/dbraw/zinc/51/78/27/790517827.db2.gz MGASEXMJNWAWEV-LLVKDONJSA-N 1 2 314.349 2.112 20 10 DECDLO Oc1cc(F)c(Br)cc1C[N@H+]1CCC[C@@H](O)C1 ZINC001144298815 790849032 /nfs/dbraw/zinc/84/90/32/790849032.db2.gz JSVQTIDYRDDOKT-SECBINFHSA-N 1 2 304.159 2.251 20 10 DECDLO Oc1cc(F)c(Br)cc1C[N@@H+]1CCC[C@@H](O)C1 ZINC001144298815 790849049 /nfs/dbraw/zinc/84/90/49/790849049.db2.gz JSVQTIDYRDDOKT-SECBINFHSA-N 1 2 304.159 2.251 20 10 DECDLO OC[C@H]1CC[N@H+](Cc2cc(Br)c(F)cc2O)C1 ZINC001144300050 790849114 /nfs/dbraw/zinc/84/91/14/790849114.db2.gz PYRXRBBRSULLJE-QMMMGPOBSA-N 1 2 304.159 2.108 20 10 DECDLO OC[C@H]1CC[N@@H+](Cc2cc(Br)c(F)cc2O)C1 ZINC001144300050 790849128 /nfs/dbraw/zinc/84/91/28/790849128.db2.gz PYRXRBBRSULLJE-QMMMGPOBSA-N 1 2 304.159 2.108 20 10 DECDLO C[C@H](C[S@](C)=O)[NH2+]Cc1cc(Br)cc(F)c1O ZINC000715792395 792511560 /nfs/dbraw/zinc/51/15/60/792511560.db2.gz OQVQIGSVLVSPPU-GJEGPGMTSA-N 1 2 324.215 2.150 20 10 DECDLO CNC(=O)OC[C@H]1CCCC[N@@H+]1Cc1cc(F)c(F)cc1O ZINC001182175406 795620823 /nfs/dbraw/zinc/62/08/23/795620823.db2.gz XQBXFINOROTSSM-LLVKDONJSA-N 1 2 314.332 2.381 20 10 DECDLO CNC(=O)OC[C@H]1CCCC[N@H+]1Cc1cc(F)c(F)cc1O ZINC001182175406 795620827 /nfs/dbraw/zinc/62/08/27/795620827.db2.gz XQBXFINOROTSSM-LLVKDONJSA-N 1 2 314.332 2.381 20 10 DECDLO COC[C@H]1CC[N@H+](Cc2c(O)ccc3c(C)cc(=O)oc32)C1 ZINC001139126556 796327695 /nfs/dbraw/zinc/32/76/95/796327695.db2.gz KFVUVQVZVVMBKA-LBPRGKRZSA-N 1 2 303.358 2.275 20 10 DECDLO COC[C@H]1CC[N@@H+](Cc2c(O)ccc3c(C)cc(=O)oc32)C1 ZINC001139126556 796327699 /nfs/dbraw/zinc/32/76/99/796327699.db2.gz KFVUVQVZVVMBKA-LBPRGKRZSA-N 1 2 303.358 2.275 20 10 DECDLO O=C1OCCN1C1CC[NH+](Cc2c(O)cc(F)cc2F)CC1 ZINC001140583517 796541554 /nfs/dbraw/zinc/54/15/54/796541554.db2.gz JJDCSGWCICARTD-UHFFFAOYSA-N 1 2 312.316 2.087 20 10 DECDLO Oc1cc(F)cc(F)c1C[N@@H+]1CCCN(c2ncccn2)CC1 ZINC001140583694 796541947 /nfs/dbraw/zinc/54/19/47/796541947.db2.gz QXQAHYJNVSSQEQ-UHFFFAOYSA-N 1 2 320.343 2.173 20 10 DECDLO Oc1cc(F)cc(F)c1C[N@H+]1CCCN(c2ncccn2)CC1 ZINC001140583694 796541950 /nfs/dbraw/zinc/54/19/50/796541950.db2.gz QXQAHYJNVSSQEQ-UHFFFAOYSA-N 1 2 320.343 2.173 20 10 DECDLO C[C@H]1CN(C)C(=O)C[N@@H+]1Cc1cc2c3c(c1)CCCN3CCC2 ZINC001141078498 796633027 /nfs/dbraw/zinc/63/30/27/796633027.db2.gz YIDGGXFOAHATCU-AWEZNQCLSA-N 1 2 313.445 2.048 20 10 DECDLO C[C@H]1CN(C)C(=O)C[N@H+]1Cc1cc2c3c(c1)CCCN3CCC2 ZINC001141078498 796633030 /nfs/dbraw/zinc/63/30/30/796633030.db2.gz YIDGGXFOAHATCU-AWEZNQCLSA-N 1 2 313.445 2.048 20 10 DECDLO Cc1cc(C)c(N(C)S(=O)(=O)Cc2ccc(N)cc2)c[nH+]1 ZINC001213513436 801617693 /nfs/dbraw/zinc/61/76/93/801617693.db2.gz KNQXHTYKCYAIMA-UHFFFAOYSA-N 1 2 305.403 2.247 20 10 DECDLO C[C@@H]([NH2+]CCCC(C)(C)CO)c1cccc(-c2nn[nH]n2)c1O ZINC001603662181 1070029466 /nfs/dbraw/zinc/02/94/66/1070029466.db2.gz GZSVMCPFAMNPIB-LLVKDONJSA-N 1 2 319.409 2.022 20 10 DECDLO Oc1cc(F)c(F)cc1C[NH2+]Cc1nc(-c2ccccn2)n[nH]1 ZINC001462241424 1058788478 /nfs/dbraw/zinc/78/84/78/1058788478.db2.gz WSGCCKAMSGHCFK-UHFFFAOYSA-N 1 2 317.299 2.140 20 10 DECDLO CNc1cc(CNC(=O)NCc2cccc(Cl)c2O)cc[nH+]1 ZINC001479595325 1061514490 /nfs/dbraw/zinc/51/44/90/1061514490.db2.gz BZPNJMRXHAJJAI-UHFFFAOYSA-N 1 2 320.780 2.482 20 10 DECDLO CC[N@@H+]1CC[C@@H]1C(=O)NCc1cc(Cl)cc(Cl)c1O ZINC001638305975 1078557062 /nfs/dbraw/zinc/55/70/62/1078557062.db2.gz SAYPRSBXQYERPE-LLVKDONJSA-N 1 2 303.189 2.409 20 10 DECDLO CC[N@H+]1CC[C@@H]1C(=O)NCc1cc(Cl)cc(Cl)c1O ZINC001638305975 1078557066 /nfs/dbraw/zinc/55/70/66/1078557066.db2.gz SAYPRSBXQYERPE-LLVKDONJSA-N 1 2 303.189 2.409 20 10 DECDLO CS(=O)(=O)CC1(C[NH2+]Cc2cc(Cl)cc(F)c2O)CC1 ZINC001560368747 1075138535 /nfs/dbraw/zinc/13/85/35/1075138535.db2.gz CPWRQJDFQRNJBB-UHFFFAOYSA-N 1 2 321.801 2.099 20 10 DECDLO C[C@@H]([NH2+]C[C@H]1CCC[C@@H](C)O1)c1cccc(-c2nn[nH]n2)c1O ZINC001590244328 1076596979 /nfs/dbraw/zinc/59/69/79/1076596979.db2.gz TWANHOJGNSUIMK-IJLUTSLNSA-N 1 2 317.393 2.181 20 10 DECDLO CC[C@H]([NH2+]C[C@@H](C)C[C@H](C)O)c1cccc(-c2nn[nH]n2)c1O ZINC001590464896 1076632139 /nfs/dbraw/zinc/63/21/39/1076632139.db2.gz RCXLMTUNNOAHGC-MJVIPROJSA-N 1 2 319.409 2.020 20 10 DECDLO OC[C@@H]([NH2+]Cc1cc(Cl)cc(F)c1O)C1CCOCC1 ZINC001620918030 1076890681 /nfs/dbraw/zinc/89/06/81/1076890681.db2.gz BHNZKEDJQCRZAG-CYBMUJFWSA-N 1 2 303.761 2.062 20 10 DECDLO O=C(c1cccc(O)c1O)N1CC[NH2+][C@H](c2ccc(F)cc2)C1 ZINC001594592173 1077054393 /nfs/dbraw/zinc/05/43/93/1077054393.db2.gz GDIBLKMIVYAOCQ-AWEZNQCLSA-N 1 2 316.332 2.024 20 10 DECDLO CS(=O)(=O)C[C@@H]1CCC[N@@H+](Cc2ccc(Cl)cc2O)C1 ZINC001652551536 1079883541 /nfs/dbraw/zinc/88/35/41/1079883541.db2.gz GBHQWABTXQGEQG-LLVKDONJSA-N 1 2 317.838 2.302 20 10 DECDLO C[N@H+](CC(=O)NCc1ccccc1)Cc1cc(F)c(F)cc1O ZINC001652695419 1079892162 /nfs/dbraw/zinc/89/21/62/1079892162.db2.gz BFAFUAUNQWZLGP-UHFFFAOYSA-N 1 2 320.339 2.419 20 10 DECDLO C[N@@H+](CC(=O)NCc1ccccc1)Cc1cc(F)c(F)cc1O ZINC001652695419 1079892165 /nfs/dbraw/zinc/89/21/65/1079892165.db2.gz BFAFUAUNQWZLGP-UHFFFAOYSA-N 1 2 320.339 2.419 20 10 DECDLO Cc1cc(Br)c(O)c(C[NH+]2CC3(CC(O)C3)C2)c1 ZINC001236673481 1138392531 /nfs/dbraw/zinc/39/25/31/1138392531.db2.gz MMYPDBHQZZAZDG-UHFFFAOYSA-N 1 2 312.207 2.420 20 10 DECDLO C[C@]1(CO)CC[N@H+](Cc2cc(Cl)c(Cl)cc2O)C[C@H]1O ZINC001236792098 1138430583 /nfs/dbraw/zinc/43/05/83/1138430583.db2.gz BMUHZYQPYOWYHW-ZIAGYGMSSA-N 1 2 320.216 2.264 20 10 DECDLO C[C@]1(CO)CC[N@@H+](Cc2cc(Cl)c(Cl)cc2O)C[C@H]1O ZINC001236792098 1138430584 /nfs/dbraw/zinc/43/05/84/1138430584.db2.gz BMUHZYQPYOWYHW-ZIAGYGMSSA-N 1 2 320.216 2.264 20 10 DECDLO Oc1c(Cl)cc(F)cc1C[N@@H+]1CC[C@@H](N2CCOCC2)C1 ZINC001237799593 1138791185 /nfs/dbraw/zinc/79/11/85/1138791185.db2.gz SDIMIILIVHRTNX-CYBMUJFWSA-N 1 2 314.788 2.091 20 10 DECDLO Oc1c(Cl)cc(F)cc1C[N@H+]1CC[C@@H](N2CCOCC2)C1 ZINC001237799593 1138791190 /nfs/dbraw/zinc/79/11/90/1138791190.db2.gz SDIMIILIVHRTNX-CYBMUJFWSA-N 1 2 314.788 2.091 20 10 DECDLO O=C1CCC2(CC[NH+](Cc3cc(F)cc(Cl)c3O)CC2)N1 ZINC001237801194 1138792954 /nfs/dbraw/zinc/79/29/54/1138792954.db2.gz FDMYQAFCUQXZEY-UHFFFAOYSA-N 1 2 312.772 2.429 20 10 DECDLO O=C1CC[N@@H+](Cc2cc(F)cc(Cl)c2O)C[C@H]2CCCN12 ZINC001237803935 1138794283 /nfs/dbraw/zinc/79/42/83/1138794283.db2.gz WOBBSNQRFGJGJL-GFCCVEGCSA-N 1 2 312.772 2.381 20 10 DECDLO O=C1CC[N@H+](Cc2cc(F)cc(Cl)c2O)C[C@H]2CCCN12 ZINC001237803935 1138794287 /nfs/dbraw/zinc/79/42/87/1138794287.db2.gz WOBBSNQRFGJGJL-GFCCVEGCSA-N 1 2 312.772 2.381 20 10 DECDLO CN1CCN(c2ccc(C[NH+]3CCSCC3)cc2F)CC1 ZINC001320475859 1140870488 /nfs/dbraw/zinc/87/04/88/1140870488.db2.gz QAIGPDGPFWJJEL-UHFFFAOYSA-N 1 2 309.454 2.126 20 10 DECDLO C[C@H]1C[C@H](N2CCOCC2)C[N@@H+]1Cc1cccc(Cl)c1O ZINC000377633478 291130399 /nfs/dbraw/zinc/13/03/99/291130399.db2.gz UVVAQXSWAFHJDL-JSGCOSHPSA-N 1 2 310.825 2.341 20 10 DECDLO C[C@H]1C[C@H](N2CCOCC2)C[N@H+]1Cc1cccc(Cl)c1O ZINC000377633478 291130401 /nfs/dbraw/zinc/13/04/01/291130401.db2.gz UVVAQXSWAFHJDL-JSGCOSHPSA-N 1 2 310.825 2.341 20 10 DECDLO C[C@H]([NH2+][C@@H]1C[N@@H+](C2CC2)C[C@H]1C)c1cc([N+](=O)[O-])ccc1[O-] ZINC000273568020 130139001 /nfs/dbraw/zinc/13/90/01/130139001.db2.gz KCFJENGABHAMTK-JRPNMDOOSA-N 1 2 305.378 2.434 20 10 DECDLO C[C@H]([NH2+][C@@H]1C[N@H+](C2CC2)C[C@H]1C)c1cc([N+](=O)[O-])ccc1[O-] ZINC000273568020 130139004 /nfs/dbraw/zinc/13/90/04/130139004.db2.gz KCFJENGABHAMTK-JRPNMDOOSA-N 1 2 305.378 2.434 20 10 DECDLO COc1c(O)c(C[N@@H+]2CCOCC23CCCC3)ccc1[N+](=O)[O-] ZINC000278321441 286187128 /nfs/dbraw/zinc/18/71/28/286187128.db2.gz YDXXSIJUABVPMF-UHFFFAOYSA-N 1 2 322.361 2.454 20 10 DECDLO COc1c(O)c(C[N@H+]2CCOCC23CCCC3)ccc1[N+](=O)[O-] ZINC000278321441 286187129 /nfs/dbraw/zinc/18/71/29/286187129.db2.gz YDXXSIJUABVPMF-UHFFFAOYSA-N 1 2 322.361 2.454 20 10 DECDLO C[N@H+](CCS(=O)(=O)c1ccccc1)Cc1ccccc1O ZINC000109768877 402275849 /nfs/dbraw/zinc/27/58/49/402275849.db2.gz XLGSNZUYHXPAGL-UHFFFAOYSA-N 1 2 305.399 2.298 20 10 DECDLO C[N@@H+](CCS(=O)(=O)c1ccccc1)Cc1ccccc1O ZINC000109768877 402275852 /nfs/dbraw/zinc/27/58/52/402275852.db2.gz XLGSNZUYHXPAGL-UHFFFAOYSA-N 1 2 305.399 2.298 20 10 DECDLO Oc1ccc(F)cc1CN1CC[NH+](Cc2ccncc2)CC1 ZINC000184714612 402294379 /nfs/dbraw/zinc/29/43/79/402294379.db2.gz DSVPGCAXLUZPMR-UHFFFAOYSA-N 1 2 301.365 2.244 20 10 DECDLO CO[C@@H]1C[N@H+](Cc2cc(Cl)cc(C(C)=O)c2O)C[C@@H]1OC ZINC000234862092 402361807 /nfs/dbraw/zinc/36/18/07/402361807.db2.gz BODMQSWRFMYQKB-OKILXGFUSA-N 1 2 313.781 2.094 20 10 DECDLO CO[C@@H]1C[N@@H+](Cc2cc(Cl)cc(C(C)=O)c2O)C[C@@H]1OC ZINC000234862092 402361810 /nfs/dbraw/zinc/36/18/10/402361810.db2.gz BODMQSWRFMYQKB-OKILXGFUSA-N 1 2 313.781 2.094 20 10 DECDLO CCS(=O)(=O)C[C@@H](C)[NH2+][C@H](C)c1ccc(F)c(F)c1O ZINC000187782104 402511702 /nfs/dbraw/zinc/51/17/02/402511702.db2.gz WLXVOIRDLUZSCT-RKDXNWHRSA-N 1 2 307.362 2.144 20 10 DECDLO C[C@@H]([NH2+]Cc1cc(Cl)cc(Cl)c1O)C(=O)NCCF ZINC000282573153 403156462 /nfs/dbraw/zinc/15/64/62/403156462.db2.gz FOZWDZJCPWFOPU-SSDOTTSWSA-N 1 2 309.168 2.263 20 10 DECDLO C[C@H]([NH2+][C@H](CO)C[C@H](O)C(C)(C)C)c1ccc(F)c(F)c1O ZINC000284368463 403266650 /nfs/dbraw/zinc/26/66/50/403266650.db2.gz ODAHKPFYKBXNIV-KWBADKCTSA-N 1 2 317.376 2.479 20 10 DECDLO OC[C@@H]1C[C@@H](F)C[N@@H+]1Cc1cc(Br)ccc1O ZINC000372635727 227095394 /nfs/dbraw/zinc/09/53/94/227095394.db2.gz CQMKCMNORHZPMG-MNOVXSKESA-N 1 2 304.159 2.059 20 10 DECDLO OC[C@@H]1C[C@@H](F)C[N@H+]1Cc1cc(Br)ccc1O ZINC000372635727 227095399 /nfs/dbraw/zinc/09/53/99/227095399.db2.gz CQMKCMNORHZPMG-MNOVXSKESA-N 1 2 304.159 2.059 20 10 DECDLO COc1cc(O)c(C[N@H+](C)[C@@H](C)C(=O)OC(C)C)cc1OC ZINC000271083130 522774766 /nfs/dbraw/zinc/77/47/66/522774766.db2.gz JQKBEZNRRZYKEG-NSHDSACASA-N 1 2 311.378 2.181 20 10 DECDLO COc1cc(O)c(C[N@@H+](C)[C@@H](C)C(=O)OC(C)C)cc1OC ZINC000271083130 522774776 /nfs/dbraw/zinc/77/47/76/522774776.db2.gz JQKBEZNRRZYKEG-NSHDSACASA-N 1 2 311.378 2.181 20 10 DECDLO Cc1cccc(C[N@@H+]2CCNC(=O)[C@H]2c2cccs2)c1O ZINC000373216984 534708682 /nfs/dbraw/zinc/70/86/82/534708682.db2.gz PFTORTASGKUNJX-CQSZACIVSA-N 1 2 302.399 2.435 20 10 DECDLO Cc1cccc(C[N@H+]2CCNC(=O)[C@H]2c2cccs2)c1O ZINC000373216984 534708690 /nfs/dbraw/zinc/70/86/90/534708690.db2.gz PFTORTASGKUNJX-CQSZACIVSA-N 1 2 302.399 2.435 20 10 DECDLO O=C1NCCCN1C1CC[NH+](Cc2cccc(Cl)c2O)CC1 ZINC000180466628 527063720 /nfs/dbraw/zinc/06/37/20/527063720.db2.gz HTZDQYMUDLHKQO-UHFFFAOYSA-N 1 2 323.824 2.425 20 10 DECDLO CC[N@H+](CCCN1C(=O)NC(C)(C)C1=O)c1ccc(OC)cc1 ZINC000299388886 528444927 /nfs/dbraw/zinc/44/49/27/528444927.db2.gz QOEBCERDBFYXEX-UHFFFAOYSA-N 1 2 319.405 2.242 20 10 DECDLO CC[N@@H+](CCCN1C(=O)NC(C)(C)C1=O)c1ccc(OC)cc1 ZINC000299388886 528444932 /nfs/dbraw/zinc/44/49/32/528444932.db2.gz QOEBCERDBFYXEX-UHFFFAOYSA-N 1 2 319.405 2.242 20 10 DECDLO CCN(Cc1ccc(N(C)C)cc1)C(=O)NCc1c[nH+]cn1C ZINC000292469484 625514404 /nfs/dbraw/zinc/51/44/04/625514404.db2.gz YPIXQHUEIAYNBO-UHFFFAOYSA-N 1 2 315.421 2.218 20 10 DECDLO CC[C@@H](CO)Nc1cc(NCc2ccc(N(C)C)cc2)[nH+]cn1 ZINC000891579280 624482881 /nfs/dbraw/zinc/48/28/81/624482881.db2.gz WTJSXUWYVGNURN-AWEZNQCLSA-N 1 2 315.421 2.338 20 10 DECDLO CC[C@@H](CO)Nc1cc(NCc2ccc(N(C)C)cc2)nc[nH+]1 ZINC000891579280 624482883 /nfs/dbraw/zinc/48/28/83/624482883.db2.gz WTJSXUWYVGNURN-AWEZNQCLSA-N 1 2 315.421 2.338 20 10 DECDLO COc1ccc(O)c([C@@H](C)NC(=O)[C@@H]2CCn3cc[nH+]c3C2)c1 ZINC000161404168 625039706 /nfs/dbraw/zinc/03/97/06/625039706.db2.gz NSPFDJNSGJVSIL-VXGBXAGGSA-N 1 2 315.373 2.037 20 10 DECDLO [NH2+]=C1Nc2nc3ccccc3n2[C@@H](c2cccc(Cl)c2O)N1 ZINC000124702979 633403792 /nfs/dbraw/zinc/40/37/92/633403792.db2.gz HBEQGFBFYDABCC-ZDUSSCGKSA-N 1 2 313.748 2.492 20 10 DECDLO C[C@H]([NH2+][C@H]1CNOC1)c1cc(Br)cc(Cl)c1O ZINC000925870651 635976099 /nfs/dbraw/zinc/97/60/99/635976099.db2.gz ZYEKMJPYTVQORI-XPUUQOCRSA-N 1 2 321.602 2.362 20 10 DECDLO OC[C@@H]1CCC[N@H+](Cc2cc(Br)cc(F)c2O)C1 ZINC000893863291 636049558 /nfs/dbraw/zinc/04/95/58/636049558.db2.gz DMTPAVKNYZTGHY-SECBINFHSA-N 1 2 318.186 2.498 20 10 DECDLO OC[C@@H]1CCC[N@@H+](Cc2cc(Br)cc(F)c2O)C1 ZINC000893863291 636049559 /nfs/dbraw/zinc/04/95/59/636049559.db2.gz DMTPAVKNYZTGHY-SECBINFHSA-N 1 2 318.186 2.498 20 10 DECDLO COC(=O)C[C@H]1CSCC[N@@H+]1Cc1cc(F)cc(F)c1O ZINC000894046582 636098561 /nfs/dbraw/zinc/09/85/61/636098561.db2.gz WPMZCILHCGRGSX-NSHDSACASA-N 1 2 317.357 2.151 20 10 DECDLO C[C@@H]1CC[N@H+](Cc2cc(Br)cc(F)c2O)[C@H]1CO ZINC000894533462 637093820 /nfs/dbraw/zinc/09/38/20/637093820.db2.gz MSLILADODOAQFB-PELKAZGASA-N 1 2 318.186 2.497 20 10 DECDLO C[C@@H]1CC[N@@H+](Cc2cc(Br)cc(F)c2O)[C@H]1CO ZINC000894533462 637093824 /nfs/dbraw/zinc/09/38/24/637093824.db2.gz MSLILADODOAQFB-PELKAZGASA-N 1 2 318.186 2.497 20 10 DECDLO CC1(C)C[N@H+](Cc2cc(F)cc(F)c2O)C[C@]2(CCOC2)O1 ZINC000894627969 637136516 /nfs/dbraw/zinc/13/65/16/637136516.db2.gz BYDMKKAISVKNTI-INIZCTEOSA-N 1 2 313.344 2.440 20 10 DECDLO CC1(C)C[N@@H+](Cc2cc(F)cc(F)c2O)C[C@]2(CCOC2)O1 ZINC000894627969 637136520 /nfs/dbraw/zinc/13/65/20/637136520.db2.gz BYDMKKAISVKNTI-INIZCTEOSA-N 1 2 313.344 2.440 20 10 DECDLO CC1(C)C[N@H+](Cc2cc(F)cc(F)c2O)C[C@@]2(CCOC2)O1 ZINC000894627970 637136677 /nfs/dbraw/zinc/13/66/77/637136677.db2.gz BYDMKKAISVKNTI-MRXNPFEDSA-N 1 2 313.344 2.440 20 10 DECDLO CC1(C)C[N@@H+](Cc2cc(F)cc(F)c2O)C[C@@]2(CCOC2)O1 ZINC000894627970 637136683 /nfs/dbraw/zinc/13/66/83/637136683.db2.gz BYDMKKAISVKNTI-MRXNPFEDSA-N 1 2 313.344 2.440 20 10 DECDLO OCCC[N@@H+](Cc1ccccn1)Cc1cc(F)cc(F)c1O ZINC000894770750 637199474 /nfs/dbraw/zinc/19/94/74/637199474.db2.gz QKSHRCXYOTZIHQ-UHFFFAOYSA-N 1 2 308.328 2.450 20 10 DECDLO C[C@H](CCO)[N@H+](C)Cc1cc(Br)cc(F)c1O ZINC000895149988 637671435 /nfs/dbraw/zinc/67/14/35/637671435.db2.gz VKNYOTDZWOLTQO-MRVPVSSYSA-N 1 2 306.175 2.497 20 10 DECDLO C[C@H](CCO)[N@@H+](C)Cc1cc(Br)cc(F)c1O ZINC000895149988 637671436 /nfs/dbraw/zinc/67/14/36/637671436.db2.gz VKNYOTDZWOLTQO-MRVPVSSYSA-N 1 2 306.175 2.497 20 10 DECDLO C[C@@H]([NH2+][C@@H](C)c1cc(F)cc(F)c1O)[C@H]1CN(C)CCO1 ZINC000756762326 639692902 /nfs/dbraw/zinc/69/29/02/639692902.db2.gz XPJVOEJXTPUXMK-IMSIIYSGSA-N 1 2 300.349 2.040 20 10 DECDLO C[C@@H]1C[N@H+](CCO)[C@@H](C)CN1Cc1cc(Cl)cc(F)c1O ZINC000841891367 650594425 /nfs/dbraw/zinc/59/44/25/650594425.db2.gz KQVRRJZDCXUUSE-WDEREUQCSA-N 1 2 316.804 2.072 20 10 DECDLO C[C@@H]1C[N@@H+](CCO)[C@@H](C)CN1Cc1cc(Cl)cc(F)c1O ZINC000841891367 650594426 /nfs/dbraw/zinc/59/44/26/650594426.db2.gz KQVRRJZDCXUUSE-WDEREUQCSA-N 1 2 316.804 2.072 20 10 DECDLO CCN(CC)c1ccc(C[NH+]2CC3(C2)CCNC(=O)O3)cc1 ZINC000897752565 640915727 /nfs/dbraw/zinc/91/57/27/640915727.db2.gz IERWVKNDXFWLKB-UHFFFAOYSA-N 1 2 303.406 2.217 20 10 DECDLO COc1cc(C[N@@H+](C)Cc2nc([C@H](C)OC)no2)c(O)cc1C ZINC000768462643 641084233 /nfs/dbraw/zinc/08/42/33/641084233.db2.gz AZINHYHEQUHECT-NSHDSACASA-N 1 2 321.377 2.432 20 10 DECDLO COc1cc(C[N@H+](C)Cc2nc([C@H](C)OC)no2)c(O)cc1C ZINC000768462643 641084239 /nfs/dbraw/zinc/08/42/39/641084239.db2.gz AZINHYHEQUHECT-NSHDSACASA-N 1 2 321.377 2.432 20 10 DECDLO COC(=O)C[N@@H+](Cc1cc(Br)ccc1O)C1CC1 ZINC000770281865 641353631 /nfs/dbraw/zinc/35/36/31/641353631.db2.gz XVTBDNZTTIOPKS-UHFFFAOYSA-N 1 2 314.179 2.292 20 10 DECDLO CC[NH+](CC)C[C@@H](C)NCc1ccc([N+](=O)[O-])c(OC)c1O ZINC000775014881 641994236 /nfs/dbraw/zinc/99/42/36/641994236.db2.gz VKFLIMUGIAVDFV-LLVKDONJSA-N 1 2 311.382 2.129 20 10 DECDLO COc1c(O)c(C[NH2+][C@H](C)c2nnc(C)s2)ccc1[N+](=O)[O-] ZINC000775063206 642001498 /nfs/dbraw/zinc/00/14/98/642001498.db2.gz ODNLDEDAMZNQHI-SSDOTTSWSA-N 1 2 324.362 2.320 20 10 DECDLO COCC1(O)CC[NH+](Cc2cc(Cl)cc(F)c2O)CC1 ZINC000775707400 642082075 /nfs/dbraw/zinc/08/20/75/642082075.db2.gz IBPOQTBBNFHUPI-UHFFFAOYSA-N 1 2 303.761 2.158 20 10 DECDLO CN(C)c1ccc(CN(C)C(=O)C[N@@H+]2CCC[C@H](F)C2)cc1 ZINC000903001160 643219865 /nfs/dbraw/zinc/21/98/65/643219865.db2.gz LRVYIWNMFNCTOW-HNNXBMFYSA-N 1 2 307.413 2.145 20 10 DECDLO CN(C)c1ccc(CN(C)C(=O)C[N@H+]2CCC[C@H](F)C2)cc1 ZINC000903001160 643219867 /nfs/dbraw/zinc/21/98/67/643219867.db2.gz LRVYIWNMFNCTOW-HNNXBMFYSA-N 1 2 307.413 2.145 20 10 DECDLO CCOC(=O)[C@@H]([NH2+]Cc1cc(C)ccc1O)[C@H]1CCCOC1 ZINC000789578203 643750710 /nfs/dbraw/zinc/75/07/10/643750710.db2.gz BVIFEXRSYGSKBY-BBRMVZONSA-N 1 2 307.390 2.149 20 10 DECDLO CCOC(=O)[C@@H]([NH2+]Cc1cc(C)ccc1O)C1CCOCC1 ZINC000789582019 643751359 /nfs/dbraw/zinc/75/13/59/643751359.db2.gz TZXQXDZLCXSLDM-INIZCTEOSA-N 1 2 307.390 2.149 20 10 DECDLO COc1c(C)c[nH+]c(CNC(=O)c2c(F)ccc(O)c2O)c1C ZINC000789967963 643796975 /nfs/dbraw/zinc/79/69/75/643796975.db2.gz ZHABNCAMCGOANF-UHFFFAOYSA-N 1 2 320.320 2.187 20 10 DECDLO COc1cc(C[N@H+]2CC(=O)N(C)[C@H](C)C2)c(O)c(C(C)(C)C)c1 ZINC000799957075 645237528 /nfs/dbraw/zinc/23/75/28/645237528.db2.gz ZHYDJUJGTNGSOJ-GFCCVEGCSA-N 1 2 320.433 2.361 20 10 DECDLO COc1cc(C[N@@H+]2CC(=O)N(C)[C@H](C)C2)c(O)c(C(C)(C)C)c1 ZINC000799957075 645237531 /nfs/dbraw/zinc/23/75/31/645237531.db2.gz ZHYDJUJGTNGSOJ-GFCCVEGCSA-N 1 2 320.433 2.361 20 10 DECDLO CCC[N@H+](Cc1cccc(Cl)c1O)[C@@H]1CC(=O)N(C)C1=O ZINC000802655830 645540693 /nfs/dbraw/zinc/54/06/93/645540693.db2.gz FYLMDEGHOHILMD-GFCCVEGCSA-N 1 2 310.781 2.015 20 10 DECDLO CCC[N@@H+](Cc1cccc(Cl)c1O)[C@@H]1CC(=O)N(C)C1=O ZINC000802655830 645540695 /nfs/dbraw/zinc/54/06/95/645540695.db2.gz FYLMDEGHOHILMD-GFCCVEGCSA-N 1 2 310.781 2.015 20 10 DECDLO C[C@@H]([NH2+][C@@H]1CCc2[nH+]c[nH]c2C1)c1cc([N+](=O)[O-])ccc1[O-] ZINC000810253842 646345680 /nfs/dbraw/zinc/34/56/80/646345680.db2.gz DYHRNPVIHQHPBU-NXEZZACHSA-N 1 2 302.334 2.232 20 10 DECDLO CC[C@@H]([NH2+][C@@H]1CCC(=O)N(C)C1=O)c1cccc(Cl)c1O ZINC000818362305 647458146 /nfs/dbraw/zinc/45/81/46/647458146.db2.gz UUGYTOVRYNCMTD-VXGBXAGGSA-N 1 2 310.781 2.234 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@H+](C)C[C@@H](O)C(F)(F)F)c1O ZINC000181338457 648624458 /nfs/dbraw/zinc/62/44/58/648624458.db2.gz XCITXCQVUVFDSQ-LLVKDONJSA-N 1 2 309.259 2.089 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@@H+](C)C[C@@H](O)C(F)(F)F)c1O ZINC000181338457 648624459 /nfs/dbraw/zinc/62/44/59/648624459.db2.gz XCITXCQVUVFDSQ-LLVKDONJSA-N 1 2 309.259 2.089 20 10 DECDLO CS(=O)(=O)C[C@@H]1CCCC[N@@H+]1Cc1cc(Cl)ccc1O ZINC000824914771 648671828 /nfs/dbraw/zinc/67/18/28/648671828.db2.gz YRKRQABWKHIKMY-ZDUSSCGKSA-N 1 2 317.838 2.445 20 10 DECDLO CS(=O)(=O)C[C@@H]1CCCC[N@H+]1Cc1cc(Cl)ccc1O ZINC000824914771 648671830 /nfs/dbraw/zinc/67/18/30/648671830.db2.gz YRKRQABWKHIKMY-ZDUSSCGKSA-N 1 2 317.838 2.445 20 10 DECDLO O=C1CC[C@@H]2C[N@H+](Cc3cc(Cl)cc(F)c3O)CC[C@@H]2N1 ZINC000827133975 648979484 /nfs/dbraw/zinc/97/94/84/648979484.db2.gz YVENFIHHJVVRTE-RNCFNFMXSA-N 1 2 312.772 2.285 20 10 DECDLO O=C1CC[C@@H]2C[N@@H+](Cc3cc(Cl)cc(F)c3O)CC[C@@H]2N1 ZINC000827133975 648979486 /nfs/dbraw/zinc/97/94/86/648979486.db2.gz YVENFIHHJVVRTE-RNCFNFMXSA-N 1 2 312.772 2.285 20 10 DECDLO COCC[N@H+](C)CC(=O)c1cc(C)n(-c2ccc(F)cn2)c1C ZINC000827472465 649039611 /nfs/dbraw/zinc/03/96/11/649039611.db2.gz GSSIGMMIWXHOOI-UHFFFAOYSA-N 1 2 319.380 2.389 20 10 DECDLO COCC[N@@H+](C)CC(=O)c1cc(C)n(-c2ccc(F)cn2)c1C ZINC000827472465 649039613 /nfs/dbraw/zinc/03/96/13/649039613.db2.gz GSSIGMMIWXHOOI-UHFFFAOYSA-N 1 2 319.380 2.389 20 10 DECDLO CC[C@H]1C[N@H+](Cc2ccc([N+](=O)[O-])c(OC)c2O)[C@H](C)CO1 ZINC000846042210 651303872 /nfs/dbraw/zinc/30/38/72/651303872.db2.gz AMCSOEURZPEJDV-PWSUYJOCSA-N 1 2 310.350 2.308 20 10 DECDLO CC[C@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])c(OC)c2O)[C@H](C)CO1 ZINC000846042210 651303874 /nfs/dbraw/zinc/30/38/74/651303874.db2.gz AMCSOEURZPEJDV-PWSUYJOCSA-N 1 2 310.350 2.308 20 10 DECDLO C[C@@H]([NH2+]CC[C@]1(O)CCCOC1)c1cc(F)cc(F)c1O ZINC000846210648 651315384 /nfs/dbraw/zinc/31/53/84/651315384.db2.gz AOLIYYMSMRYYPH-MEBBXXQBSA-N 1 2 301.333 2.253 20 10 DECDLO CCOc1ccc(O)c(C[NH2+]Cc2nc([C@H]3CCCO3)n[nH]2)c1 ZINC000848562104 651471264 /nfs/dbraw/zinc/47/12/64/651471264.db2.gz HHEUNDOLDCPHJV-CQSZACIVSA-N 1 2 318.377 2.050 20 10 DECDLO CCOC(=O)[C@@H]([NH2+]Cc1cccc(CC)c1O)C1CCOCC1 ZINC000848905939 651553899 /nfs/dbraw/zinc/55/38/99/651553899.db2.gz NHVQXVZMBXYQFX-INIZCTEOSA-N 1 2 321.417 2.403 20 10 DECDLO CO[C@H](C[NH2+][C@@H](C)c1cc(F)cc(F)c1O)[C@@H]1CCOC1 ZINC000850484921 651937196 /nfs/dbraw/zinc/93/71/96/651937196.db2.gz ULDMSLVZKDBLKC-IMSIIYSGSA-N 1 2 301.333 2.373 20 10 DECDLO Cc1cc(C(=O)C[N@@H+]2CC[C@H](O)C2)c(C)n1-c1cccc(F)c1 ZINC000114470150 651956693 /nfs/dbraw/zinc/95/66/93/651956693.db2.gz BQOZESMYZLJBMH-INIZCTEOSA-N 1 2 316.376 2.483 20 10 DECDLO Cc1cc(C(=O)C[N@H+]2CC[C@H](O)C2)c(C)n1-c1cccc(F)c1 ZINC000114470150 651956700 /nfs/dbraw/zinc/95/67/00/651956700.db2.gz BQOZESMYZLJBMH-INIZCTEOSA-N 1 2 316.376 2.483 20 10 DECDLO CC1(C)COCC[N@@H+]1Cc1ccc(N2CCOCC2)c(F)c1 ZINC000130881566 684193621 /nfs/dbraw/zinc/19/36/21/684193621.db2.gz ZZJJOQOQXCRBDQ-UHFFFAOYSA-N 1 2 308.397 2.273 20 10 DECDLO CC1(C)COCC[N@H+]1Cc1ccc(N2CCOCC2)c(F)c1 ZINC000130881566 684193622 /nfs/dbraw/zinc/19/36/22/684193622.db2.gz ZZJJOQOQXCRBDQ-UHFFFAOYSA-N 1 2 308.397 2.273 20 10 DECDLO O=C(NCc1ccc2cccnc2c1O)[C@@H]1CCn2cc[nH+]c2C1 ZINC000862025038 686224512 /nfs/dbraw/zinc/22/45/12/686224512.db2.gz LRHMBSKGARCVME-CYBMUJFWSA-N 1 2 322.368 2.016 20 10 DECDLO OC[C@@]1(F)CC[N@@H+](Cc2c(O)cccc2Br)C1 ZINC000862357921 686280708 /nfs/dbraw/zinc/28/07/08/686280708.db2.gz MWALHPSTAOOMAL-GFCCVEGCSA-N 1 2 304.159 2.061 20 10 DECDLO OC[C@@]1(F)CC[N@H+](Cc2c(O)cccc2Br)C1 ZINC000862357921 686280702 /nfs/dbraw/zinc/28/07/02/686280702.db2.gz MWALHPSTAOOMAL-GFCCVEGCSA-N 1 2 304.159 2.061 20 10 DECDLO CC(C)=CC[NH+]1CC(NC(=O)c2ccc(N=NC(N)=O)cc2)C1 ZINC001031459427 688923441 /nfs/dbraw/zinc/92/34/41/688923441.db2.gz SPZRJFBNYIHJRC-UHFFFAOYSA-N 1 2 315.377 2.229 20 10 DECDLO COc1ccc(N2CC[NH+](Cc3cnoc3C)CC2)c(OC)c1 ZINC000879463528 690646888 /nfs/dbraw/zinc/64/68/88/690646888.db2.gz ZSNLIWQBBQAYAY-UHFFFAOYSA-N 1 2 317.389 2.322 20 10 DECDLO CNc1cc(CNC(=O)N(C)Cc2ccccc2O)cc[nH+]1 ZINC001348263074 1151139380 /nfs/dbraw/zinc/13/93/80/1151139380.db2.gz FIAOZTHUFNJDAP-UHFFFAOYSA-N 1 2 300.362 2.171 20 10 DECDLO COc1cc(O)c(CN2CC[NH2+]CC(F)(F)C2)c(Cl)c1 ZINC001211348367 777037170 /nfs/dbraw/zinc/03/71/70/777037170.db2.gz YPMWOKRLLDBMAZ-UHFFFAOYSA-N 1 2 306.740 2.095 20 10 DECDLO OC[C@@H]1CCC[N@H+](Cc2cc(Br)c(F)cc2O)C1 ZINC001144299221 790849516 /nfs/dbraw/zinc/84/95/16/790849516.db2.gz SAVUVZCMZDEEMN-SECBINFHSA-N 1 2 318.186 2.498 20 10 DECDLO OC[C@@H]1CCC[N@@H+](Cc2cc(Br)c(F)cc2O)C1 ZINC001144299221 790849528 /nfs/dbraw/zinc/84/95/28/790849528.db2.gz SAVUVZCMZDEEMN-SECBINFHSA-N 1 2 318.186 2.498 20 10 DECDLO Oc1c(F)cc(Br)cc1C[NH2+]C[C@H]1C[C@H](O)C1 ZINC000715744675 792509693 /nfs/dbraw/zinc/50/96/93/792509693.db2.gz IADLOQLUTWSENO-GVJMRKKJSA-N 1 2 304.159 2.154 20 10 DECDLO COC[C@H]1Cn2nccc2C[N@H+](Cc2c(O)cccc2F)C1 ZINC001137835760 796144334 /nfs/dbraw/zinc/14/43/34/796144334.db2.gz MYCBYZASQFFIPG-GFCCVEGCSA-N 1 2 305.353 2.006 20 10 DECDLO COC[C@H]1Cn2nccc2C[N@@H+](Cc2c(O)cccc2F)C1 ZINC001137835760 796144336 /nfs/dbraw/zinc/14/43/36/796144336.db2.gz MYCBYZASQFFIPG-GFCCVEGCSA-N 1 2 305.353 2.006 20 10 DECDLO O=C(c1ccccc1)N1CC[NH+](Cc2c(O)cccc2F)CC1 ZINC001137831994 796144473 /nfs/dbraw/zinc/14/44/73/796144473.db2.gz VYWZGADBKCZOKG-UHFFFAOYSA-N 1 2 314.360 2.489 20 10 DECDLO CCn1ncc2c1[C@@H](COC)C[N@H+](Cc1cccc(F)c1O)C2 ZINC001138125303 796168036 /nfs/dbraw/zinc/16/80/36/796168036.db2.gz NNANDFXIMWKANB-CQSZACIVSA-N 1 2 319.380 2.494 20 10 DECDLO CCn1ncc2c1[C@@H](COC)C[N@@H+](Cc1cccc(F)c1O)C2 ZINC001138125303 796168039 /nfs/dbraw/zinc/16/80/39/796168039.db2.gz NNANDFXIMWKANB-CQSZACIVSA-N 1 2 319.380 2.494 20 10 DECDLO C[C@@H]([NH2+]Cc1ccc(N2CCOCC2)c(F)c1)c1csnn1 ZINC001202859711 796264725 /nfs/dbraw/zinc/26/47/25/796264725.db2.gz JXMKDKZVKTVISB-LLVKDONJSA-N 1 2 322.409 2.365 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1C[C@H](CO)CC[C@@H]1C ZINC001139126689 796327976 /nfs/dbraw/zinc/32/79/76/796327976.db2.gz MSYZVXWFZHMVTH-QWHCGFSZSA-N 1 2 317.385 2.400 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1C[C@H](CO)CC[C@@H]1C ZINC001139126689 796327981 /nfs/dbraw/zinc/32/79/81/796327981.db2.gz MSYZVXWFZHMVTH-QWHCGFSZSA-N 1 2 317.385 2.400 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+](C)[C@@H]1CCCOC1 ZINC001139129909 796328770 /nfs/dbraw/zinc/32/87/70/796328770.db2.gz KBEZANIDOUFFFW-GFCCVEGCSA-N 1 2 303.358 2.418 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+](C)[C@@H]1CCCOC1 ZINC001139129909 796328775 /nfs/dbraw/zinc/32/87/75/796328775.db2.gz KBEZANIDOUFFFW-GFCCVEGCSA-N 1 2 303.358 2.418 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CCC[C@@H](O)[C@@H](C)C1 ZINC001139127488 796328924 /nfs/dbraw/zinc/32/89/24/796328924.db2.gz WZOBKWOATSVQET-SWLSCSKDSA-N 1 2 317.385 2.400 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CCC[C@@H](O)[C@@H](C)C1 ZINC001139127488 796328928 /nfs/dbraw/zinc/32/89/28/796328928.db2.gz WZOBKWOATSVQET-SWLSCSKDSA-N 1 2 317.385 2.400 20 10 DECDLO O=C(C1CCC1)N1CC[NH+](Cc2c(O)cccc2Cl)CC1 ZINC001140341577 796509187 /nfs/dbraw/zinc/50/91/87/796509187.db2.gz XAOXQKSALJJGAF-UHFFFAOYSA-N 1 2 308.809 2.490 20 10 DECDLO CC(=O)[C@H]1C[N@H+](Cc2cc3c4c(c2)CCCN4CCC3)CCO1 ZINC001141079076 796632584 /nfs/dbraw/zinc/63/25/84/796632584.db2.gz RVKZTIDPIODRFC-GOSISDBHSA-N 1 2 314.429 2.175 20 10 DECDLO CC(=O)[C@H]1C[N@@H+](Cc2cc3c4c(c2)CCCN4CCC3)CCO1 ZINC001141079076 796632586 /nfs/dbraw/zinc/63/25/86/796632586.db2.gz RVKZTIDPIODRFC-GOSISDBHSA-N 1 2 314.429 2.175 20 10 DECDLO CCOC(=O)[C@@]12C[C@@H]1CC[N@@H+]2Cc1ccc2c(c1)OCCN2C ZINC001141142094 796638651 /nfs/dbraw/zinc/63/86/51/796638651.db2.gz FICHHXJPVJZUDM-KBXCAEBGSA-N 1 2 316.401 2.043 20 10 DECDLO CCOC(=O)[C@@]12C[C@@H]1CC[N@H+]2Cc1ccc2c(c1)OCCN2C ZINC001141142094 796638658 /nfs/dbraw/zinc/63/86/58/796638658.db2.gz FICHHXJPVJZUDM-KBXCAEBGSA-N 1 2 316.401 2.043 20 10 DECDLO CCOC(=O)[C@@H]1C[N@H+](Cc2cc(F)c(F)cc2O)CCS1 ZINC001142530989 796748166 /nfs/dbraw/zinc/74/81/66/796748166.db2.gz NINNBJIAFUANAM-ZDUSSCGKSA-N 1 2 317.357 2.151 20 10 DECDLO CCOC(=O)[C@@H]1C[N@@H+](Cc2cc(F)c(F)cc2O)CCS1 ZINC001142530989 796748167 /nfs/dbraw/zinc/74/81/67/796748167.db2.gz NINNBJIAFUANAM-ZDUSSCGKSA-N 1 2 317.357 2.151 20 10 DECDLO Cc1ccnc(N2CC[NH+](Cc3cc(F)c(F)cc3O)CC2)n1 ZINC001142531392 796748475 /nfs/dbraw/zinc/74/84/75/796748475.db2.gz WCARNYMLZQIHAK-UHFFFAOYSA-N 1 2 320.343 2.091 20 10 DECDLO COc1ccc(C[NH+]2CC(NC(=O)OC(C)(C)C)C2)c(O)c1 ZINC001203621280 800091054 /nfs/dbraw/zinc/09/10/54/800091054.db2.gz RBEOYRPZHKQRHF-UHFFFAOYSA-N 1 2 308.378 2.110 20 10 DECDLO COc1ccc(O)c(C[N@@H+]2CC[C@@](O)(C(F)(F)F)[C@H](F)C2)c1 ZINC001203669455 800102959 /nfs/dbraw/zinc/10/29/59/800102959.db2.gz CVEURGFPPCVYND-OLZOCXBDSA-N 1 2 323.286 2.238 20 10 DECDLO COc1ccc(O)c(C[N@H+]2CC[C@@](O)(C(F)(F)F)[C@H](F)C2)c1 ZINC001203669455 800102961 /nfs/dbraw/zinc/10/29/61/800102961.db2.gz CVEURGFPPCVYND-OLZOCXBDSA-N 1 2 323.286 2.238 20 10 DECDLO CC(C)(C)OC(=O)N1CC[N@H+](Cc2ccc(O)cc2O)[C@H]2C[C@H]21 ZINC001204276787 800199473 /nfs/dbraw/zinc/19/94/73/800199473.db2.gz RHJYEMWERDUWAB-UONOGXRCSA-N 1 2 320.389 2.291 20 10 DECDLO CC(C)(C)OC(=O)N1CC[N@@H+](Cc2ccc(O)cc2O)[C@H]2C[C@H]21 ZINC001204276787 800199476 /nfs/dbraw/zinc/19/94/76/800199476.db2.gz RHJYEMWERDUWAB-UONOGXRCSA-N 1 2 320.389 2.291 20 10 DECDLO COc1cc(N(C)C)ccc1C[N@@H+]1CC(=O)NC2(CCCC2)C1 ZINC001231857347 801739001 /nfs/dbraw/zinc/73/90/01/801739001.db2.gz HMWPHVPJWROVBQ-UHFFFAOYSA-N 1 2 317.433 2.006 20 10 DECDLO COc1cc(N(C)C)ccc1C[N@H+]1CC(=O)NC2(CCCC2)C1 ZINC001231857347 801739005 /nfs/dbraw/zinc/73/90/05/801739005.db2.gz HMWPHVPJWROVBQ-UHFFFAOYSA-N 1 2 317.433 2.006 20 10 DECDLO COc1ccc(N2CC[NH+](Cc3cncc(O)c3)CC2)c(C)c1 ZINC001232044918 801780910 /nfs/dbraw/zinc/78/09/10/801780910.db2.gz YLAXRHYXOWQSKK-UHFFFAOYSA-N 1 2 313.401 2.426 20 10 DECDLO COC(=O)[C@@]1(F)CC[N@@H+](Cc2cc(Cl)c(OC)cc2O)C1 ZINC001232263928 801832590 /nfs/dbraw/zinc/83/25/90/801832590.db2.gz BOTPWVRFRNFDHA-CQSZACIVSA-N 1 2 317.744 2.141 20 10 DECDLO Oc1cc(I)ccc1C[NH+]1CC=CC1 ZINC001232974006 801995356 /nfs/dbraw/zinc/99/53/56/801995356.db2.gz FILDTJAOQGTONS-UHFFFAOYSA-N 1 2 301.127 2.369 20 10 DECDLO CN1C[C@@]2(CC1=O)CCCC[N@@H+]2Cc1ccc(F)c(F)c1O ZINC001233074011 802020662 /nfs/dbraw/zinc/02/06/62/802020662.db2.gz GEKCFWCBVXWHKJ-INIZCTEOSA-N 1 2 310.344 2.257 20 10 DECDLO CN1C[C@@]2(CC1=O)CCCC[N@H+]2Cc1ccc(F)c(F)c1O ZINC001233074011 802020669 /nfs/dbraw/zinc/02/06/69/802020669.db2.gz GEKCFWCBVXWHKJ-INIZCTEOSA-N 1 2 310.344 2.257 20 10 DECDLO CCO[C@@H]1C[N@H+](Cc2ccc(F)c(F)c2O)[C@@H]2CCCO[C@H]12 ZINC001233074085 802020844 /nfs/dbraw/zinc/02/08/44/802020844.db2.gz GWEFWEAYCVNBBT-IOASZLSFSA-N 1 2 313.344 2.439 20 10 DECDLO C[C@H]([NH2+]Cc1cc(N(C)C)cc[nH+]1)c1cc(C(=O)[O-])ccc1O ZINC001593292110 994674916 /nfs/dbraw/zinc/67/49/16/994674916.db2.gz IFGHZULDYOHFEG-NSHDSACASA-N 1 2 315.373 2.402 20 10 DECDLO CCOC(=O)CC(C)(C)CC(=O)C(=O)CCCn1cc[nH+]c1 ZINC001627026477 1078268969 /nfs/dbraw/zinc/26/89/69/1078268969.db2.gz KXOQAOVXPCTFLC-UHFFFAOYSA-N 1 2 308.378 2.171 20 10 DECDLO CC(C)CN1C[C@@]2(F)C[N@H+](Cc3ccccc3O)C[C@@]2(F)C1=O ZINC001272619557 1079017359 /nfs/dbraw/zinc/01/73/59/1079017359.db2.gz WZUWLGIDXQKOBI-DLBZAZTESA-N 1 2 324.371 2.123 20 10 DECDLO CC(C)CN1C[C@@]2(F)C[N@@H+](Cc3ccccc3O)C[C@@]2(F)C1=O ZINC001272619557 1079017362 /nfs/dbraw/zinc/01/73/62/1079017362.db2.gz WZUWLGIDXQKOBI-DLBZAZTESA-N 1 2 324.371 2.123 20 10 DECDLO C[C@@H]([NH2+][C@@H](C)c1cccc(-c2nn[nH]n2)c1O)[C@@H]1CCCOC1 ZINC001589949968 1076532346 /nfs/dbraw/zinc/53/23/46/1076532346.db2.gz PDXMTHXRNWOBBM-GRYCIOLGSA-N 1 2 317.393 2.038 20 10 DECDLO C[C@@H]([NH2+]CC[C@H]1CC1(F)F)c1cccc(-c2nn[nH]n2)c1O ZINC001589962910 1076537049 /nfs/dbraw/zinc/53/70/49/1076537049.db2.gz VFIAUTCVZMGHEW-BDAKNGLRSA-N 1 2 309.320 2.268 20 10 DECDLO C[C@@H]([NH2+]C[C@H]1CCOC1(C)C)c1cccc(-c2nn[nH]n2)c1O ZINC001589962087 1076537070 /nfs/dbraw/zinc/53/70/70/1076537070.db2.gz GJRIIEQYKPIKTN-GHMZBOCLSA-N 1 2 317.393 2.038 20 10 DECDLO CSC1(C[NH2+][C@@H](C)c2cccc(-c3nn[nH]n3)c2O)CC1 ZINC001591688177 1076771057 /nfs/dbraw/zinc/77/10/57/1076771057.db2.gz IRMUEVURVSMUSO-VIFPVBQESA-N 1 2 305.407 2.119 20 10 DECDLO Oc1cccc(F)c1C[NH2+]Cc1ccc(-c2nn[nH]n2)c(F)c1 ZINC001593540007 1077019883 /nfs/dbraw/zinc/01/98/83/1077019883.db2.gz LYPDUBXIQTZJLL-UHFFFAOYSA-N 1 2 317.299 2.140 20 10 DECDLO C[NH+]1CCC(CCO)([NH2+]Cc2cc(Cl)cc(F)c2[O-])CC1 ZINC001620985754 1077112898 /nfs/dbraw/zinc/11/28/98/1077112898.db2.gz ULNZNYAUBTXCLB-UHFFFAOYSA-N 1 2 316.804 2.121 20 10 DECDLO C[C@@H](CS(C)(=O)=O)[N@H+](Cc1cc(F)c(F)cc1O)C1CC1 ZINC001651952306 1079842411 /nfs/dbraw/zinc/84/24/11/1079842411.db2.gz LBPXBILSUIOXFG-VIFPVBQESA-N 1 2 319.373 2.068 20 10 DECDLO C[C@@H](CS(C)(=O)=O)[N@@H+](Cc1cc(F)c(F)cc1O)C1CC1 ZINC001651952306 1079842415 /nfs/dbraw/zinc/84/24/15/1079842415.db2.gz LBPXBILSUIOXFG-VIFPVBQESA-N 1 2 319.373 2.068 20 10 DECDLO COC(=O)C[C@@H]1C[N@H+](Cc2cc(C(C)C)ccc2O)CCO1 ZINC001657252247 1080166935 /nfs/dbraw/zinc/16/69/35/1080166935.db2.gz IICHIUSGLCLFQO-OAHLLOKOSA-N 1 2 307.390 2.280 20 10 DECDLO COC(=O)C[C@@H]1C[N@@H+](Cc2cc(C(C)C)ccc2O)CCO1 ZINC001657252247 1080166937 /nfs/dbraw/zinc/16/69/37/1080166937.db2.gz IICHIUSGLCLFQO-OAHLLOKOSA-N 1 2 307.390 2.280 20 10 DECDLO COc1ccc(N2CC3(C2)C[NH+](Cc2cc(C)nn2C)C3)cc1 ZINC001276926577 1083683701 /nfs/dbraw/zinc/68/37/01/1083683701.db2.gz GGKOBAHDEZWAGN-UHFFFAOYSA-N 1 2 312.417 2.059 20 10 DECDLO CC(C)(C)c1ccc(C[N@@H+]2CCn3cnc(CO)c3C2)c(O)c1 ZINC001235506822 1084449958 /nfs/dbraw/zinc/44/99/58/1084449958.db2.gz HDRIBSWUUYQQPV-UHFFFAOYSA-N 1 2 315.417 2.394 20 10 DECDLO CC(C)(C)c1ccc(C[N@H+]2CCn3cnc(CO)c3C2)c(O)c1 ZINC001235506822 1084449966 /nfs/dbraw/zinc/44/99/66/1084449966.db2.gz HDRIBSWUUYQQPV-UHFFFAOYSA-N 1 2 315.417 2.394 20 10 DECDLO [NH3+][C@@]12C[C@@H]1CN(Cc1cc(Cl)cc(Br)c1O)C2 ZINC001236022102 1084592217 /nfs/dbraw/zinc/59/22/17/1084592217.db2.gz CACYDTZMMQTCQP-PRHODGIISA-N 1 2 317.614 2.341 20 10 DECDLO Oc1cccc(F)c1C[NH+]1CC2(CCN2Cc2ccc[nH]2)C1 ZINC001276354124 1089227548 /nfs/dbraw/zinc/22/75/48/1089227548.db2.gz IKRRYSGSXKDUEB-UHFFFAOYSA-N 1 2 301.365 2.320 20 10 DECDLO CC(C)NC(=O)N1CCC2(C[NH+](Cc3c(O)cccc3F)C2)C1 ZINC001276359085 1089242604 /nfs/dbraw/zinc/24/26/04/1089242604.db2.gz FYUXZCYZIYCLJS-UHFFFAOYSA-N 1 2 321.396 2.157 20 10 DECDLO CN1CC[C@]2(CCC[N@@H+]2Cc2cc(F)cc(Cl)c2O)C1=O ZINC001274442174 1091245166 /nfs/dbraw/zinc/24/51/66/1091245166.db2.gz NMCWWFIUGMIFCU-OAHLLOKOSA-N 1 2 312.772 2.381 20 10 DECDLO CN1CC[C@]2(CCC[N@H+]2Cc2cc(F)cc(Cl)c2O)C1=O ZINC001274442174 1091245176 /nfs/dbraw/zinc/24/51/76/1091245176.db2.gz NMCWWFIUGMIFCU-OAHLLOKOSA-N 1 2 312.772 2.381 20 10 DECDLO Oc1cc(C[N@@H+]2CC[C@@]23CCOC3)c(O)cc1Br ZINC001236765611 1138418174 /nfs/dbraw/zinc/41/81/74/1138418174.db2.gz QDMVOJCHWCPOGM-ZDUSSCGKSA-N 1 2 314.179 2.225 20 10 DECDLO Oc1cc(C[N@H+]2CC[C@@]23CCOC3)c(O)cc1Br ZINC001236765611 1138418180 /nfs/dbraw/zinc/41/81/80/1138418180.db2.gz QDMVOJCHWCPOGM-ZDUSSCGKSA-N 1 2 314.179 2.225 20 10 DECDLO O=C1NCC[C@@]12CCC[N@@H+](Cc1cc(Cl)cc(F)c1O)C2 ZINC001237618098 1138717996 /nfs/dbraw/zinc/71/79/96/1138717996.db2.gz FOZSOZRWYOULCU-OAHLLOKOSA-N 1 2 312.772 2.287 20 10 DECDLO O=C1NCC[C@@]12CCC[N@H+](Cc1cc(Cl)cc(F)c1O)C2 ZINC001237618098 1138718004 /nfs/dbraw/zinc/71/80/04/1138718004.db2.gz FOZSOZRWYOULCU-OAHLLOKOSA-N 1 2 312.772 2.287 20 10 DECDLO O=C1NC[C@]2(CCC[N@@H+](Cc3cc(Cl)cc(F)c3O)C2)O1 ZINC001237621484 1138720351 /nfs/dbraw/zinc/72/03/51/1138720351.db2.gz BAGLRKZOKLIJSD-AWEZNQCLSA-N 1 2 314.744 2.259 20 10 DECDLO O=C1NC[C@]2(CCC[N@H+](Cc3cc(Cl)cc(F)c3O)C2)O1 ZINC001237621484 1138720355 /nfs/dbraw/zinc/72/03/55/1138720355.db2.gz BAGLRKZOKLIJSD-AWEZNQCLSA-N 1 2 314.744 2.259 20 10 DECDLO COC(=O)[C@H]1C[N@H+](Cc2cc(F)cc(Cl)c2O)C[C@@H]1C ZINC001237801970 1138793101 /nfs/dbraw/zinc/79/31/01/1138793101.db2.gz JOIOXRHQJLJCNR-KWQFWETISA-N 1 2 301.745 2.426 20 10 DECDLO COC(=O)[C@H]1C[N@@H+](Cc2cc(F)cc(Cl)c2O)C[C@@H]1C ZINC001237801970 1138793106 /nfs/dbraw/zinc/79/31/06/1138793106.db2.gz JOIOXRHQJLJCNR-KWQFWETISA-N 1 2 301.745 2.426 20 10 DECDLO COc1cc(O)c(C[NH2+]Cc2nc(C(F)F)no2)cc1OC ZINC001336837765 1142590896 /nfs/dbraw/zinc/59/08/96/1142590896.db2.gz ZOJZNIBBZAZVCW-UHFFFAOYSA-N 1 2 315.276 2.020 20 10 DECDLO Cn1cc(N2CC[C@@H]([NH2+]Cc3cc(Cl)cc(F)c3O)C2)cn1 ZINC001324924209 1147858537 /nfs/dbraw/zinc/85/85/37/1147858537.db2.gz LYXOJGMRBANSGJ-GFCCVEGCSA-N 1 2 324.787 2.287 20 10 DECDLO CN(C)c1ccc(C[N@@H+]2CCNC(=O)[C@@H]2c2ccccc2)cc1 ZINC000092674803 185333001 /nfs/dbraw/zinc/33/30/01/185333001.db2.gz GHTKJXKBSJNQMN-SFHVURJKSA-N 1 2 309.413 2.426 20 10 DECDLO CN(C)c1ccc(C[N@H+]2CCNC(=O)[C@@H]2c2ccccc2)cc1 ZINC000092674803 185333002 /nfs/dbraw/zinc/33/30/02/185333002.db2.gz GHTKJXKBSJNQMN-SFHVURJKSA-N 1 2 309.413 2.426 20 10 DECDLO C[C@@H]([NH2+]CC(C)(C)N1CCOCC1)c1ccc(F)c(F)c1O ZINC000191184422 296116483 /nfs/dbraw/zinc/11/64/83/296116483.db2.gz SZWGLNLDDHUQRK-LLVKDONJSA-N 1 2 314.376 2.432 20 10 DECDLO COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@@H](C)Cc2cc(C)[nH]n2)c1 ZINC000273533145 130133700 /nfs/dbraw/zinc/13/37/00/130133700.db2.gz WTIWINHFDXGHES-JQWIXIFHSA-N 1 2 317.389 2.492 20 10 DECDLO C[C@H]1CS(=O)(=O)C[C@H]1[NH2+]Cc1cc(Cl)cc(Cl)c1O ZINC000288470165 131326529 /nfs/dbraw/zinc/32/65/29/131326529.db2.gz FOPBPZYHTUTYBT-WRWORJQWSA-N 1 2 324.229 2.222 20 10 DECDLO COC(=O)[C@H]([NH2+]Cc1cc(-c2ccccc2)ccc1O)[C@@H](C)O ZINC000276438458 403175144 /nfs/dbraw/zinc/17/51/44/403175144.db2.gz IKHQAAMABVQIHZ-SJKOYZFVSA-N 1 2 315.369 2.071 20 10 DECDLO O=C(NCCCCNc1cccc[nH+]1)c1c(F)ccc(O)c1O ZINC000276634184 403192172 /nfs/dbraw/zinc/19/21/72/403192172.db2.gz UAXIDYWXRRIGOP-UHFFFAOYSA-N 1 2 319.336 2.254 20 10 DECDLO CC[N@H+](Cc1cnn[nH]1)Cc1cc(Br)ccc1O ZINC000294875218 403736379 /nfs/dbraw/zinc/73/63/79/403736379.db2.gz FCQNKNPJPCHXQN-UHFFFAOYSA-N 1 2 311.183 2.295 20 10 DECDLO CC[N@@H+](Cc1cnn[nH]1)Cc1cc(Br)ccc1O ZINC000294875218 403736384 /nfs/dbraw/zinc/73/63/84/403736384.db2.gz FCQNKNPJPCHXQN-UHFFFAOYSA-N 1 2 311.183 2.295 20 10 DECDLO CC[N@H+](Cc1c[nH]nn1)Cc1cc(Br)ccc1O ZINC000294875218 403736386 /nfs/dbraw/zinc/73/63/86/403736386.db2.gz FCQNKNPJPCHXQN-UHFFFAOYSA-N 1 2 311.183 2.295 20 10 DECDLO CC[N@@H+](Cc1c[nH]nn1)Cc1cc(Br)ccc1O ZINC000294875218 403736388 /nfs/dbraw/zinc/73/63/88/403736388.db2.gz FCQNKNPJPCHXQN-UHFFFAOYSA-N 1 2 311.183 2.295 20 10 DECDLO CC[N@H+](Cc1cn[nH]n1)Cc1cc(Br)ccc1O ZINC000294875218 403736393 /nfs/dbraw/zinc/73/63/93/403736393.db2.gz FCQNKNPJPCHXQN-UHFFFAOYSA-N 1 2 311.183 2.295 20 10 DECDLO CC[N@@H+](Cc1cn[nH]n1)Cc1cc(Br)ccc1O ZINC000294875218 403736395 /nfs/dbraw/zinc/73/63/95/403736395.db2.gz FCQNKNPJPCHXQN-UHFFFAOYSA-N 1 2 311.183 2.295 20 10 DECDLO CN(C)C(=O)O[C@@H]1CC[N@@H+](Cc2cc(Cl)c(F)cc2O)C1 ZINC000295069319 403749343 /nfs/dbraw/zinc/74/93/43/403749343.db2.gz HGMIATGCUPICQY-SNVBAGLBSA-N 1 2 316.760 2.457 20 10 DECDLO O=C1NCCN1[C@H]1CCC[N@@H+](Cc2cccc(Cl)c2O)C1 ZINC000362045173 403919864 /nfs/dbraw/zinc/91/98/64/403919864.db2.gz KMEIBFRKSXIOQR-LBPRGKRZSA-N 1 2 309.797 2.035 20 10 DECDLO O=C1NCCN1[C@H]1CCC[N@H+](Cc2cccc(Cl)c2O)C1 ZINC000362045173 403919868 /nfs/dbraw/zinc/91/98/68/403919868.db2.gz KMEIBFRKSXIOQR-LBPRGKRZSA-N 1 2 309.797 2.035 20 10 DECDLO CCOCc1nc([C@@H](C)[NH2+]Cc2cccc(OC)c2O)no1 ZINC000290972332 404368498 /nfs/dbraw/zinc/36/84/98/404368498.db2.gz SOLFVJBPLJAFEX-SNVBAGLBSA-N 1 2 307.350 2.171 20 10 DECDLO COc1cc(Cl)cc(CN2CCc3c([nH+]cn3C)C2)c1O ZINC000366677000 404829995 /nfs/dbraw/zinc/82/99/95/404829995.db2.gz FBRNFPATMKRGDO-UHFFFAOYSA-N 1 2 307.781 2.346 20 10 DECDLO CN(C)c1ccc(C[N@@H+]2CCO[C@@H]([C@@H]3CCCO3)C2)cc1F ZINC000367546200 405080030 /nfs/dbraw/zinc/08/00/30/405080030.db2.gz DRXFEPWLICLCBE-DLBZAZTESA-N 1 2 308.397 2.272 20 10 DECDLO CN(C)c1ccc(C[N@H+]2CCO[C@@H]([C@@H]3CCCO3)C2)cc1F ZINC000367546200 405080031 /nfs/dbraw/zinc/08/00/31/405080031.db2.gz DRXFEPWLICLCBE-DLBZAZTESA-N 1 2 308.397 2.272 20 10 DECDLO CCOC[C@H]1C[N@H+](Cc2cc(Cl)cc(F)c2O)CCO1 ZINC000529667162 405763277 /nfs/dbraw/zinc/76/32/77/405763277.db2.gz RQAMKMMGQIMUHQ-GFCCVEGCSA-N 1 2 303.761 2.422 20 10 DECDLO CCOC[C@H]1C[N@@H+](Cc2cc(Cl)cc(F)c2O)CCO1 ZINC000529667162 405763282 /nfs/dbraw/zinc/76/32/82/405763282.db2.gz RQAMKMMGQIMUHQ-GFCCVEGCSA-N 1 2 303.761 2.422 20 10 DECDLO CC[C@@H]([NH2+]CCCNS(C)(=O)=O)c1cccc(Cl)c1O ZINC000287753873 286907077 /nfs/dbraw/zinc/90/70/77/286907077.db2.gz QMMLGNXIGFJDFZ-GFCCVEGCSA-N 1 2 320.842 2.026 20 10 DECDLO C[C@H]([NH2+]C[C@H]1CCCCN1CCO)c1cc(F)cc(F)c1O ZINC000834849819 649854157 /nfs/dbraw/zinc/85/41/57/649854157.db2.gz GBRIJZSUSPTXQB-WCQYABFASA-N 1 2 314.376 2.168 20 10 DECDLO CN(C)c1ccc(/C=C\C[N@@H+]2CCN(C)C(=O)C2(C)C)cc1 ZINC000835025103 649868289 /nfs/dbraw/zinc/86/82/89/649868289.db2.gz FAVZQWUJJOQSHQ-SREVYHEPSA-N 1 2 301.434 2.318 20 10 DECDLO CN(C)c1ccc(/C=C\C[N@H+]2CCN(C)C(=O)C2(C)C)cc1 ZINC000835025103 649868291 /nfs/dbraw/zinc/86/82/91/649868291.db2.gz FAVZQWUJJOQSHQ-SREVYHEPSA-N 1 2 301.434 2.318 20 10 DECDLO CCN(CC)c1ccc(C[N@@H+]2CCO[C@H]([C@@H](C)O)C2)cc1F ZINC000840976570 636005293 /nfs/dbraw/zinc/00/52/93/636005293.db2.gz DQCORGICZKLBTJ-DYVFJYSZSA-N 1 2 310.413 2.254 20 10 DECDLO CCN(CC)c1ccc(C[N@H+]2CCO[C@H]([C@@H](C)O)C2)cc1F ZINC000840976570 636005297 /nfs/dbraw/zinc/00/52/97/636005297.db2.gz DQCORGICZKLBTJ-DYVFJYSZSA-N 1 2 310.413 2.254 20 10 DECDLO OC[C@]1(C(F)(F)F)CC[N@H+](Cc2cc(F)cc(F)c2O)C1 ZINC000895837039 638226772 /nfs/dbraw/zinc/22/67/72/638226772.db2.gz JUBIVKFRCWYMAW-LBPRGKRZSA-N 1 2 311.250 2.417 20 10 DECDLO OC[C@]1(C(F)(F)F)CC[N@@H+](Cc2cc(F)cc(F)c2O)C1 ZINC000895837039 638226775 /nfs/dbraw/zinc/22/67/75/638226775.db2.gz JUBIVKFRCWYMAW-LBPRGKRZSA-N 1 2 311.250 2.417 20 10 DECDLO Cn1ncc(Br)c1C[NH2+]Cc1c(O)cccc1F ZINC000896637958 638620647 /nfs/dbraw/zinc/62/06/47/638620647.db2.gz SRJLWDBPHYOTHX-UHFFFAOYSA-N 1 2 314.158 2.317 20 10 DECDLO O=S1(=O)CCCC[C@@H]1C[NH2+]Cc1cc(Cl)cc(F)c1O ZINC000753568445 639314460 /nfs/dbraw/zinc/31/44/60/639314460.db2.gz RRJPUMJKWBHDGS-LLVKDONJSA-N 1 2 321.801 2.242 20 10 DECDLO COc1ccc(N2CC[NH+](Cc3cnc(C)nc3)CC2)cc1F ZINC000753861745 639350218 /nfs/dbraw/zinc/35/02/18/639350218.db2.gz VDQNNRCQBPYNGU-UHFFFAOYSA-N 1 2 316.380 2.255 20 10 DECDLO COC(=O)c1ccc(O)c([C@H](C)[NH2+]Cc2nnc(C)s2)c1 ZINC000757637286 639862044 /nfs/dbraw/zinc/86/20/44/639862044.db2.gz HFADPBURZWERSX-QMMMGPOBSA-N 1 2 307.375 2.190 20 10 DECDLO C[C@H](Cn1cc[nH+]c1)NC(=O)N[C@@H](C)c1ccc(N(C)C)cc1 ZINC000773238777 641747085 /nfs/dbraw/zinc/74/70/85/641747085.db2.gz XBBRBHIAWPDJTB-KGLIPLIRSA-N 1 2 315.421 2.398 20 10 DECDLO CC[C@]1(C)COCC[N@@H+]1Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000775075933 642003892 /nfs/dbraw/zinc/00/38/92/642003892.db2.gz RFAAEKSQQGZOCW-OAHLLOKOSA-N 1 2 310.350 2.310 20 10 DECDLO CC[C@]1(C)COCC[N@H+]1Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000775075933 642003895 /nfs/dbraw/zinc/00/38/95/642003895.db2.gz RFAAEKSQQGZOCW-OAHLLOKOSA-N 1 2 310.350 2.310 20 10 DECDLO COc1c(O)c(C[N@@H+]2CC(C)(C)OC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000775109071 642008061 /nfs/dbraw/zinc/00/80/61/642008061.db2.gz PXRWJVZNINRBMM-JTQLQIEISA-N 1 2 310.350 2.308 20 10 DECDLO COc1c(O)c(C[N@H+]2CC(C)(C)OC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000775109071 642008063 /nfs/dbraw/zinc/00/80/63/642008063.db2.gz PXRWJVZNINRBMM-JTQLQIEISA-N 1 2 310.350 2.308 20 10 DECDLO CCc1noc(C[NH2+][C@H](C)c2ccc(N3CCOCC3)cc2)n1 ZINC000775258264 642022619 /nfs/dbraw/zinc/02/26/19/642022619.db2.gz VQNWXKZCGJTGFZ-CYBMUJFWSA-N 1 2 316.405 2.319 20 10 DECDLO CNC(=O)C1CC[NH+](Cc2cc(Cl)cc(F)c2O)CC1 ZINC000775644217 642071654 /nfs/dbraw/zinc/07/16/54/642071654.db2.gz AQWZMFNTJGOPFM-UHFFFAOYSA-N 1 2 300.761 2.143 20 10 DECDLO C[C@@H]1CC[N@H+](CC(=O)NCc2ccc(N(C)C)cc2)C[C@@H]1F ZINC000778229663 642357137 /nfs/dbraw/zinc/35/71/37/642357137.db2.gz AFNBFOLEWZHVGR-CJNGLKHVSA-N 1 2 307.413 2.049 20 10 DECDLO C[C@@H]1CC[N@@H+](CC(=O)NCc2ccc(N(C)C)cc2)C[C@@H]1F ZINC000778229663 642357144 /nfs/dbraw/zinc/35/71/44/642357144.db2.gz AFNBFOLEWZHVGR-CJNGLKHVSA-N 1 2 307.413 2.049 20 10 DECDLO CCOc1ccc(C[N@@H+]2CCN(CC(C)C)C(=O)[C@@H]2C)c(O)c1 ZINC000779202621 642471525 /nfs/dbraw/zinc/47/15/25/642471525.db2.gz QQCFFLREOZCVOC-AWEZNQCLSA-N 1 2 320.433 2.480 20 10 DECDLO CCOc1ccc(C[N@H+]2CCN(CC(C)C)C(=O)[C@@H]2C)c(O)c1 ZINC000779202621 642471528 /nfs/dbraw/zinc/47/15/28/642471528.db2.gz QQCFFLREOZCVOC-AWEZNQCLSA-N 1 2 320.433 2.480 20 10 DECDLO O=C(/C=C\c1ccc(O)c(O)c1)N1CCC[C@H](n2cc[nH+]c2)C1 ZINC000779513844 642507223 /nfs/dbraw/zinc/50/72/23/642507223.db2.gz YJMSOVCSKCHDRT-SDQPKGBYSA-N 1 2 313.357 2.171 20 10 DECDLO CCOC(=O)[C@@H]([NH2+]Cc1cc(C)ccc1O)[C@@H]1CCCOC1 ZINC000789578205 643750487 /nfs/dbraw/zinc/75/04/87/643750487.db2.gz BVIFEXRSYGSKBY-CJNGLKHVSA-N 1 2 307.390 2.149 20 10 DECDLO C[C@@H]([NH2+][C@H](C)c1cc(F)cc(F)c1O)c1nnnn1C1CC1 ZINC000790758131 643889174 /nfs/dbraw/zinc/88/91/74/643889174.db2.gz XGFGURMEDPOMSG-HTQZYQBOSA-N 1 2 309.320 2.404 20 10 DECDLO COc1ccc(CNC(=O)Nc2ccn3cc[nH+]c3c2)c(O)c1 ZINC000810226820 646342098 /nfs/dbraw/zinc/34/20/98/646342098.db2.gz LYZMHQCHGDJJGI-UHFFFAOYSA-N 1 2 312.329 2.370 20 10 DECDLO COC(=O)[C@H](COC(C)C)[N@H+](C)Cc1ccc(N(C)C)c(C)c1 ZINC000815062447 646961901 /nfs/dbraw/zinc/96/19/01/646961901.db2.gz URKLFSMFMATSAM-KRWDZBQOSA-N 1 2 322.449 2.459 20 10 DECDLO COC(=O)[C@H](COC(C)C)[N@@H+](C)Cc1ccc(N(C)C)c(C)c1 ZINC000815062447 646961906 /nfs/dbraw/zinc/96/19/06/646961906.db2.gz URKLFSMFMATSAM-KRWDZBQOSA-N 1 2 322.449 2.459 20 10 DECDLO C[C@H]([NH2+]Cc1cnn(C)n1)c1cccc(C(F)(F)F)c1O ZINC000815626176 647036881 /nfs/dbraw/zinc/03/68/81/647036881.db2.gz XXNZUOWUIRIDLQ-QMMMGPOBSA-N 1 2 300.284 2.390 20 10 DECDLO NC(=O)C1CCC([NH2+]Cc2cc(Cl)c(F)cc2O)CC1 ZINC000816550376 647150329 /nfs/dbraw/zinc/15/03/29/647150329.db2.gz PLAIPTBLYZIHDO-UHFFFAOYSA-N 1 2 300.761 2.318 20 10 DECDLO COc1ccc(O)c(C[NH2+]Cc2ncn(-c3ccccc3)n2)c1 ZINC000816665207 647165355 /nfs/dbraw/zinc/16/53/55/647165355.db2.gz XQAZGHRALMJVSC-UHFFFAOYSA-N 1 2 310.357 2.271 20 10 DECDLO CCOC(=O)C[N@@H+](Cc1ccccc1O)C[C@@H]1CC[C@@H](C)O1 ZINC000823576807 648445474 /nfs/dbraw/zinc/44/54/74/648445474.db2.gz ZZFAINLDFDADNA-HIFRSBDPSA-N 1 2 307.390 2.325 20 10 DECDLO CCOC(=O)C[N@H+](Cc1ccccc1O)C[C@@H]1CC[C@@H](C)O1 ZINC000823576807 648445479 /nfs/dbraw/zinc/44/54/79/648445479.db2.gz ZZFAINLDFDADNA-HIFRSBDPSA-N 1 2 307.390 2.325 20 10 DECDLO COC[C@@](C)(O)CC[NH2+]Cc1cccc(Br)c1O ZINC000824559564 648610451 /nfs/dbraw/zinc/61/04/51/648610451.db2.gz VNXSBICDLHMFNU-ZDUSSCGKSA-N 1 2 318.211 2.032 20 10 DECDLO OCCCSCC[NH2+]Cc1cccc(Br)c1O ZINC000105643227 651176970 /nfs/dbraw/zinc/17/69/70/651176970.db2.gz ZSXNHNASJRPPHE-UHFFFAOYSA-N 1 2 320.252 2.360 20 10 DECDLO CC[C@H]1C[N@H+](Cc2ccc([N+](=O)[O-])c(OC)c2O)[C@@H](C)CO1 ZINC000846042207 651304006 /nfs/dbraw/zinc/30/40/06/651304006.db2.gz AMCSOEURZPEJDV-JQWIXIFHSA-N 1 2 310.350 2.308 20 10 DECDLO CC[C@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])c(OC)c2O)[C@@H](C)CO1 ZINC000846042207 651304007 /nfs/dbraw/zinc/30/40/07/651304007.db2.gz AMCSOEURZPEJDV-JQWIXIFHSA-N 1 2 310.350 2.308 20 10 DECDLO COc1ccc(N(C)CC[N@H+](C)Cc2cc(C(C)=O)no2)cc1 ZINC000847007896 651368655 /nfs/dbraw/zinc/36/86/55/651368655.db2.gz GVHZVJBNYCNLQZ-UHFFFAOYSA-N 1 2 317.389 2.454 20 10 DECDLO COc1ccc(N(C)CC[N@@H+](C)Cc2cc(C(C)=O)no2)cc1 ZINC000847007896 651368656 /nfs/dbraw/zinc/36/86/56/651368656.db2.gz GVHZVJBNYCNLQZ-UHFFFAOYSA-N 1 2 317.389 2.454 20 10 DECDLO COc1ccc(O)c([C@@H](C)NC(=O)[C@H](C)Cc2c[nH]c[nH+]2)c1 ZINC000847588791 651404474 /nfs/dbraw/zinc/40/44/74/651404474.db2.gz BZJNTSICOOYVAD-GHMZBOCLSA-N 1 2 303.362 2.180 20 10 DECDLO COc1ccc(O)c([C@@H](C)NC(=O)[C@H](C)Cc2c[nH+]c[nH]2)c1 ZINC000847588791 651404476 /nfs/dbraw/zinc/40/44/76/651404476.db2.gz BZJNTSICOOYVAD-GHMZBOCLSA-N 1 2 303.362 2.180 20 10 DECDLO CCN(CC)c1ccc(C[NH2+]Cc2nc(C(N)=O)cs2)cc1 ZINC000850384961 651916916 /nfs/dbraw/zinc/91/69/16/651916916.db2.gz VKCSIHOKDQXYJH-UHFFFAOYSA-N 1 2 318.446 2.378 20 10 DECDLO C[C@@H]([NH2+]C/C=C/CO)c1cc(Br)cc(F)c1O ZINC000850506996 651941625 /nfs/dbraw/zinc/94/16/25/651941625.db2.gz DCWLGQVERWQKRB-UFUPEUMYSA-N 1 2 304.159 2.493 20 10 DECDLO C[C@H]([NH2+]Cc1c(O)cccc1Br)c1ncnn1C ZINC000858160139 652268676 /nfs/dbraw/zinc/26/86/76/652268676.db2.gz OKBFCRLHBVXAFH-QMMMGPOBSA-N 1 2 311.183 2.134 20 10 DECDLO COC(=O)COc1ccc(N(C)Cc2[nH]c(C)c(C)[nH+]2)cc1 ZINC000862323099 686276836 /nfs/dbraw/zinc/27/68/36/686276836.db2.gz PHBMKPHZWHUTQG-UHFFFAOYSA-N 1 2 303.362 2.215 20 10 DECDLO CN(C)c1cc(F)c(C[N@@H+]2C[C@@H]3CCC[C@@H]3[C@H]2C(N)=O)cc1F ZINC000862338801 686279044 /nfs/dbraw/zinc/27/90/44/686279044.db2.gz UXEXAZYZNFXCND-PKWAYOAASA-N 1 2 323.387 2.117 20 10 DECDLO CN(C)c1cc(F)c(C[N@H+]2C[C@@H]3CCC[C@@H]3[C@H]2C(N)=O)cc1F ZINC000862338801 686279048 /nfs/dbraw/zinc/27/90/48/686279048.db2.gz UXEXAZYZNFXCND-PKWAYOAASA-N 1 2 323.387 2.117 20 10 DECDLO CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)Cc1c[nH+]cn1C ZINC000863942526 686598160 /nfs/dbraw/zinc/59/81/60/686598160.db2.gz ZNZADLMIHMIEPQ-UHFFFAOYSA-N 1 2 314.433 2.466 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@@H+](C)[C@@H]2CCCCN(C)C2=O)c1O ZINC000872263585 688967737 /nfs/dbraw/zinc/96/77/37/688967737.db2.gz RBXBEJPEUHCJFQ-OAHLLOKOSA-N 1 2 322.380 2.177 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@H+](C)[C@@H]2CCCCN(C)C2=O)c1O ZINC000872263585 688967738 /nfs/dbraw/zinc/96/77/38/688967738.db2.gz RBXBEJPEUHCJFQ-OAHLLOKOSA-N 1 2 322.380 2.177 20 10 DECDLO CN(C)c1ccc(CNC(=O)[C@@H]2C[C@H]2c2c[nH]c[nH+]2)cc1F ZINC000874251836 689378253 /nfs/dbraw/zinc/37/82/53/689378253.db2.gz RJITYYLOIJCSNY-VXGBXAGGSA-N 1 2 302.353 2.035 20 10 DECDLO CN(C)c1ccc(CNC(=O)[C@@H]2C[C@H]2c2c[nH+]c[nH]2)cc1F ZINC000874251836 689378258 /nfs/dbraw/zinc/37/82/58/689378258.db2.gz RJITYYLOIJCSNY-VXGBXAGGSA-N 1 2 302.353 2.035 20 10 DECDLO CCC[C@@H](C)C(=O)NCC[NH2+]Cc1cc(F)cc(F)c1O ZINC000883130116 691435706 /nfs/dbraw/zinc/43/57/06/691435706.db2.gz RGTITHIFOYXLII-SNVBAGLBSA-N 1 2 300.349 2.312 20 10 DECDLO C[C@H]([NH2+][C@@H]1CNOC1)c1cc(Br)cc(Cl)c1O ZINC000925862899 693356036 /nfs/dbraw/zinc/35/60/36/693356036.db2.gz ZYEKMJPYTVQORI-POYBYMJQSA-N 1 2 321.602 2.362 20 10 DECDLO CCNc1cc(CNC(=O)N2Cc3cccc(O)c3C2)cc[nH+]1 ZINC001346810440 1151025448 /nfs/dbraw/zinc/02/54/48/1151025448.db2.gz KEAQPWIMHYNBPG-UHFFFAOYSA-N 1 2 312.373 2.444 20 10 DECDLO C[C@@H](C(=O)NC(C)(C)C)[N@H+](C)Cc1cc(F)cc(F)c1O ZINC001350316140 1151343400 /nfs/dbraw/zinc/34/34/00/1151343400.db2.gz KFNNFNKKBHNHDE-VIFPVBQESA-N 1 2 300.349 2.405 20 10 DECDLO C[C@@H](C(=O)NC(C)(C)C)[N@@H+](C)Cc1cc(F)cc(F)c1O ZINC001350316140 1151343405 /nfs/dbraw/zinc/34/34/05/1151343405.db2.gz KFNNFNKKBHNHDE-VIFPVBQESA-N 1 2 300.349 2.405 20 10 DECDLO Cc1nnc([C@H](C)[NH2+]Cc2ccc(N3CCOCC3)cc2)o1 ZINC001354604126 1151906848 /nfs/dbraw/zinc/90/68/48/1151906848.db2.gz ONPUTTXTCKKEME-LBPRGKRZSA-N 1 2 302.378 2.065 20 10 DECDLO CC(C)(C)CC(=O)N1CC[NH+](Cc2cc(O)ccc2O)CC1 ZINC001141162437 778317780 /nfs/dbraw/zinc/31/77/80/778317780.db2.gz RKSHKKFDLVUYBZ-UHFFFAOYSA-N 1 2 306.406 2.178 20 10 DECDLO COC(=O)[C@H](Cc1ccc(O)c(O)c1)[NH2+]C1CCC(C)CC1 ZINC001168192805 780446602 /nfs/dbraw/zinc/44/66/02/780446602.db2.gz FNJYGVYREOATJF-UBHUBRDASA-N 1 2 307.390 2.350 20 10 DECDLO Cc1[nH+]cn(-c2ccc(NCc3ccc(O)c(O)c3)nn2)c1C ZINC001169992349 785795794 /nfs/dbraw/zinc/79/57/94/785795794.db2.gz CRDBKVCQNUFACB-UHFFFAOYSA-N 1 2 311.345 2.302 20 10 DECDLO COC(=[NH2+])c1cccc(NCC(=O)c2ccc(O)c(O)c2)c1 ZINC001170322156 786907376 /nfs/dbraw/zinc/90/73/76/786907376.db2.gz FVVSJYKDASOYQJ-UHFFFAOYSA-N 1 2 300.314 2.364 20 10 DECDLO Oc1c(F)cc(Br)cc1C[NH2+]C[C@H]1CCOC1 ZINC000715759316 792510958 /nfs/dbraw/zinc/51/09/58/792510958.db2.gz LQVDUBPIFZXBJN-MRVPVSSYSA-N 1 2 304.159 2.420 20 10 DECDLO O=C(/C=C/c1ccc(O)c(O)c1)NCc1c[nH+]cn1C1CCC1 ZINC001179691532 795153870 /nfs/dbraw/zinc/15/38/70/795153870.db2.gz SZADJIDTIIYECX-FNORWQNLSA-N 1 2 313.357 2.349 20 10 DECDLO CCOC(=O)[C@H](C)[N@H+](Cc1ccc(OC)c(OC)c1O)C1CC1 ZINC001120040534 795396504 /nfs/dbraw/zinc/39/65/04/795396504.db2.gz ZPAKQAHVKQBQGT-NSHDSACASA-N 1 2 323.389 2.325 20 10 DECDLO CCOC(=O)[C@H](C)[N@@H+](Cc1ccc(OC)c(OC)c1O)C1CC1 ZINC001120040534 795396511 /nfs/dbraw/zinc/39/65/11/795396511.db2.gz ZPAKQAHVKQBQGT-NSHDSACASA-N 1 2 323.389 2.325 20 10 DECDLO COc1cccc(C[NH+]2CC(N(C)C(=O)OC(C)(C)C)C2)c1O ZINC001203585246 796022842 /nfs/dbraw/zinc/02/28/42/796022842.db2.gz NWCTUCCKICLSBY-UHFFFAOYSA-N 1 2 322.405 2.452 20 10 DECDLO CCOC(=O)C1=C(O)CC[N@H+](Cc2ccc(N(C)C)c(C)c2)C1 ZINC001139669629 796071286 /nfs/dbraw/zinc/07/12/86/796071286.db2.gz DYKSIAHYAXCXCL-HNNXBMFYSA-N 1 2 318.417 2.015 20 10 DECDLO CCOC(=O)C1=C(O)CC[N@@H+](Cc2ccc(N(C)C)c(C)c2)C1 ZINC001139669629 796071296 /nfs/dbraw/zinc/07/12/96/796071296.db2.gz DYKSIAHYAXCXCL-HNNXBMFYSA-N 1 2 318.417 2.015 20 10 DECDLO CCOC[C@H]1C[N@H+](Cc2c(O)cccc2F)Cc2cn(C)nc21 ZINC001137834341 796143707 /nfs/dbraw/zinc/14/37/07/796143707.db2.gz CWYNDFKFDBOGSQ-CYBMUJFWSA-N 1 2 319.380 2.401 20 10 DECDLO CCOC[C@H]1C[N@@H+](Cc2c(O)cccc2F)Cc2cn(C)nc21 ZINC001137834341 796143712 /nfs/dbraw/zinc/14/37/12/796143712.db2.gz CWYNDFKFDBOGSQ-CYBMUJFWSA-N 1 2 319.380 2.401 20 10 DECDLO Oc1c(F)cccc1C[NH+]1CCN(CCc2ccccn2)CC1 ZINC001138127695 796167365 /nfs/dbraw/zinc/16/73/65/796167365.db2.gz MTELBOBHRQQAQB-UHFFFAOYSA-N 1 2 315.392 2.287 20 10 DECDLO Oc1c(F)cccc1CN1CC[NH+](CCc2ccccn2)CC1 ZINC001138127695 796167369 /nfs/dbraw/zinc/16/73/69/796167369.db2.gz MTELBOBHRQQAQB-UHFFFAOYSA-N 1 2 315.392 2.287 20 10 DECDLO CCN(CC)c1ccc(C[N@@H+]2CC[C@@H](O)[C@H](F)C2)c(OC)c1 ZINC001138386836 796209017 /nfs/dbraw/zinc/20/90/17/796209017.db2.gz XTLFHWJTBVWKQW-HZPDHXFCSA-N 1 2 310.413 2.446 20 10 DECDLO CCN(CC)c1ccc(C[N@H+]2CC[C@@H](O)[C@H](F)C2)c(OC)c1 ZINC001138386836 796209024 /nfs/dbraw/zinc/20/90/24/796209024.db2.gz XTLFHWJTBVWKQW-HZPDHXFCSA-N 1 2 310.413 2.446 20 10 DECDLO COC[C@H]1Cn2ccnc2C[N@H+](Cc2cc(F)ccc2O)C1 ZINC001140063693 796472039 /nfs/dbraw/zinc/47/20/39/796472039.db2.gz WEQSGCYYTDCRNM-GFCCVEGCSA-N 1 2 305.353 2.006 20 10 DECDLO COC[C@H]1Cn2ccnc2C[N@@H+](Cc2cc(F)ccc2O)C1 ZINC001140063693 796472044 /nfs/dbraw/zinc/47/20/44/796472044.db2.gz WEQSGCYYTDCRNM-GFCCVEGCSA-N 1 2 305.353 2.006 20 10 DECDLO OC[C@H]1C[C@H](F)C[N@H+](Cc2c(O)cccc2Br)C1 ZINC001140098858 796477219 /nfs/dbraw/zinc/47/72/19/796477219.db2.gz PLUUDCYGIRJIJG-UWVGGRQHSA-N 1 2 318.186 2.307 20 10 DECDLO OC[C@H]1C[C@H](F)C[N@@H+](Cc2c(O)cccc2Br)C1 ZINC001140098858 796477221 /nfs/dbraw/zinc/47/72/21/796477221.db2.gz PLUUDCYGIRJIJG-UWVGGRQHSA-N 1 2 318.186 2.307 20 10 DECDLO COCCOC1C[NH+](Cc2cc3c4c(c2)CCCN4CCC3)C1 ZINC001141078725 796633055 /nfs/dbraw/zinc/63/30/55/796633055.db2.gz GDVOIGRBWNFSGJ-UHFFFAOYSA-N 1 2 316.445 2.233 20 10 DECDLO CN(C)c1ccc(CN2CC[NH2+]CC(F)(F)C2)c(Cl)c1 ZINC001211342662 801550116 /nfs/dbraw/zinc/55/01/16/801550116.db2.gz XGTHLKFTMZDNAA-UHFFFAOYSA-N 1 2 303.784 2.447 20 10 DECDLO O=C([O-])c1ccc(C[N@@H+]2CC[C@H](Oc3cc[nH+]cc3)C2)c(O)c1 ZINC001231455508 801669125 /nfs/dbraw/zinc/66/91/25/801669125.db2.gz QLDRDTSSVVDZQH-HNNXBMFYSA-N 1 2 314.341 2.139 20 10 DECDLO O=C([O-])c1ccc(C[N@H+]2CC[C@H](Oc3cc[nH+]cc3)C2)c(O)c1 ZINC001231455508 801669130 /nfs/dbraw/zinc/66/91/30/801669130.db2.gz QLDRDTSSVVDZQH-HNNXBMFYSA-N 1 2 314.341 2.139 20 10 DECDLO COc1cc(C[N@H+](C)[C@@H](C)C(=O)OC(C)(C)C)c(O)cc1O ZINC001231638720 801702055 /nfs/dbraw/zinc/70/20/55/801702055.db2.gz FBJILLNXMRXXPB-JTQLQIEISA-N 1 2 311.378 2.268 20 10 DECDLO COc1cc(C[N@@H+](C)[C@@H](C)C(=O)OC(C)(C)C)c(O)cc1O ZINC001231638720 801702062 /nfs/dbraw/zinc/70/20/62/801702062.db2.gz FBJILLNXMRXXPB-JTQLQIEISA-N 1 2 311.378 2.268 20 10 DECDLO C[NH+]1CCN(Cc2c(O)cc(Br)cc2F)CC1 ZINC001233027245 802006352 /nfs/dbraw/zinc/00/63/52/802006352.db2.gz OLVZYWRZVFEOBH-UHFFFAOYSA-N 1 2 303.175 2.041 20 10 DECDLO Oc1ccc(F)c(F)c1C[N@@H+]1CCN2CC(F)(F)C[C@H]2C1 ZINC001233335536 802079823 /nfs/dbraw/zinc/07/98/23/802079823.db2.gz ZWPNCKLQNTUNDI-VIFPVBQESA-N 1 2 304.287 2.196 20 10 DECDLO Oc1ccc(F)c(F)c1C[N@H+]1CCN2CC(F)(F)C[C@H]2C1 ZINC001233335536 802079829 /nfs/dbraw/zinc/07/98/29/802079829.db2.gz ZWPNCKLQNTUNDI-VIFPVBQESA-N 1 2 304.287 2.196 20 10 DECDLO Cc1cncnc1O[C@H]1CC[N@@H+](Cc2c(O)ccc(F)c2F)C1 ZINC001233336493 802081101 /nfs/dbraw/zinc/08/11/01/802081101.db2.gz NUFAGORKFPKARD-NSHDSACASA-N 1 2 321.327 2.422 20 10 DECDLO CC(=O)OC[C@H]([NH3+])c1nnc(-c2ccc(-n3cccc3)cc2)o1 ZINC001217698467 802100912 /nfs/dbraw/zinc/10/09/12/802100912.db2.gz DIWIDQNBMGRMKR-AWEZNQCLSA-N 1 2 312.329 2.090 20 10 DECDLO CC(C)(C)C(=O)NCC[NH2+]Cc1cc(Cl)cc(F)c1O ZINC001560359251 1075138683 /nfs/dbraw/zinc/13/86/83/1075138683.db2.gz GSPKLLMMSOATRW-UHFFFAOYSA-N 1 2 302.777 2.437 20 10 DECDLO CO[C@@H]([C@@H](C)[NH2+][C@@H](C)c1cccc(-c2nn[nH]n2)c1O)C1CC1 ZINC001591326444 1076723641 /nfs/dbraw/zinc/72/36/41/1076723641.db2.gz LDRNMYAHHDIMKV-WMFXKJRFSA-N 1 2 317.393 2.036 20 10 DECDLO Cn1c2ccc(F)cc2c(C[NH2+]CC[NH+]2CCCC2)c1C(=O)[O-] ZINC001600902096 1077299523 /nfs/dbraw/zinc/29/95/23/1077299523.db2.gz PWEJOQWTVBVTSE-UHFFFAOYSA-N 1 2 319.380 2.201 20 10 DECDLO C[C@@H](CS(C)(=O)=O)[N@H+](Cc1ccc(Cl)cc1O)C1CC1 ZINC001659123916 1080231013 /nfs/dbraw/zinc/23/10/13/1080231013.db2.gz MZMABMJVTHFWIZ-JTQLQIEISA-N 1 2 317.838 2.443 20 10 DECDLO C[C@@H](CS(C)(=O)=O)[N@@H+](Cc1ccc(Cl)cc1O)C1CC1 ZINC001659123916 1080231024 /nfs/dbraw/zinc/23/10/24/1080231024.db2.gz MZMABMJVTHFWIZ-JTQLQIEISA-N 1 2 317.838 2.443 20 10 DECDLO C[C@@]1(O)COCC[N@H+](Cc2c(O)ccc(Cl)c2Cl)C1 ZINC001237078906 1080442308 /nfs/dbraw/zinc/44/23/08/1080442308.db2.gz ZRGJCSRGVOSUFX-ZDUSSCGKSA-N 1 2 306.189 2.282 20 10 DECDLO C[C@@]1(O)COCC[N@@H+](Cc2c(O)ccc(Cl)c2Cl)C1 ZINC001237078906 1080442314 /nfs/dbraw/zinc/44/23/14/1080442314.db2.gz ZRGJCSRGVOSUFX-ZDUSSCGKSA-N 1 2 306.189 2.282 20 10 DECDLO COC(C[N@H+](C)Cc1cc(Br)cc(F)c1O)OC ZINC001235069553 1084297278 /nfs/dbraw/zinc/29/72/78/1084297278.db2.gz WGCJMODVVKLUGK-UHFFFAOYSA-N 1 2 322.174 2.345 20 10 DECDLO COC(C[N@@H+](C)Cc1cc(Br)cc(F)c1O)OC ZINC001235069553 1084297285 /nfs/dbraw/zinc/29/72/85/1084297285.db2.gz WGCJMODVVKLUGK-UHFFFAOYSA-N 1 2 322.174 2.345 20 10 DECDLO CC(C)c1ccc(C[N@@H+]2CCn3cnc(CO)c3C2)c(O)c1 ZINC001235509491 1084451943 /nfs/dbraw/zinc/45/19/43/1084451943.db2.gz YZLYUEYGMRKBJY-UHFFFAOYSA-N 1 2 301.390 2.220 20 10 DECDLO CC(C)c1ccc(C[N@H+]2CCn3cnc(CO)c3C2)c(O)c1 ZINC001235509491 1084451955 /nfs/dbraw/zinc/45/19/55/1084451955.db2.gz YZLYUEYGMRKBJY-UHFFFAOYSA-N 1 2 301.390 2.220 20 10 DECDLO CN1CC[C@@]2(CC[N@H+](Cc3cc(Cl)cc(F)c3O)C2)C1=O ZINC001274365916 1091209042 /nfs/dbraw/zinc/20/90/42/1091209042.db2.gz MYNKXAOIOVHNMT-HNNXBMFYSA-N 1 2 312.772 2.239 20 10 DECDLO CN1CC[C@@]2(CC[N@@H+](Cc3cc(Cl)cc(F)c3O)C2)C1=O ZINC001274365916 1091209049 /nfs/dbraw/zinc/20/90/49/1091209049.db2.gz MYNKXAOIOVHNMT-HNNXBMFYSA-N 1 2 312.772 2.239 20 10 DECDLO CN1CC[C@]2(CCC[N@@H+]2Cc2cc(F)c(Cl)cc2O)C1=O ZINC001274063031 1093786413 /nfs/dbraw/zinc/78/64/13/1093786413.db2.gz FXLVSJQICYIHFU-OAHLLOKOSA-N 1 2 312.772 2.381 20 10 DECDLO CN1CC[C@]2(CCC[N@H+]2Cc2cc(F)c(Cl)cc2O)C1=O ZINC001274063031 1093786417 /nfs/dbraw/zinc/78/64/17/1093786417.db2.gz FXLVSJQICYIHFU-OAHLLOKOSA-N 1 2 312.772 2.381 20 10 DECDLO CCN1CC[N@H+](Cc2cc(OC)c(OC)cc2O)C(C)(C)C1 ZINC001236751302 1138407306 /nfs/dbraw/zinc/40/73/06/1138407306.db2.gz FELLOXVBUNLVDM-UHFFFAOYSA-N 1 2 308.422 2.326 20 10 DECDLO CCN1CC[N@@H+](Cc2cc(OC)c(OC)cc2O)C(C)(C)C1 ZINC001236751302 1138407316 /nfs/dbraw/zinc/40/73/16/1138407316.db2.gz FELLOXVBUNLVDM-UHFFFAOYSA-N 1 2 308.422 2.326 20 10 DECDLO COc1cc(O)c(C[N@@H+]2CCCC3(C2)OCCO3)c(Cl)c1 ZINC001236803377 1138432621 /nfs/dbraw/zinc/43/26/21/1138432621.db2.gz MZVQBTZXJQDWHA-UHFFFAOYSA-N 1 2 313.781 2.393 20 10 DECDLO COc1cc(O)c(C[N@H+]2CCCC3(C2)OCCO3)c(Cl)c1 ZINC001236803377 1138432628 /nfs/dbraw/zinc/43/26/28/1138432628.db2.gz MZVQBTZXJQDWHA-UHFFFAOYSA-N 1 2 313.781 2.393 20 10 DECDLO CCOC(=O)[C@@H]1C[N@H+](Cc2ccc(C(C)C)cc2O)CCO1 ZINC001237048873 1138489200 /nfs/dbraw/zinc/48/92/00/1138489200.db2.gz JLGJIMNGYFDOFL-INIZCTEOSA-N 1 2 307.390 2.280 20 10 DECDLO CCOC(=O)[C@@H]1C[N@@H+](Cc2ccc(C(C)C)cc2O)CCO1 ZINC001237048873 1138489203 /nfs/dbraw/zinc/48/92/03/1138489203.db2.gz JLGJIMNGYFDOFL-INIZCTEOSA-N 1 2 307.390 2.280 20 10 DECDLO Oc1ccc(F)c(Cl)c1C[NH+]1CCN(c2ncccn2)CC1 ZINC001237121378 1138508521 /nfs/dbraw/zinc/50/85/21/1138508521.db2.gz LTOFFKZAOMKREH-UHFFFAOYSA-N 1 2 322.771 2.297 20 10 DECDLO CC[C@@H](C(=O)N(C)c1ccc(N)cc1)[N@@H+]1CCO[C@@H](CC)C1 ZINC001340725907 1143414330 /nfs/dbraw/zinc/41/43/30/1143414330.db2.gz IIPNQDKSVXGVFS-HOTGVXAUSA-N 1 2 305.422 2.121 20 10 DECDLO CC[C@@H](C(=O)N(C)c1ccc(N)cc1)[N@H+]1CCO[C@@H](CC)C1 ZINC001340725907 1143414360 /nfs/dbraw/zinc/41/43/60/1143414360.db2.gz IIPNQDKSVXGVFS-HOTGVXAUSA-N 1 2 305.422 2.121 20 10 DECDLO C[C@@H]1CCN(C(=O)NCc2ccc(N)cc2)C[C@H]1n1cc[nH+]c1 ZINC001262603728 1144322571 /nfs/dbraw/zinc/32/25/71/1144322571.db2.gz SVYQJVRIVDYYAW-CZUORRHYSA-N 1 2 313.405 2.258 20 10 DECDLO CCC[N@@H+]1CCCC[C@H]1C(=O)OCC(=O)c1ccc(O)c(O)c1 ZINC001326587128 1148153942 /nfs/dbraw/zinc/15/39/42/1148153942.db2.gz JKVBZZFFRVWHGD-ZDUSSCGKSA-N 1 2 321.373 2.088 20 10 DECDLO CCC[N@H+]1CCCC[C@H]1C(=O)OCC(=O)c1ccc(O)c(O)c1 ZINC001326587128 1148153952 /nfs/dbraw/zinc/15/39/52/1148153952.db2.gz JKVBZZFFRVWHGD-ZDUSSCGKSA-N 1 2 321.373 2.088 20 10 DECDLO COC(=O)C1CC[NH+](Cc2cc(F)cc(C(C)=O)c2O)CC1 ZINC000079384916 185167756 /nfs/dbraw/zinc/16/77/56/185167756.db2.gz KTENYDKUZLCVMZ-UHFFFAOYSA-N 1 2 309.337 2.119 20 10 DECDLO COC(=O)C[N@@H+](Cc1cc(Cl)ccc1O)C[C@@H]1CCCO1 ZINC000264705978 291080635 /nfs/dbraw/zinc/08/06/35/291080635.db2.gz LCYCYNDBXLCWEC-ZDUSSCGKSA-N 1 2 313.781 2.200 20 10 DECDLO COC(=O)C[N@H+](Cc1cc(Cl)ccc1O)C[C@@H]1CCCO1 ZINC000264705978 291080639 /nfs/dbraw/zinc/08/06/39/291080639.db2.gz LCYCYNDBXLCWEC-ZDUSSCGKSA-N 1 2 313.781 2.200 20 10 DECDLO C[C@H](CO[C@@H]1CCOC1)[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1O ZINC000273612514 130145349 /nfs/dbraw/zinc/14/53/49/130145349.db2.gz WNOMRYQSVSTJCQ-NQBHXWOUSA-N 1 2 310.350 2.145 20 10 DECDLO O=C(NC1CC1)N[C@@H]1CC[N@@H+](Cc2cccc(Cl)c2O)C1 ZINC000273731367 130159303 /nfs/dbraw/zinc/15/93/03/130159303.db2.gz KDLXRCUANNXQBR-GFCCVEGCSA-N 1 2 309.797 2.082 20 10 DECDLO O=C(NC1CC1)N[C@@H]1CC[N@H+](Cc2cccc(Cl)c2O)C1 ZINC000273731367 130159305 /nfs/dbraw/zinc/15/93/05/130159305.db2.gz KDLXRCUANNXQBR-GFCCVEGCSA-N 1 2 309.797 2.082 20 10 DECDLO C[C@@H](CS(C)(=O)=O)[NH2+]Cc1cc(Cl)cc(Cl)c1O ZINC000078639887 401859953 /nfs/dbraw/zinc/85/99/53/401859953.db2.gz DLOGZPSUXCGBLI-ZETCQYMHSA-N 1 2 312.218 2.222 20 10 DECDLO NC(=O)[C@@H]1CCC[N@H+](Cc2cc(Cl)cc(Cl)c2O)C1 ZINC000155015305 402242181 /nfs/dbraw/zinc/24/21/81/402242181.db2.gz SGMGDUUAQMPRPY-MRVPVSSYSA-N 1 2 303.189 2.396 20 10 DECDLO NC(=O)[C@@H]1CCC[N@@H+](Cc2cc(Cl)cc(Cl)c2O)C1 ZINC000155015305 402242182 /nfs/dbraw/zinc/24/21/82/402242182.db2.gz SGMGDUUAQMPRPY-MRVPVSSYSA-N 1 2 303.189 2.396 20 10 DECDLO CC[C@H]1C[N@H+](Cc2ccc([N+](=O)[O-])c(OC)c2O)C[C@@H](C)O1 ZINC000278163993 402861491 /nfs/dbraw/zinc/86/14/91/402861491.db2.gz DVZNREHSCGEPMS-PWSUYJOCSA-N 1 2 310.350 2.308 20 10 DECDLO CC[C@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])c(OC)c2O)C[C@@H](C)O1 ZINC000278163993 402861493 /nfs/dbraw/zinc/86/14/93/402861493.db2.gz DVZNREHSCGEPMS-PWSUYJOCSA-N 1 2 310.350 2.308 20 10 DECDLO COc1c(O)c(C[N@@H+]2CCO[C@H]3CCC[C@H]32)ccc1[N+](=O)[O-] ZINC000278247143 402862535 /nfs/dbraw/zinc/86/25/35/402862535.db2.gz OTKOAGVQTVOMQI-YPMHNXCESA-N 1 2 308.334 2.062 20 10 DECDLO COc1c(O)c(C[N@H+]2CCO[C@H]3CCC[C@H]32)ccc1[N+](=O)[O-] ZINC000278247143 402862538 /nfs/dbraw/zinc/86/25/38/402862538.db2.gz OTKOAGVQTVOMQI-YPMHNXCESA-N 1 2 308.334 2.062 20 10 DECDLO CN(C)C(=O)[C@H]1CCC[N@@H+]1Cc1cc(Cl)c(F)cc1O ZINC000294823963 403735045 /nfs/dbraw/zinc/73/50/45/403735045.db2.gz GMPUFZSIPWVEAM-GFCCVEGCSA-N 1 2 300.761 2.237 20 10 DECDLO CN(C)C(=O)[C@H]1CCC[N@H+]1Cc1cc(Cl)c(F)cc1O ZINC000294823963 403735048 /nfs/dbraw/zinc/73/50/48/403735048.db2.gz GMPUFZSIPWVEAM-GFCCVEGCSA-N 1 2 300.761 2.237 20 10 DECDLO CCC[N@H+](Cc1noc(CCOC)n1)Cc1ccccc1O ZINC000290023987 404015466 /nfs/dbraw/zinc/01/54/66/404015466.db2.gz PQUFQPZUUBFPSN-UHFFFAOYSA-N 1 2 305.378 2.376 20 10 DECDLO CCC[N@@H+](Cc1noc(CCOC)n1)Cc1ccccc1O ZINC000290023987 404015481 /nfs/dbraw/zinc/01/54/81/404015481.db2.gz PQUFQPZUUBFPSN-UHFFFAOYSA-N 1 2 305.378 2.376 20 10 DECDLO COC(=O)c1ccc(O)c([C@@H](C)[NH2+]Cc2nnc(C(C)C)[nH]2)c1 ZINC000296625743 404312257 /nfs/dbraw/zinc/31/22/57/404312257.db2.gz XCFFGPNJEYUQHI-SNVBAGLBSA-N 1 2 318.377 2.271 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@@H+]2CCC(F)(F)[C@H](CO)C2)c1O ZINC000291863682 404556101 /nfs/dbraw/zinc/55/61/01/404556101.db2.gz PMCMUPZPITWNQW-NSHDSACASA-N 1 2 317.307 2.183 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@H+]2CCC(F)(F)[C@H](CO)C2)c1O ZINC000291863682 404556109 /nfs/dbraw/zinc/55/61/09/404556109.db2.gz PMCMUPZPITWNQW-NSHDSACASA-N 1 2 317.307 2.183 20 10 DECDLO COCCN1CC[C@@H]([NH2+][C@@H](C)c2ccc(F)c(F)c2O)C1 ZINC000276930466 292541841 /nfs/dbraw/zinc/54/18/41/292541841.db2.gz ODXATXYGWRYRFT-WDEREUQCSA-N 1 2 300.349 2.042 20 10 DECDLO COc1cc(O)c(C[N@@H+]2CCC[C@@H]2c2ncc[nH]2)cc1OC ZINC000375353353 227147930 /nfs/dbraw/zinc/14/79/30/227147930.db2.gz PKBOAXJMEIFDAZ-GFCCVEGCSA-N 1 2 303.362 2.470 20 10 DECDLO COc1cc(O)c(C[N@H+]2CCC[C@@H]2c2ncc[nH]2)cc1OC ZINC000375353353 227147940 /nfs/dbraw/zinc/14/79/40/227147940.db2.gz PKBOAXJMEIFDAZ-GFCCVEGCSA-N 1 2 303.362 2.470 20 10 DECDLO C[C@H]([NH2+][C@H]1C[C@@H](O)C1)c1cc(Br)cc(F)c1O ZINC000834905456 649859097 /nfs/dbraw/zinc/85/90/97/649859097.db2.gz IEEZHZKOBNHZGX-CNUIFLNQSA-N 1 2 304.159 2.468 20 10 DECDLO O=C(c1ccco1)N1CCC[N@@H+](Cc2cccc(F)c2O)CC1 ZINC000374917523 534757685 /nfs/dbraw/zinc/75/76/85/534757685.db2.gz QWRYSBXJXODFAH-UHFFFAOYSA-N 1 2 318.348 2.472 20 10 DECDLO O=C(c1ccco1)N1CCC[N@H+](Cc2cccc(F)c2O)CC1 ZINC000374917523 534757691 /nfs/dbraw/zinc/75/76/91/534757691.db2.gz QWRYSBXJXODFAH-UHFFFAOYSA-N 1 2 318.348 2.472 20 10 DECDLO COC(=O)[C@@H]1C[C@H](C)CC[N@@H+]1Cc1cc(OC)c(OC)cc1O ZINC000274952698 536525310 /nfs/dbraw/zinc/52/53/10/536525310.db2.gz SKRHPWIVGWYUTC-YPMHNXCESA-N 1 2 323.389 2.183 20 10 DECDLO COC(=O)[C@@H]1C[C@H](C)CC[N@H+]1Cc1cc(OC)c(OC)cc1O ZINC000274952698 536525316 /nfs/dbraw/zinc/52/53/16/536525316.db2.gz SKRHPWIVGWYUTC-YPMHNXCESA-N 1 2 323.389 2.183 20 10 DECDLO COc1ccc(C[N@H+](C)[C@@H](C)C(=O)OC(C)C)c(O)c1OC ZINC000892148782 624796827 /nfs/dbraw/zinc/79/68/27/624796827.db2.gz MYUAQGJJXRJDHV-NSHDSACASA-N 1 2 311.378 2.181 20 10 DECDLO COc1ccc(C[N@@H+](C)[C@@H](C)C(=O)OC(C)C)c(O)c1OC ZINC000892148782 624796828 /nfs/dbraw/zinc/79/68/28/624796828.db2.gz MYUAQGJJXRJDHV-NSHDSACASA-N 1 2 311.378 2.181 20 10 DECDLO C[C@@H]1CC[N@H+](Cc2cc(Br)cc(F)c2O)[C@@H]1CO ZINC000894533463 637093476 /nfs/dbraw/zinc/09/34/76/637093476.db2.gz MSLILADODOAQFB-PRHODGIISA-N 1 2 318.186 2.497 20 10 DECDLO C[C@@H]1CC[N@@H+](Cc2cc(Br)cc(F)c2O)[C@@H]1CO ZINC000894533463 637093486 /nfs/dbraw/zinc/09/34/86/637093486.db2.gz MSLILADODOAQFB-PRHODGIISA-N 1 2 318.186 2.497 20 10 DECDLO C[N@@H+](Cc1cc(Br)cc(F)c1O)CC1CC(O)C1 ZINC000894534180 637094639 /nfs/dbraw/zinc/09/46/39/637094639.db2.gz QKPWNDGNIRHLBY-UHFFFAOYSA-N 1 2 318.186 2.497 20 10 DECDLO C[N@H+](Cc1cc(Br)cc(F)c1O)CC1CC(O)C1 ZINC000894534180 637094641 /nfs/dbraw/zinc/09/46/41/637094641.db2.gz QKPWNDGNIRHLBY-UHFFFAOYSA-N 1 2 318.186 2.497 20 10 DECDLO C[C@@H](NC(=O)NCCc1cn(C)c[nH+]1)c1ccc(N(C)C)cc1 ZINC000838559134 637599391 /nfs/dbraw/zinc/59/93/91/637599391.db2.gz KNRPUJNOVCZFNO-CYBMUJFWSA-N 1 2 315.421 2.089 20 10 DECDLO CCn1ccc(C[NH2+][C@H](C)c2cc(C(=O)OC)ccc2O)n1 ZINC000840839994 650365209 /nfs/dbraw/zinc/36/52/09/650365209.db2.gz CPLLUKLHAQORDL-LLVKDONJSA-N 1 2 303.362 2.246 20 10 DECDLO CCOC(=O)c1ncc(C[NH2+]Cc2c(O)cccc2F)s1 ZINC000896641609 638622481 /nfs/dbraw/zinc/62/24/81/638622481.db2.gz NTSKKNLBQYSHJA-UHFFFAOYSA-N 1 2 310.350 2.454 20 10 DECDLO Cc1cc(O)c(C[NH+]2CC(OCC(=O)N(C)C)C2)cc1C(C)C ZINC000751943991 639138773 /nfs/dbraw/zinc/13/87/73/639138773.db2.gz ONZKFKGYUZBECK-UHFFFAOYSA-N 1 2 320.433 2.113 20 10 DECDLO CCNC(=O)N1CC[C@@H]([NH2+][C@@H](C)c2cc(F)cc(F)c2O)C1 ZINC000756760336 639692818 /nfs/dbraw/zinc/69/28/18/639692818.db2.gz NSZSVPYCQOXZGV-GXSJLCMTSA-N 1 2 313.348 2.125 20 10 DECDLO Cc1cnc(C[N@H+](C)Cc2ccc(N3CCOCC3)cc2)nc1 ZINC000760808532 640230884 /nfs/dbraw/zinc/23/08/84/640230884.db2.gz MASURZCOVKBMBT-UHFFFAOYSA-N 1 2 312.417 2.254 20 10 DECDLO Cc1cnc(C[N@@H+](C)Cc2ccc(N3CCOCC3)cc2)nc1 ZINC000760808532 640230892 /nfs/dbraw/zinc/23/08/92/640230892.db2.gz MASURZCOVKBMBT-UHFFFAOYSA-N 1 2 312.417 2.254 20 10 DECDLO CN(C)c1ccc(CNC(=O)C[NH+]2CC3(C2)CC(F)(F)C3)cc1 ZINC000761114722 640271868 /nfs/dbraw/zinc/27/18/68/640271868.db2.gz OBHQXPGWXJZWQP-UHFFFAOYSA-N 1 2 323.387 2.100 20 10 DECDLO C[C@H]([NH2+][C@@H](CCO)C1CCOCC1)c1cc(F)cc(F)c1O ZINC000763557842 640552761 /nfs/dbraw/zinc/55/27/61/640552761.db2.gz FTDHLBGCFOZCIB-BONVTDFDSA-N 1 2 315.360 2.499 20 10 DECDLO Oc1c(Cl)cccc1C[NH2+]Cc1cn(C[C@H]2CCCO2)nn1 ZINC000898216281 641050200 /nfs/dbraw/zinc/05/02/00/641050200.db2.gz WTVRBNGMQRIYJT-CYBMUJFWSA-N 1 2 322.796 2.106 20 10 DECDLO COC(=O)c1cc(C[NH2+]Cc2cccc(Cl)c2O)cn1C ZINC000898218816 641051397 /nfs/dbraw/zinc/05/13/97/641051397.db2.gz PWCOSNNKLZCWLA-UHFFFAOYSA-N 1 2 308.765 2.461 20 10 DECDLO COc1c(O)c(C[NH2+]Cc2ccn(C(C)C)n2)ccc1[N+](=O)[O-] ZINC000775022088 641994575 /nfs/dbraw/zinc/99/45/75/641994575.db2.gz CXWFBOHQXJSNHN-UHFFFAOYSA-N 1 2 320.349 2.376 20 10 DECDLO CC(=O)N1CCC([NH2+]Cc2cc(Cl)cc(F)c2O)CC1 ZINC000775818505 642101771 /nfs/dbraw/zinc/10/17/71/642101771.db2.gz VBYFEKXVYMDOAD-UHFFFAOYSA-N 1 2 300.761 2.285 20 10 DECDLO C[C@@H]1CC[N@H+](CC(=O)N(C)Cc2ccc(N(C)C)cc2)C[C@H]1F ZINC000778235842 642358159 /nfs/dbraw/zinc/35/81/59/642358159.db2.gz JBXNBKZWEPDQAN-RHSMWYFYSA-N 1 2 321.440 2.391 20 10 DECDLO C[C@@H]1CC[N@@H+](CC(=O)N(C)Cc2ccc(N(C)C)cc2)C[C@H]1F ZINC000778235842 642358164 /nfs/dbraw/zinc/35/81/64/642358164.db2.gz JBXNBKZWEPDQAN-RHSMWYFYSA-N 1 2 321.440 2.391 20 10 DECDLO C[C@@H]([NH2+][C@@H]1CCn2cc[nH+]c2C1)c1cc([N+](=O)[O-])ccc1[O-] ZINC000779062337 642460032 /nfs/dbraw/zinc/46/00/32/642460032.db2.gz SMJZDXMHWBQXHR-GHMZBOCLSA-N 1 2 302.334 2.163 20 10 DECDLO CCOc1cccc(C[N@@H+]2CCN(CC(C)C)C(=O)[C@H]2C)c1O ZINC000779202591 642472058 /nfs/dbraw/zinc/47/20/58/642472058.db2.gz PGTUNPDIEIRPOE-CQSZACIVSA-N 1 2 320.433 2.480 20 10 DECDLO CCOc1cccc(C[N@H+]2CCN(CC(C)C)C(=O)[C@H]2C)c1O ZINC000779202591 642472061 /nfs/dbraw/zinc/47/20/61/642472061.db2.gz PGTUNPDIEIRPOE-CQSZACIVSA-N 1 2 320.433 2.480 20 10 DECDLO COCCOCCC[NH2+]Cc1cccc(Br)c1O ZINC000042411833 642581047 /nfs/dbraw/zinc/58/10/47/642581047.db2.gz YFGMRNDPWODBKI-UHFFFAOYSA-N 1 2 318.211 2.297 20 10 DECDLO Cc1cc(C)c(C(=O)NCCc2ccc(O)c(O)c2)c(C)[nH+]1 ZINC000907055888 644431515 /nfs/dbraw/zinc/43/15/15/644431515.db2.gz FYUOTCURHBXZHM-UHFFFAOYSA-N 1 2 300.358 2.391 20 10 DECDLO OC[C@@H](C[NH2+]Cc1cc(Cl)cc(F)c1O)c1cccnc1 ZINC000809778245 646281997 /nfs/dbraw/zinc/28/19/97/646281997.db2.gz NLJDRTHKXANWPP-GFCCVEGCSA-N 1 2 310.756 2.445 20 10 DECDLO C[C@@H]([NH2+][C@@H]1CC[C@H]1O)c1cc(Br)cc(F)c1O ZINC000818357691 647457367 /nfs/dbraw/zinc/45/73/67/647457367.db2.gz HMWYVRWTHLYIRW-DIMCTHFVSA-N 1 2 304.159 2.468 20 10 DECDLO O=C(/C=C/c1ccc(O)c(O)c1)NCc1ccn2cc[nH+]c2c1 ZINC000181207226 648581615 /nfs/dbraw/zinc/58/16/15/648581615.db2.gz JNUAXJMGGYCZBI-DUXPYHPUSA-N 1 2 309.325 2.075 20 10 DECDLO OCCCN1CCC[C@H]1C[NH2+]Cc1cc(Cl)cc(F)c1O ZINC000824565494 648611506 /nfs/dbraw/zinc/61/15/06/648611506.db2.gz XCAWRKPAVCWPGZ-ZDUSSCGKSA-N 1 2 316.804 2.121 20 10 DECDLO CO[C@@H]1COCC[C@H]1C[NH2+]Cc1cc(Cl)cc(F)c1O ZINC000824710235 648640495 /nfs/dbraw/zinc/64/04/95/648640495.db2.gz WCWIQMWLNZVJEP-TVQRCGJNSA-N 1 2 303.761 2.326 20 10 DECDLO Cc1cc(O)c(CN2CC[NH+]([C@H]3CCOC3)CC2)c(Cl)c1 ZINC000827125552 648976039 /nfs/dbraw/zinc/97/60/39/648976039.db2.gz MBNZYBQKHVDVOF-ZDUSSCGKSA-N 1 2 310.825 2.261 20 10 DECDLO Cc1cc(O)c(C[NH+]2CCN([C@H]3CCOC3)CC2)c(Cl)c1 ZINC000827125552 648976042 /nfs/dbraw/zinc/97/60/42/648976042.db2.gz MBNZYBQKHVDVOF-ZDUSSCGKSA-N 1 2 310.825 2.261 20 10 DECDLO COc1cccc([C@H](C)[NH2+]Cc2nc([C@@H]3CCCO3)n[nH]2)c1O ZINC000848558351 651470750 /nfs/dbraw/zinc/47/07/50/651470750.db2.gz PPRXNXRGSZJXCS-GWCFXTLKSA-N 1 2 318.377 2.221 20 10 DECDLO CCOC(=O)[C@@H]([NH2+]Cc1cccc(CC)c1O)[C@@H]1CCCOC1 ZINC000848906967 651555195 /nfs/dbraw/zinc/55/51/95/651555195.db2.gz YWFYDLPHCAOPTF-CVEARBPZSA-N 1 2 321.417 2.403 20 10 DECDLO COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@H]2C[C@H](C)n3ncnc32)c1 ZINC000850499335 651940205 /nfs/dbraw/zinc/94/02/05/651940205.db2.gz NOTDQDPVBPYPOI-KWBADKCTSA-N 1 2 316.361 2.127 20 10 DECDLO C[C@H]([NH2+]C/C=C/CO)c1cc(Br)cc(F)c1O ZINC000850506994 651941540 /nfs/dbraw/zinc/94/15/40/651941540.db2.gz DCWLGQVERWQKRB-SGJFDWMWSA-N 1 2 304.159 2.493 20 10 DECDLO C[C@@H]([NH2+][C@H]1C[C@H](O)C1)c1cc(Br)c(F)cc1O ZINC000850579487 651956401 /nfs/dbraw/zinc/95/64/01/651956401.db2.gz YIQZTTBLLPVMIO-BWZBUEFSSA-N 1 2 304.159 2.468 20 10 DECDLO O=C(NCCCSc1nccs1)[C@@H]1CCn2c[nH+]cc2C1 ZINC000132417179 684208578 /nfs/dbraw/zinc/20/85/78/684208578.db2.gz NGOXETFSPUUHFQ-LLVKDONJSA-N 1 2 322.459 2.201 20 10 DECDLO COC(=O)/C=C(\C)C[NH+]1CCN(c2ccc(OC)c(F)c2)CC1 ZINC000929823829 694034776 /nfs/dbraw/zinc/03/47/76/694034776.db2.gz UVVYEUOQFXPXKD-JLHYYAGUSA-N 1 2 322.380 2.076 20 10 DECDLO Cc1cc(O)c(CN[C@H]2CC[N@H+](CC(C)(C)O)C2)c(Cl)c1 ZINC000865660241 687294074 /nfs/dbraw/zinc/29/40/74/687294074.db2.gz QVLDWRORGAGWRL-LBPRGKRZSA-N 1 2 312.841 2.289 20 10 DECDLO Cc1cc(O)c(CN[C@H]2CC[N@@H+](CC(C)(C)O)C2)c(Cl)c1 ZINC000865660241 687294078 /nfs/dbraw/zinc/29/40/78/687294078.db2.gz QVLDWRORGAGWRL-LBPRGKRZSA-N 1 2 312.841 2.289 20 10 DECDLO COCCN(C)C(=[NH2+])NCc1cc(Cl)cc(Cl)c1O ZINC000871606368 688821976 /nfs/dbraw/zinc/82/19/76/688821976.db2.gz NBOKCQZRYUKWGF-UHFFFAOYSA-N 1 2 306.193 2.302 20 10 DECDLO CC1(C)C[N@H+](Cc2ccc(F)c(F)c2O)C[C@]2(CCOC2)O1 ZINC000877492917 690130283 /nfs/dbraw/zinc/13/02/83/690130283.db2.gz XHASXGAQLIODGO-INIZCTEOSA-N 1 2 313.344 2.440 20 10 DECDLO CC1(C)C[N@@H+](Cc2ccc(F)c(F)c2O)C[C@]2(CCOC2)O1 ZINC000877492917 690130286 /nfs/dbraw/zinc/13/02/86/690130286.db2.gz XHASXGAQLIODGO-INIZCTEOSA-N 1 2 313.344 2.440 20 10 DECDLO O=C([C@H]1CC[N@@H+](Cc2ccc(F)c(F)c2O)C1)N1CCCC1 ZINC000877529800 690142305 /nfs/dbraw/zinc/14/23/05/690142305.db2.gz MZCGVTQECYZTRW-LBPRGKRZSA-N 1 2 310.344 2.115 20 10 DECDLO O=C([C@H]1CC[N@H+](Cc2ccc(F)c(F)c2O)C1)N1CCCC1 ZINC000877529800 690142307 /nfs/dbraw/zinc/14/23/07/690142307.db2.gz MZCGVTQECYZTRW-LBPRGKRZSA-N 1 2 310.344 2.115 20 10 DECDLO Oc1c(C[NH2+][C@H]2COc3ccccc3[C@@H]2O)ccc(F)c1F ZINC000877537597 690144866 /nfs/dbraw/zinc/14/48/66/690144866.db2.gz MXBOXGCDCGIKGV-LRDDRELGSA-N 1 2 307.296 2.255 20 10 DECDLO C[C@H]([NH2+][C@@H](CO)C[C@H]1CCCO1)c1cc(F)cc(F)c1O ZINC000886669815 692154584 /nfs/dbraw/zinc/15/45/84/692154584.db2.gz FGNNCRUKZMWQIU-MVWJERBFSA-N 1 2 301.333 2.251 20 10 DECDLO COc1cccc([C@@H](C)[NH2+]Cc2nc(CSC)n[nH]2)c1O ZINC000886759747 692184562 /nfs/dbraw/zinc/18/45/62/692184562.db2.gz OFQHHHWDTACRMU-SECBINFHSA-N 1 2 308.407 2.233 20 10 DECDLO C[C@H]([NH2+][C@H]1CCc2nnn(C)c2C1)c1cc(F)cc(F)c1O ZINC000927148956 693560763 /nfs/dbraw/zinc/56/07/63/693560763.db2.gz YXRMCJFTKZXKBS-WPRPVWTQSA-N 1 2 308.332 2.007 20 10 DECDLO Nc1ccc(CNC(=O)NCCCCNc2cccc[nH+]2)cc1 ZINC001353540257 1151837176 /nfs/dbraw/zinc/83/71/76/1151837176.db2.gz SKRBLIJUZXOAFE-UHFFFAOYSA-N 1 2 313.405 2.355 20 10 DECDLO C[C@H]1C[N@H+](Cc2cc(Br)c(F)cc2O)C[C@@H]1O ZINC001144299325 790848232 /nfs/dbraw/zinc/84/82/32/790848232.db2.gz WFTBRFXWGZGFBW-MADCSZMMSA-N 1 2 304.159 2.106 20 10 DECDLO O=C(Cc1ccc(O)c(O)c1)Nc1ccccc1-n1cc[nH+]c1 ZINC001136185545 789661432 /nfs/dbraw/zinc/66/14/32/789661432.db2.gz DAZKJGNDMSVAHT-UHFFFAOYSA-N 1 2 309.325 2.465 20 10 DECDLO CN(C)c1ccc(/C=C/C(=O)N2CCc3[nH+]ccn3CC2)cc1 ZINC001180126558 795245686 /nfs/dbraw/zinc/24/56/86/795245686.db2.gz XNZTYBQIKFNAFA-VMPITWQZSA-N 1 2 310.401 2.047 20 10 DECDLO COc1ccc(O)c(C[NH2+][C@@H](C)c2nc(C(F)(F)F)n[nH]2)c1 ZINC001184001055 795978707 /nfs/dbraw/zinc/97/87/07/795978707.db2.gz ALYYNFKDDFIPIL-ZETCQYMHSA-N 1 2 316.283 2.389 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CCOC[C@H](C)C1 ZINC001139126378 796327066 /nfs/dbraw/zinc/32/70/66/796327066.db2.gz FHQSWUHMDJTDAY-LLVKDONJSA-N 1 2 303.358 2.275 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CCOC[C@H](C)C1 ZINC001139126378 796327069 /nfs/dbraw/zinc/32/70/69/796327069.db2.gz FHQSWUHMDJTDAY-LLVKDONJSA-N 1 2 303.358 2.275 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CC[C@@H](C)[C@@H](O)CC1 ZINC001139126846 796327129 /nfs/dbraw/zinc/32/71/29/796327129.db2.gz RZUFBDWNTLCWMH-ABAIWWIYSA-N 1 2 317.385 2.400 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CC[C@@H](C)[C@@H](O)CC1 ZINC001139126846 796327132 /nfs/dbraw/zinc/32/71/32/796327132.db2.gz RZUFBDWNTLCWMH-ABAIWWIYSA-N 1 2 317.385 2.400 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CC[C@@](C)(CO)C1 ZINC001139126273 796328118 /nfs/dbraw/zinc/32/81/18/796328118.db2.gz DDZVSHGAZBIPBD-QGZVFWFLSA-N 1 2 303.358 2.011 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CC[C@@](C)(CO)C1 ZINC001139126273 796328124 /nfs/dbraw/zinc/32/81/24/796328124.db2.gz DDZVSHGAZBIPBD-QGZVFWFLSA-N 1 2 303.358 2.011 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2CN1CC[NH+]2CCC1CC2 ZINC001139130576 796330801 /nfs/dbraw/zinc/33/08/01/796330801.db2.gz GCMRIOYDXKPGCJ-UHFFFAOYSA-N 1 2 314.385 2.087 20 10 DECDLO COC(=O)CC[C@H]1COCC[N@@H+]1Cc1ccc(N(C)C)c(C)c1 ZINC001139673337 796408345 /nfs/dbraw/zinc/40/83/45/796408345.db2.gz ADMGCWALAAWHMS-INIZCTEOSA-N 1 2 320.433 2.215 20 10 DECDLO COC(=O)CC[C@H]1COCC[N@H+]1Cc1ccc(N(C)C)c(C)c1 ZINC001139673337 796408346 /nfs/dbraw/zinc/40/83/46/796408346.db2.gz ADMGCWALAAWHMS-INIZCTEOSA-N 1 2 320.433 2.215 20 10 DECDLO CN1C[C@]2(CC1=O)CCCC[N@@H+]2Cc1c(O)cc(F)cc1F ZINC001140581691 796541052 /nfs/dbraw/zinc/54/10/52/796541052.db2.gz XPVUMLIFAKGNKK-MRXNPFEDSA-N 1 2 310.344 2.257 20 10 DECDLO CN1C[C@]2(CC1=O)CCCC[N@H+]2Cc1c(O)cc(F)cc1F ZINC001140581691 796541054 /nfs/dbraw/zinc/54/10/54/796541054.db2.gz XPVUMLIFAKGNKK-MRXNPFEDSA-N 1 2 310.344 2.257 20 10 DECDLO C[C@@H]1C[N@H+](Cc2ccc(N3CCOCC3)cc2F)[C@@H](C)CO1 ZINC001140667213 796553224 /nfs/dbraw/zinc/55/32/24/796553224.db2.gz LDKSPCZCVAUSSN-UONOGXRCSA-N 1 2 308.397 2.272 20 10 DECDLO C[C@@H]1C[N@@H+](Cc2ccc(N3CCOCC3)cc2F)[C@@H](C)CO1 ZINC001140667213 796553226 /nfs/dbraw/zinc/55/32/26/796553226.db2.gz LDKSPCZCVAUSSN-UONOGXRCSA-N 1 2 308.397 2.272 20 10 DECDLO COC(=O)C[C@@H]1C[N@H+](Cc2cccc(C(C)(C)C)c2O)CCO1 ZINC001143111138 796803005 /nfs/dbraw/zinc/80/30/05/796803005.db2.gz YYQJXGJSBCAUJW-CQSZACIVSA-N 1 2 321.417 2.454 20 10 DECDLO COC(=O)C[C@@H]1C[N@@H+](Cc2cccc(C(C)(C)C)c2O)CCO1 ZINC001143111138 796803010 /nfs/dbraw/zinc/80/30/10/796803010.db2.gz YYQJXGJSBCAUJW-CQSZACIVSA-N 1 2 321.417 2.454 20 10 DECDLO COc1ccc(N2CC[NH+](Cc3ncccc3OC)CC2)cc1 ZINC001206610871 800564383 /nfs/dbraw/zinc/56/43/83/800564383.db2.gz ORIXWCBALZZHGM-UHFFFAOYSA-N 1 2 313.401 2.421 20 10 DECDLO COC(=O)[C@@]1(C)CCC[N@@H+]1Cc1ccc(N(C)C)cc1OC ZINC001231852620 801737466 /nfs/dbraw/zinc/73/74/66/801737466.db2.gz YJJZZBPZCIABCW-QGZVFWFLSA-N 1 2 306.406 2.289 20 10 DECDLO COC(=O)[C@@]1(C)CCC[N@H+]1Cc1ccc(N(C)C)cc1OC ZINC001231852620 801737467 /nfs/dbraw/zinc/73/74/67/801737467.db2.gz YJJZZBPZCIABCW-QGZVFWFLSA-N 1 2 306.406 2.289 20 10 DECDLO COc1cc(O)c(C[N@H+]2C[C@H](F)C[C@H](CO)C2)cc1Cl ZINC001232266069 801833670 /nfs/dbraw/zinc/83/36/70/801833670.db2.gz IJDKZZZFIMMIAZ-GXSJLCMTSA-N 1 2 303.761 2.207 20 10 DECDLO COc1cc(O)c(C[N@@H+]2CC(=O)NC3(CCCC3)C2)cc1Cl ZINC001232270872 801834927 /nfs/dbraw/zinc/83/49/27/801834927.db2.gz LKZXEXIUCVXKGN-UHFFFAOYSA-N 1 2 324.808 2.299 20 10 DECDLO COc1cc(O)c(C[N@H+]2CC(=O)NC3(CCCC3)C2)cc1Cl ZINC001232270872 801834930 /nfs/dbraw/zinc/83/49/30/801834930.db2.gz LKZXEXIUCVXKGN-UHFFFAOYSA-N 1 2 324.808 2.299 20 10 DECDLO COc1cccc2c1CC[N@H+](Cc1cc(O)c(O)c(O)c1)C2 ZINC001233015581 802003040 /nfs/dbraw/zinc/00/30/40/802003040.db2.gz TYMBHOMSTZEVGI-UHFFFAOYSA-N 1 2 301.342 2.370 20 10 DECDLO COc1cccc2c1CC[N@@H+](Cc1cc(O)c(O)c(O)c1)C2 ZINC001233015581 802003047 /nfs/dbraw/zinc/00/30/47/802003047.db2.gz TYMBHOMSTZEVGI-UHFFFAOYSA-N 1 2 301.342 2.370 20 10 DECDLO Oc1ccc(F)c(F)c1C[N@H+]1CC[C@H](Oc2cnccn2)C1 ZINC001233336711 802081198 /nfs/dbraw/zinc/08/11/98/802081198.db2.gz WRKBGJFNOLYIFS-JTQLQIEISA-N 1 2 307.300 2.114 20 10 DECDLO CC(=O)N1CC[N@H+](Cc2cccc(C(F)(F)F)c2O)[C@@H](C)C1 ZINC001233418969 802113229 /nfs/dbraw/zinc/11/32/29/802113229.db2.gz DLPJPDIISBGUGL-JTQLQIEISA-N 1 2 316.323 2.464 20 10 DECDLO CC(=O)N1CC[N@@H+](Cc2cccc(C(F)(F)F)c2O)[C@@H](C)C1 ZINC001233418969 802113233 /nfs/dbraw/zinc/11/32/33/802113233.db2.gz DLPJPDIISBGUGL-JTQLQIEISA-N 1 2 316.323 2.464 20 10 DECDLO CC(=O)[C@@H]1C[N@H+](Cc2cccc(OC(F)(F)F)c2O)CCO1 ZINC001233776191 802207121 /nfs/dbraw/zinc/20/71/21/802207121.db2.gz MPDYTSZLNNTWLI-LBPRGKRZSA-N 1 2 319.279 2.081 20 10 DECDLO CC(=O)[C@@H]1C[N@@H+](Cc2cccc(OC(F)(F)F)c2O)CCO1 ZINC001233776191 802207125 /nfs/dbraw/zinc/20/71/25/802207125.db2.gz MPDYTSZLNNTWLI-LBPRGKRZSA-N 1 2 319.279 2.081 20 10 DECDLO O=C1C[C@@H]([NH2+]Cc2cc(Cl)cc(F)c2O)CN1CC1CC1 ZINC001331581618 1149543617 /nfs/dbraw/zinc/54/36/17/1149543617.db2.gz STLKEZUQGGJRKW-GFCCVEGCSA-N 1 2 312.772 2.285 20 10 DECDLO C[C@H]1[C@H]([NH2+]C[C@H]([NH3+])c2ccc(N(C)C)cc2)CC[C@H]1CC(=O)[O-] ZINC001594182458 998700949 /nfs/dbraw/zinc/70/09/49/998700949.db2.gz BEKOXEHTHWGNIJ-NQZOLGFYSA-N 1 2 319.449 2.231 20 10 DECDLO CC[C@H](C[C@@H](C)O)[NH2+][C@H](CC)c1cccc(-c2nn[nH]n2)c1O ZINC001604014493 1070176431 /nfs/dbraw/zinc/17/64/31/1070176431.db2.gz ABAGMXUMMGIBCT-JTNHKYCSSA-N 1 2 319.409 2.163 20 10 DECDLO COc1ccc(N(C)CC[N@H+](C)CC(=O)OCC(C)C)cc1 ZINC001619656600 1078160701 /nfs/dbraw/zinc/16/07/01/1078160701.db2.gz MFRROZCYJVKABG-UHFFFAOYSA-N 1 2 308.422 2.262 20 10 DECDLO COc1ccc(N(C)CC[N@@H+](C)CC(=O)OCC(C)C)cc1 ZINC001619656600 1078160702 /nfs/dbraw/zinc/16/07/02/1078160702.db2.gz MFRROZCYJVKABG-UHFFFAOYSA-N 1 2 308.422 2.262 20 10 DECDLO CCCOC(=O)[C@H](C)[N@H+](C)CCN(C)c1ccc(OC)cc1 ZINC001646718897 1074574774 /nfs/dbraw/zinc/57/47/74/1074574774.db2.gz JUSUPXQGDUKOSW-AWEZNQCLSA-N 1 2 308.422 2.405 20 10 DECDLO CCCOC(=O)[C@H](C)[N@@H+](C)CCN(C)c1ccc(OC)cc1 ZINC001646718897 1074574777 /nfs/dbraw/zinc/57/47/77/1074574777.db2.gz JUSUPXQGDUKOSW-AWEZNQCLSA-N 1 2 308.422 2.405 20 10 DECDLO O=C(NCCn1c[nH+]cc1-c1ccccc1)c1cccc(O)c1O ZINC001648083404 1074986925 /nfs/dbraw/zinc/98/69/25/1074986925.db2.gz SQOCMTVEVVQZFU-UHFFFAOYSA-N 1 2 323.352 2.391 20 10 DECDLO CC[C@H]([NH2+]C1CC(F)(F)C1)c1cccc(-c2nn[nH]n2)c1O ZINC001590467775 1076634366 /nfs/dbraw/zinc/63/43/66/1076634366.db2.gz UABGDIIJUZIYLH-NSHDSACASA-N 1 2 309.320 2.411 20 10 DECDLO Oc1cc(F)c(F)cc1C[NH2+]Cc1ccc(-c2nn[nH]n2)s1 ZINC001593539361 1077019048 /nfs/dbraw/zinc/01/90/48/1077019048.db2.gz NNRWHOXGTWEUAP-UHFFFAOYSA-N 1 2 323.328 2.202 20 10 DECDLO O=C(NCc1cc(O)ccc1O)c1ccc(-n2cc[nH+]c2)cc1 ZINC001593873710 1077050015 /nfs/dbraw/zinc/05/00/15/1077050015.db2.gz XKJAZDCCUKKJJX-UHFFFAOYSA-N 1 2 309.325 2.214 20 10 DECDLO C[C@H](CS(C)(=O)=O)[N@H+](Cc1ccc(Cl)cc1O)C1CC1 ZINC001659123917 1080232300 /nfs/dbraw/zinc/23/23/00/1080232300.db2.gz MZMABMJVTHFWIZ-SNVBAGLBSA-N 1 2 317.838 2.443 20 10 DECDLO C[C@H](CS(C)(=O)=O)[N@@H+](Cc1ccc(Cl)cc1O)C1CC1 ZINC001659123917 1080232307 /nfs/dbraw/zinc/23/23/07/1080232307.db2.gz MZMABMJVTHFWIZ-SNVBAGLBSA-N 1 2 317.838 2.443 20 10 DECDLO Oc1ccc(Cl)c(Cl)c1C[N@@H+]1CCN2CCOC[C@@H]2C1 ZINC001237078852 1080442200 /nfs/dbraw/zinc/44/22/00/1080442200.db2.gz YRAIEDQPMYFRNN-JTQLQIEISA-N 1 2 317.216 2.215 20 10 DECDLO Oc1ccc(Cl)c(Cl)c1C[N@H+]1CCN2CCOC[C@@H]2C1 ZINC001237078852 1080442206 /nfs/dbraw/zinc/44/22/06/1080442206.db2.gz YRAIEDQPMYFRNN-JTQLQIEISA-N 1 2 317.216 2.215 20 10 DECDLO CN1CC[C@]2(CC[N@H+](Cc3cc(Cl)cc(F)c3O)C2)C1=O ZINC001274365917 1091209382 /nfs/dbraw/zinc/20/93/82/1091209382.db2.gz MYNKXAOIOVHNMT-OAHLLOKOSA-N 1 2 312.772 2.239 20 10 DECDLO CN1CC[C@]2(CC[N@@H+](Cc3cc(Cl)cc(F)c3O)C2)C1=O ZINC001274365917 1091209392 /nfs/dbraw/zinc/20/93/92/1091209392.db2.gz MYNKXAOIOVHNMT-OAHLLOKOSA-N 1 2 312.772 2.239 20 10 DECDLO Oc1ccc(Cl)cc1C[NH+]1CC2(CCN2Cc2cn[nH]c2)C1 ZINC001275276574 1091647902 /nfs/dbraw/zinc/64/79/02/1091647902.db2.gz LCWATDXSMHKHEF-UHFFFAOYSA-N 1 2 318.808 2.229 20 10 DECDLO COC[C@@H]1CC[N@@H+]1Cc1cc(O)c(Br)cc1O ZINC001236764111 1138417326 /nfs/dbraw/zinc/41/73/26/1138417326.db2.gz FRODTNLTBGDGNE-VIFPVBQESA-N 1 2 302.168 2.081 20 10 DECDLO COC[C@@H]1CC[N@H+]1Cc1cc(O)c(Br)cc1O ZINC001236764111 1138417339 /nfs/dbraw/zinc/41/73/39/1138417339.db2.gz FRODTNLTBGDGNE-VIFPVBQESA-N 1 2 302.168 2.081 20 10 DECDLO CCn1nnc2c1CC[N@H+](Cc1c(C)cccc1O)[C@@H]2COC ZINC001237486176 1138654299 /nfs/dbraw/zinc/65/42/99/1138654299.db2.gz OXRFWPWDCLYAGL-OAHLLOKOSA-N 1 2 316.405 2.058 20 10 DECDLO CCn1nnc2c1CC[N@@H+](Cc1c(C)cccc1O)[C@@H]2COC ZINC001237486176 1138654307 /nfs/dbraw/zinc/65/43/07/1138654307.db2.gz OXRFWPWDCLYAGL-OAHLLOKOSA-N 1 2 316.405 2.058 20 10 DECDLO C[C@@H]([NH2+]CCN1CCOC[C@H]1C)c1cc(F)cc(F)c1O ZINC001320249385 1140840792 /nfs/dbraw/zinc/84/07/92/1140840792.db2.gz YXPVYBDAALZWOA-GHMZBOCLSA-N 1 2 300.349 2.042 20 10 DECDLO C[C@@H]([NH2+]CCN1CCOC[C@@H]1C)c1cc(F)cc(F)c1O ZINC001320249388 1140840877 /nfs/dbraw/zinc/84/08/77/1140840877.db2.gz YXPVYBDAALZWOA-WDEREUQCSA-N 1 2 300.349 2.042 20 10 DECDLO COc1ccc(C[NH+]2CCC2)c(O)c1I ZINC001248476332 1141800561 /nfs/dbraw/zinc/80/05/61/1141800561.db2.gz DIJBEAZNVDVVNN-UHFFFAOYSA-N 1 2 319.142 2.211 20 10 DECDLO CCCc1nnc(-c2ccc(O)c(C[NH+]3CCOCC3)c2)o1 ZINC001254031629 1143029085 /nfs/dbraw/zinc/02/90/85/1143029085.db2.gz GHIMJRBNFNNXAX-UHFFFAOYSA-N 1 2 303.362 2.227 20 10 DECDLO Oc1ccc(-c2nnc(C3CC3)o2)cc1C[NH+]1CCOCC1 ZINC001254125979 1143042711 /nfs/dbraw/zinc/04/27/11/1143042711.db2.gz ILUAWYKMMILVLU-UHFFFAOYSA-N 1 2 301.346 2.152 20 10 DECDLO CN(Cc1ccccc1O)c1nnc([C@H]2CCCC[N@@H+]2C)n1C ZINC001262904290 1144341236 /nfs/dbraw/zinc/34/12/36/1144341236.db2.gz LYOPGMDFGLYQGW-CQSZACIVSA-N 1 2 315.421 2.314 20 10 DECDLO CN(Cc1ccccc1O)c1nnc([C@H]2CCCC[N@H+]2C)n1C ZINC001262904290 1144341238 /nfs/dbraw/zinc/34/12/38/1144341238.db2.gz LYOPGMDFGLYQGW-CQSZACIVSA-N 1 2 315.421 2.314 20 10 DECDLO CC(C)c1ccc(O)c(C[NH+]2CCN(CC[S@](C)=O)CC2)c1 ZINC001308569443 1147480838 /nfs/dbraw/zinc/48/08/38/1147480838.db2.gz IOAHFQOOLWMBAU-QFIPXVFZSA-N 1 2 324.490 2.012 20 10 DECDLO CN(C)c1ccc(C[N@@H+]2CCOC[C@@H]2[C@H]2CCCC2=O)cc1F ZINC000375469250 529780534 /nfs/dbraw/zinc/78/05/34/529780534.db2.gz NCKBBQRFJAQBKR-RHSMWYFYSA-N 1 2 320.408 2.462 20 10 DECDLO CN(C)c1ccc(C[N@H+]2CCOC[C@@H]2[C@H]2CCCC2=O)cc1F ZINC000375469250 529780535 /nfs/dbraw/zinc/78/05/35/529780535.db2.gz NCKBBQRFJAQBKR-RHSMWYFYSA-N 1 2 320.408 2.462 20 10 DECDLO C[C@@H]([NH2+]Cc1cc(Cl)c(F)cc1O)[C@@H](C)N1CCOCC1 ZINC000293736515 131763915 /nfs/dbraw/zinc/76/39/15/131763915.db2.gz WVXMEWNPUGTGFS-GHMZBOCLSA-N 1 2 316.804 2.384 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@@H+]2CCO[C@H]([C@@H]3CCCO3)C2)c1O ZINC000089153864 401937380 /nfs/dbraw/zinc/93/73/80/401937380.db2.gz FOSLZQKSWAXSGY-HOTGVXAUSA-N 1 2 323.364 2.114 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@H+]2CCO[C@H]([C@@H]3CCCO3)C2)c1O ZINC000089153864 401937382 /nfs/dbraw/zinc/93/73/82/401937382.db2.gz FOSLZQKSWAXSGY-HOTGVXAUSA-N 1 2 323.364 2.114 20 10 DECDLO CS(=O)(=O)CCC[NH2+]Cc1cc(Cl)cc(Cl)c1O ZINC000038047235 401921176 /nfs/dbraw/zinc/92/11/76/401921176.db2.gz VZKMKJSMCFBAPW-UHFFFAOYSA-N 1 2 312.218 2.223 20 10 DECDLO Cc1nc2n(n1)C[C@@H]([NH2+][C@@H](C)c1ccc(F)c(F)c1O)CC2 ZINC000187692509 402508787 /nfs/dbraw/zinc/50/87/87/402508787.db2.gz ITVJQUDRPPGRFA-WPRPVWTQSA-N 1 2 308.332 2.236 20 10 DECDLO CCCN(Cc1ccccc1O)C(=O)CCc1c[nH+]cn1C ZINC000276643921 403192668 /nfs/dbraw/zinc/19/26/68/403192668.db2.gz VINLEFHRQYLDMI-UHFFFAOYSA-N 1 2 301.390 2.497 20 10 DECDLO CC[N@H+](CC(=O)OC)Cc1ccc(N2CCC(OC)CC2)cc1 ZINC000299322059 403557089 /nfs/dbraw/zinc/55/70/89/403557089.db2.gz DEICQTHNEOBPNP-UHFFFAOYSA-N 1 2 320.433 2.297 20 10 DECDLO CC[N@@H+](CC(=O)OC)Cc1ccc(N2CCC(OC)CC2)cc1 ZINC000299322059 403557092 /nfs/dbraw/zinc/55/70/92/403557092.db2.gz DEICQTHNEOBPNP-UHFFFAOYSA-N 1 2 320.433 2.297 20 10 DECDLO Oc1ccc(Br)cc1C[NH2+]Cc1nnc(C2CC2)[nH]1 ZINC000294779170 403734112 /nfs/dbraw/zinc/73/41/12/403734112.db2.gz KYFONGJYUWVUED-UHFFFAOYSA-N 1 2 323.194 2.440 20 10 DECDLO CCN(CC)C(=O)C[N@H+](C)Cc1cc(Cl)c(F)cc1O ZINC000295014516 403740232 /nfs/dbraw/zinc/74/02/32/403740232.db2.gz VXHSNJNFLHVLBL-UHFFFAOYSA-N 1 2 302.777 2.485 20 10 DECDLO CCN(CC)C(=O)C[N@@H+](C)Cc1cc(Cl)c(F)cc1O ZINC000295014516 403740234 /nfs/dbraw/zinc/74/02/34/403740234.db2.gz VXHSNJNFLHVLBL-UHFFFAOYSA-N 1 2 302.777 2.485 20 10 DECDLO O=C(C=Cc1c[nH]c[nH+]1)N1CCC[C@H](O)c2cc(F)ccc21 ZINC000493438833 405540306 /nfs/dbraw/zinc/54/03/06/405540306.db2.gz ZCORZBCIGTUAOE-DRDHIDPGSA-N 1 2 301.321 2.422 20 10 DECDLO OCCCN1CCC[C@@H]([NH2+]Cc2cc(Cl)c(F)cc2O)C1 ZINC000294697491 534360682 /nfs/dbraw/zinc/36/06/82/534360682.db2.gz CDASKXNLXKNKOY-GFCCVEGCSA-N 1 2 316.804 2.121 20 10 DECDLO CN(C)c1ccc(C[NH+]2CCN(C(=O)c3cccnc3)CC2)cc1 ZINC000156871937 522180847 /nfs/dbraw/zinc/18/08/47/522180847.db2.gz VUKBHCYOJJIJMO-UHFFFAOYSA-N 1 2 324.428 2.106 20 10 DECDLO C[N@H+](Cc1c(O)ccc(Cl)c1F)[C@@H]1CCCCNC1=O ZINC000365267562 523157867 /nfs/dbraw/zinc/15/78/67/523157867.db2.gz XTVKDQDIKRKRGU-LLVKDONJSA-N 1 2 300.761 2.285 20 10 DECDLO C[N@@H+](Cc1c(O)ccc(Cl)c1F)[C@@H]1CCCCNC1=O ZINC000365267562 523157885 /nfs/dbraw/zinc/15/78/85/523157885.db2.gz XTVKDQDIKRKRGU-LLVKDONJSA-N 1 2 300.761 2.285 20 10 DECDLO Cn1c[nH+]cc1CCC(=O)NCc1ccc2c(c1)CCCN2C ZINC000188805071 527506245 /nfs/dbraw/zinc/50/62/45/527506245.db2.gz QQMYKGKLCGYCGX-UHFFFAOYSA-N 1 2 312.417 2.052 20 10 DECDLO CCO[C@@H](CNCc1c(O)ccc(Cl)c1F)C[NH+](C)C ZINC000922753725 636376518 /nfs/dbraw/zinc/37/65/18/636376518.db2.gz IFCLHEUIDXSQJC-JTQLQIEISA-N 1 2 304.793 2.241 20 10 DECDLO COC(=O)c1ccc(O)c([C@@H](C)[NH2+][C@H](C)c2csnn2)c1 ZINC000840885252 650371327 /nfs/dbraw/zinc/37/13/27/650371327.db2.gz AIDOKDUKETVEHO-RKDXNWHRSA-N 1 2 307.375 2.442 20 10 DECDLO Cc1cc(N(C)C)ccc1C[N@@H+]1CCO[C@H](C(=O)C2CC2)C1 ZINC000840943461 650392510 /nfs/dbraw/zinc/39/25/10/650392510.db2.gz XKDVZAXANDHMLZ-KRWDZBQOSA-N 1 2 302.418 2.241 20 10 DECDLO Cc1cc(N(C)C)ccc1C[N@H+]1CCO[C@H](C(=O)C2CC2)C1 ZINC000840943461 650392514 /nfs/dbraw/zinc/39/25/14/650392514.db2.gz XKDVZAXANDHMLZ-KRWDZBQOSA-N 1 2 302.418 2.241 20 10 DECDLO COC(=O)c1cc(C[NH2+]Cc2ccc(F)c(F)c2O)n(C)c1C ZINC000895647221 638124137 /nfs/dbraw/zinc/12/41/37/638124137.db2.gz SGOWDVYWEJFAAQ-UHFFFAOYSA-N 1 2 324.327 2.394 20 10 DECDLO CN(C)C(=O)[C@H]1CC[N@H+](Cc2cc(Cl)cc(F)c2O)C1 ZINC000840958986 650394941 /nfs/dbraw/zinc/39/49/41/650394941.db2.gz XBVKBGGRRVYQKV-VIFPVBQESA-N 1 2 300.761 2.095 20 10 DECDLO CN(C)C(=O)[C@H]1CC[N@@H+](Cc2cc(Cl)cc(F)c2O)C1 ZINC000840958986 650394945 /nfs/dbraw/zinc/39/49/45/650394945.db2.gz XBVKBGGRRVYQKV-VIFPVBQESA-N 1 2 300.761 2.095 20 10 DECDLO C[C@@H]([NH2+]CCNC(=O)c1ccco1)c1cc(F)cc(F)c1O ZINC000756368213 639654824 /nfs/dbraw/zinc/65/48/24/639654824.db2.gz QOZDOYNTJNANRC-SECBINFHSA-N 1 2 310.300 2.344 20 10 DECDLO Cc1nc2n(n1)C[C@@H]([NH2+][C@H](C)c1cc(F)cc(F)c1O)CC2 ZINC000756535022 639670448 /nfs/dbraw/zinc/67/04/48/639670448.db2.gz MWENNVISQDVRSP-KCJUWKMLSA-N 1 2 308.332 2.236 20 10 DECDLO C[C@@H]([NH2+]CCN1CCO[C@@H](C)C1)c1cc(F)cc(F)c1O ZINC000756544444 639671426 /nfs/dbraw/zinc/67/14/26/639671426.db2.gz IKAXNEBHWCNSSW-WDEREUQCSA-N 1 2 300.349 2.042 20 10 DECDLO COC1CCN(CC[NH2+][C@@H](C)c2cc(F)cc(F)c2O)CC1 ZINC000756641916 639680751 /nfs/dbraw/zinc/68/07/51/639680751.db2.gz JMMFHBMEKFHKPA-NSHDSACASA-N 1 2 314.376 2.432 20 10 DECDLO COc1cccc(O)c1C[NH+]1CCN(C(=O)OC(C)(C)C)CC1 ZINC000768223617 641060323 /nfs/dbraw/zinc/06/03/23/641060323.db2.gz JYMFXBDNMSFEKO-UHFFFAOYSA-N 1 2 322.405 2.454 20 10 DECDLO C[C@@H](NC(=O)NCCCn1cc[nH+]c1)c1ccc(N(C)C)cc1 ZINC000774016232 641853360 /nfs/dbraw/zinc/85/33/60/641853360.db2.gz HRENADHCFGNDKH-CQSZACIVSA-N 1 2 315.421 2.400 20 10 DECDLO Cc1cc(Cl)cc(C[NH+]2CCN(C(=O)C3CC3)CC2)c1O ZINC000775645557 642071627 /nfs/dbraw/zinc/07/16/27/642071627.db2.gz BHFJVIZGICEEIV-UHFFFAOYSA-N 1 2 308.809 2.408 20 10 DECDLO COCC[N@H+](CC(=O)OC(C)(C)C)Cc1cccc(C)c1O ZINC000775669013 642075269 /nfs/dbraw/zinc/07/52/69/642075269.db2.gz QKBLEDPETHCCKN-UHFFFAOYSA-N 1 2 309.406 2.491 20 10 DECDLO COCC[N@@H+](CC(=O)OC(C)(C)C)Cc1cccc(C)c1O ZINC000775669013 642075273 /nfs/dbraw/zinc/07/52/73/642075273.db2.gz QKBLEDPETHCCKN-UHFFFAOYSA-N 1 2 309.406 2.491 20 10 DECDLO CCO[C@@H]1C[C@@H]([NH2+]Cc2cc(Cl)cc(F)c2O)[C@@H]1OC ZINC000775979538 642118606 /nfs/dbraw/zinc/11/86/06/642118606.db2.gz VUNXCHQPZNWQSW-BZPMIXESSA-N 1 2 303.761 2.467 20 10 DECDLO C[C@@H]([NH2+]CCCON)c1cc(Br)cc(F)c1O ZINC000902425855 643034089 /nfs/dbraw/zinc/03/40/89/643034089.db2.gz OHKQQTPHACHICJ-SSDOTTSWSA-N 1 2 307.163 2.225 20 10 DECDLO O=C(NCCCSc1nccs1)[C@H]1CCc2[nH+]ccn2C1 ZINC000786974455 643436614 /nfs/dbraw/zinc/43/66/14/643436614.db2.gz JROVOWAVBJZFQE-NSHDSACASA-N 1 2 322.459 2.201 20 10 DECDLO C[C@H]([NH2+]Cc1cc(Cl)cc(F)c1O)C(=O)N1CCCC1 ZINC000798959319 645104573 /nfs/dbraw/zinc/10/45/73/645104573.db2.gz CYRQGXKSCHQKMU-VIFPVBQESA-N 1 2 300.761 2.285 20 10 DECDLO NC(=O)Cc1ccc(C[NH2+]Cc2cccc(Cl)c2O)cc1 ZINC000811510209 646537656 /nfs/dbraw/zinc/53/76/56/646537656.db2.gz ZCQZHEWQNVXGKT-UHFFFAOYSA-N 1 2 304.777 2.363 20 10 DECDLO C[C@@H]([NH2+]CCCCS(C)(=O)=O)c1cc(F)cc(F)c1O ZINC000818351553 647457307 /nfs/dbraw/zinc/45/73/07/647457307.db2.gz UJINSUXIJCNAPD-SECBINFHSA-N 1 2 307.362 2.146 20 10 DECDLO CC(C)C[C@@H](C(=O)NCCc1ccc(O)c(O)c1)n1cc[nH+]c1 ZINC000821060193 647980933 /nfs/dbraw/zinc/98/09/33/647980933.db2.gz FPQMEENCXCNZMJ-AWEZNQCLSA-N 1 2 317.389 2.240 20 10 DECDLO C[NH+](C)CCN(Cc1cc2c(cc1O)OCO2)C1CCCC1 ZINC000154615122 648049352 /nfs/dbraw/zinc/04/93/52/648049352.db2.gz ZPDYSJQGKRXOKD-UHFFFAOYSA-N 1 2 306.406 2.427 20 10 DECDLO CCOC(=O)C[N@@H+](Cc1ccccc1O)C[C@H]1CCCCO1 ZINC000823581723 648446397 /nfs/dbraw/zinc/44/63/97/648446397.db2.gz OFQHBPBKPCYTJT-OAHLLOKOSA-N 1 2 307.390 2.326 20 10 DECDLO CCOC(=O)C[N@H+](Cc1ccccc1O)C[C@H]1CCCCO1 ZINC000823581723 648446399 /nfs/dbraw/zinc/44/63/99/648446399.db2.gz OFQHBPBKPCYTJT-OAHLLOKOSA-N 1 2 307.390 2.326 20 10 DECDLO COC[C@](C)(O)CC[NH2+]Cc1cccc(Br)c1O ZINC000824559563 648610129 /nfs/dbraw/zinc/61/01/29/648610129.db2.gz VNXSBICDLHMFNU-CYBMUJFWSA-N 1 2 318.211 2.032 20 10 DECDLO COC[C@]1(C(=O)OC)CCC[N@@H+]1Cc1ccc(N(C)C)c(F)c1 ZINC000827489935 649041566 /nfs/dbraw/zinc/04/15/66/649041566.db2.gz YQSYFKQSGCOZII-KRWDZBQOSA-N 1 2 324.396 2.046 20 10 DECDLO COC[C@]1(C(=O)OC)CCC[N@H+]1Cc1ccc(N(C)C)c(F)c1 ZINC000827489935 649041569 /nfs/dbraw/zinc/04/15/69/649041569.db2.gz YQSYFKQSGCOZII-KRWDZBQOSA-N 1 2 324.396 2.046 20 10 DECDLO O=C(NCCCSc1nccs1)[C@H]1CCc2c[nH+]cn2C1 ZINC000844135256 651081992 /nfs/dbraw/zinc/08/19/92/651081992.db2.gz UZJMPIBKOKQSFS-NSHDSACASA-N 1 2 322.459 2.201 20 10 DECDLO C[C@@H](CC(=O)NCc1ccc(N(C)C)c(F)c1)n1cc[nH+]c1 ZINC000844357047 651116731 /nfs/dbraw/zinc/11/67/31/651116731.db2.gz LIGMMOPIIRWKJN-LBPRGKRZSA-N 1 2 304.369 2.356 20 10 DECDLO CCOC(=O)[C@H]([NH2+]Cc1cccc(CC)c1O)[C@H]1CCCOC1 ZINC000848906972 651554867 /nfs/dbraw/zinc/55/48/67/651554867.db2.gz YWFYDLPHCAOPTF-JKSUJKDBSA-N 1 2 321.417 2.403 20 10 DECDLO O=C1O[C@@H](C[NH2+]Cc2cc(Cl)cc(F)c2O)CN1C1CC1 ZINC000848928803 651564621 /nfs/dbraw/zinc/56/46/21/651564621.db2.gz OALOLVYNCWJZGP-NSHDSACASA-N 1 2 314.744 2.258 20 10 DECDLO C[C@@H]1[C@H](C)OCC[N@@H+]1Cc1ccc(N2CCOCC2)c(F)c1 ZINC000093418167 684049261 /nfs/dbraw/zinc/04/92/61/684049261.db2.gz YGHBSJHDRHLZFT-KGLIPLIRSA-N 1 2 308.397 2.272 20 10 DECDLO C[C@@H]1[C@H](C)OCC[N@H+]1Cc1ccc(N2CCOCC2)c(F)c1 ZINC000093418167 684049263 /nfs/dbraw/zinc/04/92/63/684049263.db2.gz YGHBSJHDRHLZFT-KGLIPLIRSA-N 1 2 308.397 2.272 20 10 DECDLO CCN(CC)c1ccc(C[N@@H+]2C[C@@H](C)O[C@H](CO)C2)cc1F ZINC000191532581 684431517 /nfs/dbraw/zinc/43/15/17/684431517.db2.gz SHCIHJPGXVOKKD-HIFRSBDPSA-N 1 2 310.413 2.254 20 10 DECDLO CCN(CC)c1ccc(C[N@H+]2C[C@@H](C)O[C@H](CO)C2)cc1F ZINC000191532581 684431519 /nfs/dbraw/zinc/43/15/19/684431519.db2.gz SHCIHJPGXVOKKD-HIFRSBDPSA-N 1 2 310.413 2.254 20 10 DECDLO C[C@@H]([NH2+]Cc1ccc(F)c(F)c1O)C(=O)NCc1ccco1 ZINC000877150318 690030585 /nfs/dbraw/zinc/03/05/85/690030585.db2.gz OPOQSSFUKMMTLQ-SECBINFHSA-N 1 2 310.300 2.058 20 10 DECDLO OC[C@@]1([NH2+]Cc2ccc(F)c(F)c2O)CCOc2ccccc21 ZINC000877499250 690132591 /nfs/dbraw/zinc/13/25/91/690132591.db2.gz NFXBKRMKSRXHHS-KRWDZBQOSA-N 1 2 321.323 2.430 20 10 DECDLO CS(=O)(=O)C1(C[NH2+]Cc2ccc(F)c(F)c2O)CCCC1 ZINC000877519398 690139429 /nfs/dbraw/zinc/13/94/29/690139429.db2.gz RJKAZYKEJBONCW-UHFFFAOYSA-N 1 2 319.373 2.117 20 10 DECDLO COC(=O)[C@@H]1CSCC[N@H+](Cc2ccc(F)c(F)c2O)C1 ZINC000877593348 690161320 /nfs/dbraw/zinc/16/13/20/690161320.db2.gz STKBIQQLQFDWPZ-JTQLQIEISA-N 1 2 317.357 2.008 20 10 DECDLO COC(=O)[C@@H]1CSCC[N@@H+](Cc2ccc(F)c(F)c2O)C1 ZINC000877593348 690161324 /nfs/dbraw/zinc/16/13/24/690161324.db2.gz STKBIQQLQFDWPZ-JTQLQIEISA-N 1 2 317.357 2.008 20 10 DECDLO C[C@H]([NH2+][C@H]1C[C@H](O)C12CCOCC2)c1cc(F)cc(F)c1O ZINC000927154386 693562060 /nfs/dbraw/zinc/56/20/60/693562060.db2.gz FTUISJIFMPIUBK-HERUPUMHSA-N 1 2 313.344 2.251 20 10 DECDLO C[C@]1(O)CC[N@H+](Cc2cc(Br)c(F)cc2O)C1 ZINC001144298974 790849958 /nfs/dbraw/zinc/84/99/58/790849958.db2.gz NOHSMIDLIYNFFR-LBPRGKRZSA-N 1 2 304.159 2.251 20 10 DECDLO C[C@]1(O)CC[N@@H+](Cc2cc(Br)c(F)cc2O)C1 ZINC001144298974 790849971 /nfs/dbraw/zinc/84/99/71/790849971.db2.gz NOHSMIDLIYNFFR-LBPRGKRZSA-N 1 2 304.159 2.251 20 10 DECDLO CC[N@@H+](Cc1cc(Br)c(F)cc1O)C1CN(C)C1 ZINC001144308233 790856569 /nfs/dbraw/zinc/85/65/69/790856569.db2.gz UEKQIRAPVSIGJI-UHFFFAOYSA-N 1 2 317.202 2.430 20 10 DECDLO Cc1nonc1[C@H](C)[NH2+]Cc1ccc(N2CCOCC2)c(F)c1 ZINC000826553910 783652177 /nfs/dbraw/zinc/65/21/77/783652177.db2.gz VXRIRGLGBBHAQV-NSHDSACASA-N 1 2 320.368 2.205 20 10 DECDLO C[C@@H]1COC[C@@H]1[NH2+]Cc1cc(Br)cc(F)c1O ZINC000715713964 792507874 /nfs/dbraw/zinc/50/78/74/792507874.db2.gz SVZOCHGCCSIQKC-HQJQHLMTSA-N 1 2 304.159 2.418 20 10 DECDLO COCCOCC[NH2+]Cc1cc(Br)cc(F)c1O ZINC000715748122 792509914 /nfs/dbraw/zinc/50/99/14/792509914.db2.gz ZJFMESIMVFBRIF-UHFFFAOYSA-N 1 2 322.174 2.046 20 10 DECDLO C[C@@H]([NH2+]Cc1cccc(Br)c1O)C1(CO)CC1 ZINC000696126678 794560669 /nfs/dbraw/zinc/56/06/69/794560669.db2.gz NBCBESBQAZFBSP-SECBINFHSA-N 1 2 300.196 2.405 20 10 DECDLO C[C@@H](C(=O)NCc1cccc(Br)c1O)n1cc[nH+]c1 ZINC001116778452 794986152 /nfs/dbraw/zinc/98/61/52/794986152.db2.gz JFQSKFNZYCPZOR-VIFPVBQESA-N 1 2 324.178 2.229 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CC[C@@H](C)[C@H](O)CC1 ZINC001139126847 796328206 /nfs/dbraw/zinc/32/82/06/796328206.db2.gz RZUFBDWNTLCWMH-IAQYHMDHSA-N 1 2 317.385 2.400 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CC[C@@H](C)[C@H](O)CC1 ZINC001139126847 796328210 /nfs/dbraw/zinc/32/82/10/796328210.db2.gz RZUFBDWNTLCWMH-IAQYHMDHSA-N 1 2 317.385 2.400 20 10 DECDLO CO[C@H]1C[N@H+](Cc2c(O)cccc2Br)C[C@@H]1F ZINC001140098501 796477487 /nfs/dbraw/zinc/47/74/87/796477487.db2.gz CCVHPHNQQPVIJG-JQWIXIFHSA-N 1 2 304.159 2.323 20 10 DECDLO CO[C@H]1C[N@@H+](Cc2c(O)cccc2Br)C[C@@H]1F ZINC001140098501 796477489 /nfs/dbraw/zinc/47/74/89/796477489.db2.gz CCVHPHNQQPVIJG-JQWIXIFHSA-N 1 2 304.159 2.323 20 10 DECDLO COc1ncnc2c1CC[N@H+](Cc1c(O)cc(F)cc1F)CC2 ZINC001140581077 796540557 /nfs/dbraw/zinc/54/05/57/796540557.db2.gz POAVDYQHKZXTDQ-UHFFFAOYSA-N 1 2 321.327 2.070 20 10 DECDLO COc1ncnc2c1CC[N@@H+](Cc1c(O)cc(F)cc1F)CC2 ZINC001140581077 796540560 /nfs/dbraw/zinc/54/05/60/796540560.db2.gz POAVDYQHKZXTDQ-UHFFFAOYSA-N 1 2 321.327 2.070 20 10 DECDLO C[C@@H]1CN(C2C[NH+](Cc3cc(Cl)ccc3O)C2)C[C@@H](C)O1 ZINC001203665602 796560154 /nfs/dbraw/zinc/56/01/54/796560154.db2.gz PAKKJVDPJMKHKG-VXGBXAGGSA-N 1 2 310.825 2.339 20 10 DECDLO Cn1ncc2c1nc[nH+]c2NCc1ccc2cccnc2c1O ZINC001163539268 799371588 /nfs/dbraw/zinc/37/15/88/799371588.db2.gz UQBCDUQEXIMJCX-UHFFFAOYSA-N 1 2 306.329 2.229 20 10 DECDLO CN(C)c1ccc(C[N@@H+]2C[C@@H](F)C[C@H]2C(N)=O)c2ccccc21 ZINC001204243342 800193490 /nfs/dbraw/zinc/19/34/90/800193490.db2.gz XRNFKIZGTVOTIZ-GUYCJALGSA-N 1 2 315.392 2.304 20 10 DECDLO CN(C)c1ccc(C[N@H+]2C[C@@H](F)C[C@H]2C(N)=O)c2ccccc21 ZINC001204243342 800193495 /nfs/dbraw/zinc/19/34/95/800193495.db2.gz XRNFKIZGTVOTIZ-GUYCJALGSA-N 1 2 315.392 2.304 20 10 DECDLO CC[N@H+](CC(=O)OC(C)(C)C)Cc1cc(OC)c(O)cc1O ZINC001231638347 801701740 /nfs/dbraw/zinc/70/17/40/801701740.db2.gz YEKREMJVFYUSSY-UHFFFAOYSA-N 1 2 311.378 2.270 20 10 DECDLO CC[N@@H+](CC(=O)OC(C)(C)C)Cc1cc(OC)c(O)cc1O ZINC001231638347 801701746 /nfs/dbraw/zinc/70/17/46/801701746.db2.gz YEKREMJVFYUSSY-UHFFFAOYSA-N 1 2 311.378 2.270 20 10 DECDLO OC[C@H]1C[N@H+](Cc2ccc(F)c(F)c2O)C[C@@H]1C(F)(F)F ZINC001233073632 802021662 /nfs/dbraw/zinc/02/16/62/802021662.db2.gz AUARZNLZJQKXRK-BDAKNGLRSA-N 1 2 311.250 2.273 20 10 DECDLO OC[C@H]1C[N@@H+](Cc2ccc(F)c(F)c2O)C[C@@H]1C(F)(F)F ZINC001233073632 802021669 /nfs/dbraw/zinc/02/16/69/802021669.db2.gz AUARZNLZJQKXRK-BDAKNGLRSA-N 1 2 311.250 2.273 20 10 DECDLO CCn1cc(C[NH2+]Cc2cccc(Br)c2O)nn1 ZINC000404468829 802022076 /nfs/dbraw/zinc/02/20/76/802022076.db2.gz ZECDTXPPXQWJBP-UHFFFAOYSA-N 1 2 311.183 2.056 20 10 DECDLO COc1ccc(N(C)CCN(C)C(=O)[C@H](C)n2cc[nH+]c2)cc1 ZINC001346294576 1150965578 /nfs/dbraw/zinc/96/55/78/1150965578.db2.gz MAVTWFIUEIMKGT-AWEZNQCLSA-N 1 2 316.405 2.048 20 10 DECDLO Cc1nc(C[NH2+][C@H](C)c2cccc(-c3nn[nH]n3)c2O)cs1 ZINC001606042784 1071026678 /nfs/dbraw/zinc/02/66/78/1071026678.db2.gz BRHGFQDONGPDNU-MRVPVSSYSA-N 1 2 316.390 2.188 20 10 DECDLO CC(C)(C[NH2+]Cc1cc(Cl)cc(F)c1O)S(C)(=O)=O ZINC001474028934 1060798205 /nfs/dbraw/zinc/79/82/05/1060798205.db2.gz VSDPPQGSWVWFIO-UHFFFAOYSA-N 1 2 309.790 2.098 20 10 DECDLO Cn1ccnc1[C@@H]([NH2+]Cc1cccc(F)c1O)C(C)(C)CO ZINC001474538846 1060890006 /nfs/dbraw/zinc/89/00/06/1060890006.db2.gz XKBDYSVWOZFNGO-CQSZACIVSA-N 1 2 307.369 2.114 20 10 DECDLO CC(C)c1[nH]cc(CNC(=O)C=Cc2ccc(O)c(O)c2)[nH+]1 ZINC001639428230 1078612618 /nfs/dbraw/zinc/61/26/18/1078612618.db2.gz YINZWVUKDHMJII-GQCTYLIASA-N 1 2 301.346 2.274 20 10 DECDLO CC(C)c1[nH]c(CNC(=O)C=Cc2ccc(O)c(O)c2)c[nH+]1 ZINC001639428230 1078612622 /nfs/dbraw/zinc/61/26/22/1078612622.db2.gz YINZWVUKDHMJII-GQCTYLIASA-N 1 2 301.346 2.274 20 10 DECDLO CNc1cc(CNC(=O)NCc2cc(C)ccc2O)cc[nH+]1 ZINC001521343217 1069234735 /nfs/dbraw/zinc/23/47/35/1069234735.db2.gz ZIPZQJZAXWIKNR-UHFFFAOYSA-N 1 2 300.362 2.137 20 10 DECDLO COc1ccc(C[NH2+]Cc2nnnn2-c2ccccc2)cc1C ZINC001560317542 1075137306 /nfs/dbraw/zinc/13/73/06/1075137306.db2.gz VUKNOTVDECIRNF-UHFFFAOYSA-N 1 2 309.373 2.269 20 10 DECDLO C[C@@H](Cc1ccccn1)[NH2+][C@@H](C)c1cccc(-c2nn[nH]n2)c1O ZINC001589901504 1076526697 /nfs/dbraw/zinc/52/66/97/1076526697.db2.gz POUXEPNGJYFVJN-RYUDHWBXSA-N 1 2 324.388 2.249 20 10 DECDLO CC[C@H]([NH2+]C[C@@H](OC)C1CC1)c1cccc(-c2nn[nH]n2)c1O ZINC001590462467 1076631401 /nfs/dbraw/zinc/63/14/01/1076631401.db2.gz CQKUVAIOZJBCSB-UONOGXRCSA-N 1 2 317.393 2.038 20 10 DECDLO Cn1cc[nH+]c1CCNC(=O)c1cc2cc(O)c(O)cc2s1 ZINC001595387596 1077061161 /nfs/dbraw/zinc/06/11/61/1077061161.db2.gz JTWCKXNWSDCIGG-UHFFFAOYSA-N 1 2 317.370 2.019 20 10 DECDLO Oc1c(F)cc(Cl)cc1C[NH2+]C[C@@H](O)COCC1CC1 ZINC001655491582 1080001335 /nfs/dbraw/zinc/00/13/35/1080001335.db2.gz DCIUIENNUVQMAL-GFCCVEGCSA-N 1 2 303.761 2.062 20 10 DECDLO CCCNC(=O)C[N@@H+](CCC)Cc1cc(F)c(F)cc1O ZINC001659069556 1080229393 /nfs/dbraw/zinc/22/93/93/1080229393.db2.gz AHEQHMWZTXSFJM-UHFFFAOYSA-N 1 2 300.349 2.409 20 10 DECDLO Cc1c2ccccc2n(C)c1C[NH2+][C@H](C(N)=O)c1ccccn1 ZINC001662512381 1080613876 /nfs/dbraw/zinc/61/38/76/1080613876.db2.gz RYBZHFLKKNAKCD-KRWDZBQOSA-N 1 2 308.385 2.198 20 10 DECDLO CCc1ccc(C[NH+]2CCN(C(=O)C(F)(F)F)CC2)c(O)c1 ZINC001236782543 1138426176 /nfs/dbraw/zinc/42/61/76/1138426176.db2.gz CBOKSYGGSZYOBN-UHFFFAOYSA-N 1 2 316.323 2.161 20 10 DECDLO CN(C)C(=O)[C@H]1CCC[N@H+](Cc2cc(F)cc(Cl)c2O)C1 ZINC001237811550 1138800041 /nfs/dbraw/zinc/80/00/41/1138800041.db2.gz ANVVSILVEIFQOW-JTQLQIEISA-N 1 2 314.788 2.485 20 10 DECDLO CN(C)C(=O)[C@H]1CCC[N@@H+](Cc2cc(F)cc(Cl)c2O)C1 ZINC001237811550 1138800043 /nfs/dbraw/zinc/80/00/43/1138800043.db2.gz ANVVSILVEIFQOW-JTQLQIEISA-N 1 2 314.788 2.485 20 10 DECDLO COc1ccc(N2CCC[N@H+](Cc3cc(C)[nH]n3)CC2)cc1 ZINC001319705623 1140675577 /nfs/dbraw/zinc/67/55/77/1140675577.db2.gz MLZRVCTZNCANKB-UHFFFAOYSA-N 1 2 300.406 2.439 20 10 DECDLO COc1ccc(N2CCC[N@@H+](Cc3cc(C)[nH]n3)CC2)cc1 ZINC001319705623 1140675595 /nfs/dbraw/zinc/67/55/95/1140675595.db2.gz MLZRVCTZNCANKB-UHFFFAOYSA-N 1 2 300.406 2.439 20 10 DECDLO CC[C@H](C(=O)N(C)c1ccc(N)cc1)[N@@H+]1CCO[C@@H](CC)C1 ZINC001340725909 1143415399 /nfs/dbraw/zinc/41/53/99/1143415399.db2.gz IIPNQDKSVXGVFS-JKSUJKDBSA-N 1 2 305.422 2.121 20 10 DECDLO CC[C@H](C(=O)N(C)c1ccc(N)cc1)[N@H+]1CCO[C@@H](CC)C1 ZINC001340725909 1143415415 /nfs/dbraw/zinc/41/54/15/1143415415.db2.gz IIPNQDKSVXGVFS-JKSUJKDBSA-N 1 2 305.422 2.121 20 10 DECDLO C[C@@H]1[C@@H](CO)CC[N@@H+]1Cc1cc(Br)cc(F)c1O ZINC001308724554 1147484222 /nfs/dbraw/zinc/48/42/22/1147484222.db2.gz SYCRNSGKNOPDKV-RKDXNWHRSA-N 1 2 318.186 2.497 20 10 DECDLO C[C@@H]1[C@@H](CO)CC[N@H+]1Cc1cc(Br)cc(F)c1O ZINC001308724554 1147484227 /nfs/dbraw/zinc/48/42/27/1147484227.db2.gz SYCRNSGKNOPDKV-RKDXNWHRSA-N 1 2 318.186 2.497 20 10 DECDLO CN(C)c1ccc(C[N@H+](Cc2ncnn2CCF)C2CC2)cc1 ZINC000281400764 282288959 /nfs/dbraw/zinc/28/89/59/282288959.db2.gz FKVOGZWELTUYPT-UHFFFAOYSA-N 1 2 317.412 2.478 20 10 DECDLO CN(C)c1ccc(C[N@@H+](Cc2ncnn2CCF)C2CC2)cc1 ZINC000281400764 282288960 /nfs/dbraw/zinc/28/89/60/282288960.db2.gz FKVOGZWELTUYPT-UHFFFAOYSA-N 1 2 317.412 2.478 20 10 DECDLO CCCCNC(=O)[C@H](C)[NH+]1CCN(c2ccc(OC)cc2)CC1 ZINC000042290056 354192354 /nfs/dbraw/zinc/19/23/54/354192354.db2.gz QYIABQDEPMSUIX-HNNXBMFYSA-N 1 2 319.449 2.122 20 10 DECDLO C[C@@H]([NH2+][C@H]1CCCN(CCCO)C1)c1ccc(F)c(F)c1O ZINC000297383291 533541598 /nfs/dbraw/zinc/54/15/98/533541598.db2.gz RFOBOAHNYPPJLL-NEPJUHHUSA-N 1 2 314.376 2.168 20 10 DECDLO O=C(c1ccco1)N1CC[NH+](Cc2cccc(F)c2O)CC1 ZINC000272287727 130015630 /nfs/dbraw/zinc/01/56/30/130015630.db2.gz NPZSZTXZVQNLBR-UHFFFAOYSA-N 1 2 304.321 2.082 20 10 DECDLO Cc1ccc(C(=O)N2CCC(n3cc[nH+]c3)CC2)c(O)c1O ZINC000272731588 130058703 /nfs/dbraw/zinc/05/87/03/130058703.db2.gz HBKZJIKDBTZNGX-UHFFFAOYSA-N 1 2 301.346 2.080 20 10 DECDLO CN(C)c1ccc(C[N@H+](Cc2nnnn2C2CC2)C2CC2)cc1 ZINC000298720606 132075121 /nfs/dbraw/zinc/07/51/21/132075121.db2.gz OMVATHRXXRRPBM-UHFFFAOYSA-N 1 2 312.421 2.239 20 10 DECDLO CN(C)c1ccc(C[N@@H+](Cc2nnnn2C2CC2)C2CC2)cc1 ZINC000298720606 132075122 /nfs/dbraw/zinc/07/51/22/132075122.db2.gz OMVATHRXXRRPBM-UHFFFAOYSA-N 1 2 312.421 2.239 20 10 DECDLO CN(C)c1ccc(C[N@H+](C)Cc2ncnn2CC(F)F)cc1 ZINC000278536327 402867909 /nfs/dbraw/zinc/86/79/09/402867909.db2.gz RJNWTOAQQGPGGD-UHFFFAOYSA-N 1 2 309.364 2.241 20 10 DECDLO CN(C)c1ccc(C[N@@H+](C)Cc2ncnn2CC(F)F)cc1 ZINC000278536327 402867911 /nfs/dbraw/zinc/86/79/11/402867911.db2.gz RJNWTOAQQGPGGD-UHFFFAOYSA-N 1 2 309.364 2.241 20 10 DECDLO Oc1c(F)cccc1C[NH+]1CCN(c2ncccc2F)CC1 ZINC000272341028 402925837 /nfs/dbraw/zinc/92/58/37/402925837.db2.gz YSXUHTJHFPFEJA-UHFFFAOYSA-N 1 2 305.328 2.388 20 10 DECDLO COc1cc(Cl)cc(C[N@@H+]2CCC[C@@](F)(CO)C2)c1O ZINC000289821951 404000644 /nfs/dbraw/zinc/00/06/44/404000644.db2.gz OFKUIAQHDIDCRU-AWEZNQCLSA-N 1 2 303.761 2.351 20 10 DECDLO COc1cc(Cl)cc(C[N@H+]2CCC[C@@](F)(CO)C2)c1O ZINC000289821951 404000647 /nfs/dbraw/zinc/00/06/47/404000647.db2.gz OFKUIAQHDIDCRU-AWEZNQCLSA-N 1 2 303.761 2.351 20 10 DECDLO CC[C@@H]([NH2+][C@@H]1COC[C@H]1O)c1cc(Cl)cc(Cl)c1O ZINC000296029891 286926620 /nfs/dbraw/zinc/92/66/20/286926620.db2.gz STLIEVHVQPACQH-IJLUTSLNSA-N 1 2 306.189 2.499 20 10 DECDLO C[C@@H]([NH2+]CCN1C[C@H]2CC[C@@H](C1)O2)c1cc(F)cc(F)c1O ZINC000834891579 649858109 /nfs/dbraw/zinc/85/81/09/649858109.db2.gz OTDLJHANKWHOST-RTXFEEFZSA-N 1 2 312.360 2.184 20 10 DECDLO CC(=O)c1cc(Cl)cc(C[N@@H+](C)C2(C(N)=O)CCCC2)c1O ZINC000093211556 277105636 /nfs/dbraw/zinc/10/56/36/277105636.db2.gz RYZNNKVZBUEGOM-UHFFFAOYSA-N 1 2 324.808 2.478 20 10 DECDLO CC(=O)c1cc(Cl)cc(C[N@H+](C)C2(C(N)=O)CCCC2)c1O ZINC000093211556 277105639 /nfs/dbraw/zinc/10/56/39/277105639.db2.gz RYZNNKVZBUEGOM-UHFFFAOYSA-N 1 2 324.808 2.478 20 10 DECDLO CC[N@H+](C/C=C\c1ccc(N(C)C)cc1)[C@@H]1CCS(=O)(=O)C1 ZINC000835025018 649868013 /nfs/dbraw/zinc/86/80/13/649868013.db2.gz FQQRPAKGKJOROP-KEGWNNHHSA-N 1 2 322.474 2.275 20 10 DECDLO CC[N@@H+](C/C=C\c1ccc(N(C)C)cc1)[C@@H]1CCS(=O)(=O)C1 ZINC000835025018 649868015 /nfs/dbraw/zinc/86/80/15/649868015.db2.gz FQQRPAKGKJOROP-KEGWNNHHSA-N 1 2 322.474 2.275 20 10 DECDLO CCN1CCC[N@H+](Cc2cc(Cl)cc(OC)c2O)CC1=O ZINC000191540546 521613071 /nfs/dbraw/zinc/61/30/71/521613071.db2.gz CSCQSKQNNBPBJF-UHFFFAOYSA-N 1 2 312.797 2.108 20 10 DECDLO CCN1CCC[N@@H+](Cc2cc(Cl)cc(OC)c2O)CC1=O ZINC000191540546 521613074 /nfs/dbraw/zinc/61/30/74/521613074.db2.gz CSCQSKQNNBPBJF-UHFFFAOYSA-N 1 2 312.797 2.108 20 10 DECDLO COc1ccc(O)c(C[NH+]2CC(O)(c3ccc(F)cc3)C2)c1 ZINC000365661893 524737969 /nfs/dbraw/zinc/73/79/69/524737969.db2.gz LVVSKVCXGJFYPT-UHFFFAOYSA-N 1 2 303.333 2.243 20 10 DECDLO Oc1c(Cl)cccc1C[N@@H+]1CC[C@@H](CN2CCOCC2)C1 ZINC000180453860 526327240 /nfs/dbraw/zinc/32/72/40/526327240.db2.gz RRXCLIWRCPURKS-ZDUSSCGKSA-N 1 2 310.825 2.200 20 10 DECDLO Oc1c(Cl)cccc1C[N@H+]1CC[C@@H](CN2CCOCC2)C1 ZINC000180453860 526327242 /nfs/dbraw/zinc/32/72/42/526327242.db2.gz RRXCLIWRCPURKS-ZDUSSCGKSA-N 1 2 310.825 2.200 20 10 DECDLO CCN(C(=O)C=Cc1c[nH]c[nH+]1)c1ccc(OC)c(OC)c1 ZINC000283613705 535652385 /nfs/dbraw/zinc/65/23/85/535652385.db2.gz ZOQMLSCTWUIOFY-VMPITWQZSA-N 1 2 301.346 2.493 20 10 DECDLO CN(C)c1ccc(CNC(=O)NCc2ccn3cc[nH+]c3c2)cc1 ZINC000177785118 625090092 /nfs/dbraw/zinc/09/00/92/625090092.db2.gz VDOLICMEMDYTOC-UHFFFAOYSA-N 1 2 323.400 2.400 20 10 DECDLO CC1(C)C[N@H+](Cc2cc(Br)cc(F)c2O)C[C@H]1O ZINC000894595655 637126470 /nfs/dbraw/zinc/12/64/70/637126470.db2.gz JFIXBZZWGKWDQL-LLVKDONJSA-N 1 2 318.186 2.497 20 10 DECDLO CC1(C)C[N@@H+](Cc2cc(Br)cc(F)c2O)C[C@H]1O ZINC000894595655 637126472 /nfs/dbraw/zinc/12/64/72/637126472.db2.gz JFIXBZZWGKWDQL-LLVKDONJSA-N 1 2 318.186 2.497 20 10 DECDLO C[C@H]1OCC[C@@]12C[N@H+](Cc1cc(F)cc(F)c1O)C[C@@H](C)O2 ZINC000894598108 637126965 /nfs/dbraw/zinc/12/69/65/637126965.db2.gz USTKVLLOULIGFW-GLKRBJQHSA-N 1 2 313.344 2.439 20 10 DECDLO CS(=O)(=O)[C@@H]1CCC[N@H+](Cc2cc(F)cc(F)c2O)CC1 ZINC000894666022 637153718 /nfs/dbraw/zinc/15/37/18/637153718.db2.gz GTADTEPNGYPMCC-GFCCVEGCSA-N 1 2 319.373 2.070 20 10 DECDLO CS(=O)(=O)[C@@H]1CCC[N@@H+](Cc2cc(F)cc(F)c2O)CC1 ZINC000894666022 637153721 /nfs/dbraw/zinc/15/37/21/637153721.db2.gz GTADTEPNGYPMCC-GFCCVEGCSA-N 1 2 319.373 2.070 20 10 DECDLO COC[C@@H]1CC[N@@H+]1Cc1c2cc(F)ccc2n(C)c1C(=O)OC ZINC000894857686 637262691 /nfs/dbraw/zinc/26/26/91/637262691.db2.gz PBPFOXZOZFJEGH-LBPRGKRZSA-N 1 2 320.364 2.325 20 10 DECDLO COC[C@@H]1CC[N@H+]1Cc1c2cc(F)ccc2n(C)c1C(=O)OC ZINC000894857686 637262692 /nfs/dbraw/zinc/26/26/92/637262692.db2.gz PBPFOXZOZFJEGH-LBPRGKRZSA-N 1 2 320.364 2.325 20 10 DECDLO COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@H](C)c2csnn2)c1 ZINC000840885250 650371049 /nfs/dbraw/zinc/37/10/49/650371049.db2.gz AIDOKDUKETVEHO-DTWKUNHWSA-N 1 2 307.375 2.442 20 10 DECDLO Cc1cc(O)c(C[N@@H+]2CCN3C(=O)OCC[C@H]3C2)c(Cl)c1 ZINC000840920488 650382050 /nfs/dbraw/zinc/38/20/50/650382050.db2.gz KLEXQHJGCOIJSU-NSHDSACASA-N 1 2 310.781 2.381 20 10 DECDLO Cc1cc(O)c(C[N@H+]2CCN3C(=O)OCC[C@H]3C2)c(Cl)c1 ZINC000840920488 650382052 /nfs/dbraw/zinc/38/20/52/650382052.db2.gz KLEXQHJGCOIJSU-NSHDSACASA-N 1 2 310.781 2.381 20 10 DECDLO COc1ccc(C[N@@H+]2CCO[C@](C)(C(F)F)C2)c(O)c1OC ZINC000895484670 638053955 /nfs/dbraw/zinc/05/39/55/638053955.db2.gz SVLSHMLWIMYYOQ-HNNXBMFYSA-N 1 2 317.332 2.265 20 10 DECDLO COc1ccc(C[N@H+]2CCO[C@](C)(C(F)F)C2)c(O)c1OC ZINC000895484670 638053960 /nfs/dbraw/zinc/05/39/60/638053960.db2.gz SVLSHMLWIMYYOQ-HNNXBMFYSA-N 1 2 317.332 2.265 20 10 DECDLO COc1cccc(O)c1C[NH+]1CCN(C(=O)C(C)(C)C)CC1 ZINC000768248964 641062296 /nfs/dbraw/zinc/06/22/96/641062296.db2.gz MDIXVBLLOKSUDL-UHFFFAOYSA-N 1 2 306.406 2.091 20 10 DECDLO CCN(CC)c1ccc(C[N@@H+]2CCN3C(=O)CC[C@@H]3C2)cc1F ZINC000769205844 641194841 /nfs/dbraw/zinc/19/48/41/641194841.db2.gz IZKVBAIBJLTGEA-OAHLLOKOSA-N 1 2 319.424 2.479 20 10 DECDLO CCN(CC)c1ccc(C[N@H+]2CCN3C(=O)CC[C@@H]3C2)cc1F ZINC000769205844 641194846 /nfs/dbraw/zinc/19/48/46/641194846.db2.gz IZKVBAIBJLTGEA-OAHLLOKOSA-N 1 2 319.424 2.479 20 10 DECDLO COC1(CO)CC[NH+](Cc2c(O)ccc(Cl)c2F)CC1 ZINC000775204897 642016239 /nfs/dbraw/zinc/01/62/39/642016239.db2.gz SYLUKRKTUJEJAL-UHFFFAOYSA-N 1 2 303.761 2.158 20 10 DECDLO CCc1noc(C[NH2+][C@@H](C)c2ccc(N3CCOCC3)cc2)n1 ZINC000775258265 642022065 /nfs/dbraw/zinc/02/20/65/642022065.db2.gz VQNWXKZCGJTGFZ-ZDUSSCGKSA-N 1 2 316.405 2.319 20 10 DECDLO C[C@H]1CC[C@@H](C(N)=O)C[N@@H+]1Cc1cc(Cl)cc(F)c1O ZINC000775648841 642071463 /nfs/dbraw/zinc/07/14/63/642071463.db2.gz GNLGQARIJKLXKB-DTWKUNHWSA-N 1 2 300.761 2.271 20 10 DECDLO C[C@H]1CC[C@@H](C(N)=O)C[N@H+]1Cc1cc(Cl)cc(F)c1O ZINC000775648841 642071465 /nfs/dbraw/zinc/07/14/65/642071465.db2.gz GNLGQARIJKLXKB-DTWKUNHWSA-N 1 2 300.761 2.271 20 10 DECDLO Cc1cc(Cl)cc(C[NH+]2CCN(C(=O)N(C)C)CC2)c1O ZINC000775652015 642072930 /nfs/dbraw/zinc/07/29/30/642072930.db2.gz DUCKMLBIQXNEGO-UHFFFAOYSA-N 1 2 311.813 2.153 20 10 DECDLO OCCO[C@@H]1CCC[N@H+](Cc2cc(Cl)cc(F)c2O)C1 ZINC000775689104 642080474 /nfs/dbraw/zinc/08/04/74/642080474.db2.gz ZWFBCOHXFPGDAF-GFCCVEGCSA-N 1 2 303.761 2.158 20 10 DECDLO OCCO[C@@H]1CCC[N@@H+](Cc2cc(Cl)cc(F)c2O)C1 ZINC000775689104 642080479 /nfs/dbraw/zinc/08/04/79/642080479.db2.gz ZWFBCOHXFPGDAF-GFCCVEGCSA-N 1 2 303.761 2.158 20 10 DECDLO CC(=O)N1CC[C@@H](C[N@@H+](C)Cc2cc(Cl)cc(F)c2O)C1 ZINC000775743408 642087516 /nfs/dbraw/zinc/08/75/16/642087516.db2.gz GJYBKWAMDSSNOA-NSHDSACASA-N 1 2 314.788 2.485 20 10 DECDLO CC(=O)N1CC[C@@H](C[N@H+](C)Cc2cc(Cl)cc(F)c2O)C1 ZINC000775743408 642087521 /nfs/dbraw/zinc/08/75/21/642087521.db2.gz GJYBKWAMDSSNOA-NSHDSACASA-N 1 2 314.788 2.485 20 10 DECDLO CCC[C@@]1(C)C(=O)NCC[N@H+]1Cc1ccc(N(C)C)c(F)c1 ZINC000783740369 643045851 /nfs/dbraw/zinc/04/58/51/643045851.db2.gz ICAZJQOGBWUIRQ-KRWDZBQOSA-N 1 2 307.413 2.382 20 10 DECDLO CCC[C@@]1(C)C(=O)NCC[N@@H+]1Cc1ccc(N(C)C)c(F)c1 ZINC000783740369 643045852 /nfs/dbraw/zinc/04/58/52/643045852.db2.gz ICAZJQOGBWUIRQ-KRWDZBQOSA-N 1 2 307.413 2.382 20 10 DECDLO Cc1cnc(C[NH2+]Cc2ccc(N3CCOCC3)c(F)c2)o1 ZINC000789559011 643750008 /nfs/dbraw/zinc/75/00/08/643750008.db2.gz IMCJMXDGSVOWPO-UHFFFAOYSA-N 1 2 305.353 2.249 20 10 DECDLO O=C(NCCCSc1nccs1)[C@H]1CCn2cc[nH+]c2C1 ZINC000156407389 646418556 /nfs/dbraw/zinc/41/85/56/646418556.db2.gz RSFTXOYEKGTNSC-NSHDSACASA-N 1 2 322.459 2.201 20 10 DECDLO O=C(NCc1ccc(N2CCCC2)cc1)[C@H]1CCc2c[nH+]cn2C1 ZINC000816866888 647191956 /nfs/dbraw/zinc/19/19/56/647191956.db2.gz ZUJREOKLEXKBMV-INIZCTEOSA-N 1 2 324.428 2.362 20 10 DECDLO COc1cc(C[N@@H+]2CCNC(=O)C2(C)C)c(O)c(C(C)(C)C)c1 ZINC000824710215 648640347 /nfs/dbraw/zinc/64/03/47/648640347.db2.gz UVSTWRPMABCKHN-UHFFFAOYSA-N 1 2 320.433 2.409 20 10 DECDLO COc1cc(C[N@H+]2CCNC(=O)C2(C)C)c(O)c(C(C)(C)C)c1 ZINC000824710215 648640350 /nfs/dbraw/zinc/64/03/50/648640350.db2.gz UVSTWRPMABCKHN-UHFFFAOYSA-N 1 2 320.433 2.409 20 10 DECDLO Oc1cccc(Cl)c1C[NH2+]Cc1nnnn1-c1ccccc1 ZINC000733325987 649543462 /nfs/dbraw/zinc/54/34/62/649543462.db2.gz BXBOFFDSMQNONB-UHFFFAOYSA-N 1 2 315.764 2.311 20 10 DECDLO CCOc1ccc(C[NH2+]Cc2nc([C@@H]3CCCO3)n[nH]2)c(O)c1 ZINC000848562992 651471503 /nfs/dbraw/zinc/47/15/03/651471503.db2.gz OUIKYXHYOOLKPW-AWEZNQCLSA-N 1 2 318.377 2.050 20 10 DECDLO Oc1cccc(Cl)c1C[NH2+]Cc1nnc(C2CCOCC2)[nH]1 ZINC000865686903 687301698 /nfs/dbraw/zinc/30/16/98/687301698.db2.gz JJRIMJZGJILOHC-UHFFFAOYSA-N 1 2 322.796 2.348 20 10 DECDLO CC[C@H](C(=O)N1Cc2cccc(O)c2C1)[N@@H+]1CCO[C@H](CC)C1 ZINC000871205507 688749355 /nfs/dbraw/zinc/74/93/55/688749355.db2.gz USADANOAZUGIQH-GDBMZVCRSA-N 1 2 318.417 2.124 20 10 DECDLO CC[C@H](C(=O)N1Cc2cccc(O)c2C1)[N@H+]1CCO[C@H](CC)C1 ZINC000871205507 688749358 /nfs/dbraw/zinc/74/93/58/688749358.db2.gz USADANOAZUGIQH-GDBMZVCRSA-N 1 2 318.417 2.124 20 10 DECDLO O=C(NCC[NH+]1Cc2ccccc2C1)N1Cc2cccc(O)c2C1 ZINC000875174106 689583979 /nfs/dbraw/zinc/58/39/79/689583979.db2.gz KLROBFDPRAYOOV-UHFFFAOYSA-N 1 2 323.396 2.433 20 10 DECDLO Oc1c(C[N@@H+]2CCCN(CC(F)F)CC2)ccc(F)c1F ZINC000877529038 690142637 /nfs/dbraw/zinc/14/26/37/690142637.db2.gz RBOCALKOIFIFTC-UHFFFAOYSA-N 1 2 306.303 2.443 20 10 DECDLO Oc1c(C[N@H+]2CCCN(CC(F)F)CC2)ccc(F)c1F ZINC000877529038 690142640 /nfs/dbraw/zinc/14/26/40/690142640.db2.gz RBOCALKOIFIFTC-UHFFFAOYSA-N 1 2 306.303 2.443 20 10 DECDLO OC[C@@H](CCF)[NH2+]Cc1cc(Br)cc(F)c1O ZINC000883158991 691443585 /nfs/dbraw/zinc/44/35/85/691443585.db2.gz XDILHSOYTWVSPX-SECBINFHSA-N 1 2 310.138 2.104 20 10 DECDLO CC(C)[C@H](C[NH2+][C@@H](C)c1c([O-])cccc1F)N1CC[NH+](C)CC1 ZINC000886500214 692094593 /nfs/dbraw/zinc/09/45/93/692094593.db2.gz LHMVSWZOSYMLMN-HOCLYGCPSA-N 1 2 323.456 2.454 20 10 DECDLO Oc1c(F)cc(Br)cc1C[NH2+]CCn1cccn1 ZINC000715799129 792502500 /nfs/dbraw/zinc/50/25/00/792502500.db2.gz XXVJEDWTASZIDI-UHFFFAOYSA-N 1 2 314.158 2.280 20 10 DECDLO CN1CCC[C@@H]1C[NH2+]Cc1cc(Br)cc(F)c1O ZINC000715817577 792524986 /nfs/dbraw/zinc/52/49/86/792524986.db2.gz IKCKAURIOLNNDY-LLVKDONJSA-N 1 2 317.202 2.478 20 10 DECDLO CN(C)c1ccc(/C=C/C(=O)NCCOc2cc[nH+]cc2)cc1 ZINC001180130364 795239079 /nfs/dbraw/zinc/23/90/79/795239079.db2.gz KUUJYVFGGSFOQE-VMPITWQZSA-N 1 2 311.385 2.356 20 10 DECDLO CCOC[C@H]1Cn2nccc2C[N@H+](Cc2cccc(F)c2O)C1 ZINC001138127175 796167546 /nfs/dbraw/zinc/16/75/46/796167546.db2.gz RGNFYVZQSCTSFS-CYBMUJFWSA-N 1 2 319.380 2.396 20 10 DECDLO CCOC[C@H]1Cn2nccc2C[N@@H+](Cc2cccc(F)c2O)C1 ZINC001138127175 796167549 /nfs/dbraw/zinc/16/75/49/796167549.db2.gz RGNFYVZQSCTSFS-CYBMUJFWSA-N 1 2 319.380 2.396 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CCCC(=O)CC1 ZINC001139125361 796326013 /nfs/dbraw/zinc/32/60/13/796326013.db2.gz SPJRWIWDYKZBLU-UHFFFAOYSA-N 1 2 301.342 2.362 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CCCC(=O)CC1 ZINC001139125361 796326018 /nfs/dbraw/zinc/32/60/18/796326018.db2.gz SPJRWIWDYKZBLU-UHFFFAOYSA-N 1 2 301.342 2.362 20 10 DECDLO O=C(c1ccc(O)c(O)c1Cl)N1CCC(n2cc[nH+]c2)CC1 ZINC001193232665 797526573 /nfs/dbraw/zinc/52/65/73/797526573.db2.gz MVGFVQULYXWCCE-UHFFFAOYSA-N 1 2 321.764 2.425 20 10 DECDLO O=C1C[N@H+](Cc2ccccc2O)CCN1c1ccc(F)cc1 ZINC001203558471 800080662 /nfs/dbraw/zinc/08/06/62/800080662.db2.gz INITYSFOUSFAHZ-UHFFFAOYSA-N 1 2 300.333 2.380 20 10 DECDLO O=C1C[N@@H+](Cc2ccccc2O)CCN1c1ccc(F)cc1 ZINC001203558471 800080670 /nfs/dbraw/zinc/08/06/70/800080670.db2.gz INITYSFOUSFAHZ-UHFFFAOYSA-N 1 2 300.333 2.380 20 10 DECDLO Oc1ccc(CN2CC[C@@H]([NH+]3CCCC3)C(F)(F)C2)cc1O ZINC001203884602 800141183 /nfs/dbraw/zinc/14/11/83/800141183.db2.gz VLCRTPHGJYFURO-OAHLLOKOSA-N 1 2 312.360 2.403 20 10 DECDLO COC(=O)c1c(C[N@H+](C)C2(C)COC2)c2ccccc2n1C ZINC001232405150 801872854 /nfs/dbraw/zinc/87/28/54/801872854.db2.gz GWHMYPZGUKFZSX-UHFFFAOYSA-N 1 2 302.374 2.186 20 10 DECDLO COC(=O)c1c(C[N@@H+](C)C2(C)COC2)c2ccccc2n1C ZINC001232405150 801872861 /nfs/dbraw/zinc/87/28/61/801872861.db2.gz GWHMYPZGUKFZSX-UHFFFAOYSA-N 1 2 302.374 2.186 20 10 DECDLO COC(=O)[C@]1(F)CC[N@H+](Cc2cccc(C(F)(F)F)c2O)C1 ZINC001233416087 802111425 /nfs/dbraw/zinc/11/14/25/802111425.db2.gz WARVGLPFFGTSRC-ZDUSSCGKSA-N 1 2 321.270 2.498 20 10 DECDLO COC(=O)[C@]1(F)CC[N@@H+](Cc2cccc(C(F)(F)F)c2O)C1 ZINC001233416087 802111429 /nfs/dbraw/zinc/11/14/29/802111429.db2.gz WARVGLPFFGTSRC-ZDUSSCGKSA-N 1 2 321.270 2.498 20 10 DECDLO NC(=O)[C@@H]1CCCC[N@H+]1Cc1cccc(C(F)(F)F)c1O ZINC001233418004 802111940 /nfs/dbraw/zinc/11/19/40/802111940.db2.gz PTKVZCXASWXYGT-NSHDSACASA-N 1 2 302.296 2.251 20 10 DECDLO CC(C)(C)OC(=O)[C@@H]1CCCC[N@@H+]1Cc1cc(O)c(O)cc1O ZINC001233485959 802126990 /nfs/dbraw/zinc/12/69/90/802126990.db2.gz RTIOUCWVRAEKNQ-LBPRGKRZSA-N 1 2 323.389 2.500 20 10 DECDLO CC(C)(C)OC(=O)[C@@H]1CCCC[N@H+]1Cc1cc(O)c(O)cc1O ZINC001233485959 802126995 /nfs/dbraw/zinc/12/69/95/802126995.db2.gz RTIOUCWVRAEKNQ-LBPRGKRZSA-N 1 2 323.389 2.500 20 10 DECDLO O=C1C[C@H]([NH2+]Cc2cc(Cl)cc(F)c2O)CN1CC1CC1 ZINC001331581619 1149543065 /nfs/dbraw/zinc/54/30/65/1149543065.db2.gz STLKEZUQGGJRKW-LBPRGKRZSA-N 1 2 312.772 2.285 20 10 DECDLO CC(C)CC[C@@H](CO)[NH2+][C@H](C)c1cccc(-c2nn[nH]n2)c1O ZINC001603278651 1069930750 /nfs/dbraw/zinc/93/07/50/1069930750.db2.gz RZEGMLNYZKUPGD-NEPJUHHUSA-N 1 2 319.409 2.020 20 10 DECDLO C[C@H]([NH2+]C[C@@]1(C)CC1(F)F)c1cccc(-c2nn[nH]n2)c1O ZINC001603656697 1070022488 /nfs/dbraw/zinc/02/24/88/1070022488.db2.gz IAORIHZVNXKSNG-ISVAXAHUSA-N 1 2 309.320 2.268 20 10 DECDLO CO[C@@H]1C[C@H]([NH2+][C@@H](C)c2cccc(-c3nn[nH]n3)c2O)C1(C)C ZINC001605025398 1070580395 /nfs/dbraw/zinc/58/03/95/1070580395.db2.gz UXADRESSZBXFKE-TVYUQYBPSA-N 1 2 317.393 2.036 20 10 DECDLO C[C@@H]1C[N@H+](Cc2cc(F)c(F)cc2O)C[C@]2(CCCOC2)O1 ZINC001462156936 1058770231 /nfs/dbraw/zinc/77/02/31/1058770231.db2.gz VKMSSGYQOZRPRV-BZNIZROVSA-N 1 2 313.344 2.440 20 10 DECDLO C[C@@H]1C[N@@H+](Cc2cc(F)c(F)cc2O)C[C@]2(CCCOC2)O1 ZINC001462156936 1058770248 /nfs/dbraw/zinc/77/02/48/1058770248.db2.gz VKMSSGYQOZRPRV-BZNIZROVSA-N 1 2 313.344 2.440 20 10 DECDLO C[C@H]1C[N@H+](Cc2cc(F)c(F)cc2O)C[C@]2(CCCOC2)O1 ZINC001462156941 1058771052 /nfs/dbraw/zinc/77/10/52/1058771052.db2.gz VKMSSGYQOZRPRV-ZBEGNZNMSA-N 1 2 313.344 2.440 20 10 DECDLO C[C@H]1C[N@@H+](Cc2cc(F)c(F)cc2O)C[C@]2(CCCOC2)O1 ZINC001462156941 1058771067 /nfs/dbraw/zinc/77/10/67/1058771067.db2.gz VKMSSGYQOZRPRV-ZBEGNZNMSA-N 1 2 313.344 2.440 20 10 DECDLO CCS(=O)(=O)C[C@@H](C)[N@H+](C)Cc1ccc(Cl)cc1O ZINC001621182418 1078170585 /nfs/dbraw/zinc/17/05/85/1078170585.db2.gz DEASOUASCIRUTR-SNVBAGLBSA-N 1 2 305.827 2.301 20 10 DECDLO CCS(=O)(=O)C[C@@H](C)[N@@H+](C)Cc1ccc(Cl)cc1O ZINC001621182418 1078170587 /nfs/dbraw/zinc/17/05/87/1078170587.db2.gz DEASOUASCIRUTR-SNVBAGLBSA-N 1 2 305.827 2.301 20 10 DECDLO NC(=O)C[N@H+](Cc1ccccc1)Cc1cc(F)cc(F)c1O ZINC001560629658 1075143966 /nfs/dbraw/zinc/14/39/66/1075143966.db2.gz ZBECQOLEGURMAS-UHFFFAOYSA-N 1 2 306.312 2.158 20 10 DECDLO NC(=O)C[N@@H+](Cc1ccccc1)Cc1cc(F)cc(F)c1O ZINC001560629658 1075143968 /nfs/dbraw/zinc/14/39/68/1075143968.db2.gz ZBECQOLEGURMAS-UHFFFAOYSA-N 1 2 306.312 2.158 20 10 DECDLO C[C@H](Cc1ccccn1)[NH2+][C@@H](C)c1cccc(-c2nn[nH]n2)c1O ZINC001589901502 1076527579 /nfs/dbraw/zinc/52/75/79/1076527579.db2.gz POUXEPNGJYFVJN-NEPJUHHUSA-N 1 2 324.388 2.249 20 10 DECDLO C[C@H]([NH2+]CCOC1CCCC1)c1cccc(-c2nn[nH]n2)c1O ZINC001589961965 1076537700 /nfs/dbraw/zinc/53/77/00/1076537700.db2.gz DLDKQCWTVVZDQD-NSHDSACASA-N 1 2 317.393 2.182 20 10 DECDLO CC[C@H]([NH2+]C[C@H](O)CC(C)C)c1cccc(-c2nn[nH]n2)c1O ZINC001590462884 1076631811 /nfs/dbraw/zinc/63/18/11/1076631811.db2.gz GGVJAJIDWNWPNV-RISCZKNCSA-N 1 2 319.409 2.020 20 10 DECDLO CC[C@H]([NH2+]CC1(COC)CC1)c1cccc(-c2nn[nH]n2)c1O ZINC001590466557 1076633668 /nfs/dbraw/zinc/63/36/68/1076633668.db2.gz YIWSSNDTIOISOW-ZDUSSCGKSA-N 1 2 317.393 2.040 20 10 DECDLO CC[C@H]([NH2+]CCc1ccco1)c1cccc(-c2nn[nH]n2)c1O ZINC001590471019 1076635027 /nfs/dbraw/zinc/63/50/27/1076635027.db2.gz UOQBXZKPXYVDRS-AWEZNQCLSA-N 1 2 313.361 2.449 20 10 DECDLO CC[C@@H]([NH2+]CCc1ccccn1)c1cccc(-c2nn[nH]n2)c1O ZINC001590471106 1076635795 /nfs/dbraw/zinc/63/57/95/1076635795.db2.gz WHVVKWNQKZJXOB-OAHLLOKOSA-N 1 2 324.388 2.251 20 10 DECDLO CCC[C@@H](C[NH2+][C@@H](C)c1cccc(-c2nn[nH]n2)c1O)OCC ZINC001590556991 1076651955 /nfs/dbraw/zinc/65/19/55/1076651955.db2.gz DMKVSQDRYIFZAN-RYUDHWBXSA-N 1 2 319.409 2.428 20 10 DECDLO CO[C@H]1CCCC[C@@H]1[NH2+][C@@H](C)c1cccc(-c2nn[nH]n2)c1O ZINC001591474398 1076747520 /nfs/dbraw/zinc/74/75/20/1076747520.db2.gz ILBMUEKGBAAFAH-BPNCWPANSA-N 1 2 317.393 2.181 20 10 DECDLO OCCC[N@H+](Cc1ccccn1)Cc1cc(F)c(F)cc1O ZINC001652388246 1079872779 /nfs/dbraw/zinc/87/27/79/1079872779.db2.gz WBKOKYFMYDYUOU-UHFFFAOYSA-N 1 2 308.328 2.450 20 10 DECDLO OCCC[N@@H+](Cc1ccccn1)Cc1cc(F)c(F)cc1O ZINC001652388246 1079872781 /nfs/dbraw/zinc/87/27/81/1079872781.db2.gz WBKOKYFMYDYUOU-UHFFFAOYSA-N 1 2 308.328 2.450 20 10 DECDLO COCC1C[NH+](Cc2cc(F)cc(Br)c2O)C1 ZINC001235298293 1084376114 /nfs/dbraw/zinc/37/61/14/1084376114.db2.gz RCCCFOHNKYZYON-UHFFFAOYSA-N 1 2 304.159 2.372 20 10 DECDLO CC[N@H+](Cc1cc(F)cc(Br)c1O)C1CN(C)C1 ZINC001235304811 1084380848 /nfs/dbraw/zinc/38/08/48/1084380848.db2.gz CDQALWPOGDWPND-UHFFFAOYSA-N 1 2 317.202 2.430 20 10 DECDLO CC[N@@H+](Cc1cc(F)cc(Br)c1O)C1CN(C)C1 ZINC001235304811 1084380855 /nfs/dbraw/zinc/38/08/55/1084380855.db2.gz CDQALWPOGDWPND-UHFFFAOYSA-N 1 2 317.202 2.430 20 10 DECDLO CCOc1ccc(C[N@@H+]2CCN(C3CCCC3)C(=O)C2)c(O)c1 ZINC001237041948 1138485610 /nfs/dbraw/zinc/48/56/10/1138485610.db2.gz QZGQUJQHCZWEJU-UHFFFAOYSA-N 1 2 318.417 2.378 20 10 DECDLO CCOc1ccc(C[N@H+]2CCN(C3CCCC3)C(=O)C2)c(O)c1 ZINC001237041948 1138485616 /nfs/dbraw/zinc/48/56/16/1138485616.db2.gz QZGQUJQHCZWEJU-UHFFFAOYSA-N 1 2 318.417 2.378 20 10 DECDLO Oc1c(F)cc(Cl)cc1C[NH+]1CCC2(C[C@@H](O)CO2)CC1 ZINC001237617472 1138717615 /nfs/dbraw/zinc/71/76/15/1138717615.db2.gz RGMSRGUHFHRJPG-GFCCVEGCSA-N 1 2 315.772 2.301 20 10 DECDLO COc1cccc(CNC(=O)c2ccn3c(C)c[nH+]c3c2)c1O ZINC001294925615 1139306753 /nfs/dbraw/zinc/30/67/53/1139306753.db2.gz QZZXCVOZCSOSOZ-UHFFFAOYSA-N 1 2 311.341 2.287 20 10 DECDLO Oc1c(Cl)cccc1C[N@H+]1C[C@H](O)CC2(CCOCC2)C1 ZINC001262113567 1144291853 /nfs/dbraw/zinc/29/18/53/1144291853.db2.gz SMPLXELOZXAQQZ-CYBMUJFWSA-N 1 2 311.809 2.409 20 10 DECDLO Oc1c(Cl)cccc1C[N@@H+]1C[C@H](O)CC2(CCOCC2)C1 ZINC001262113567 1144291859 /nfs/dbraw/zinc/29/18/59/1144291859.db2.gz SMPLXELOZXAQQZ-CYBMUJFWSA-N 1 2 311.809 2.409 20 10 DECDLO Oc1c(F)cc(Br)cc1C[N@H+]1C[C@@H](O)C2(CC2)C1 ZINC001353595653 1151841036 /nfs/dbraw/zinc/84/10/36/1151841036.db2.gz YDTKEIDXSPQSPK-LLVKDONJSA-N 1 2 316.170 2.251 20 10 DECDLO Oc1c(F)cc(Br)cc1C[N@@H+]1C[C@@H](O)C2(CC2)C1 ZINC001353595653 1151841037 /nfs/dbraw/zinc/84/10/37/1151841037.db2.gz YDTKEIDXSPQSPK-LLVKDONJSA-N 1 2 316.170 2.251 20 10 DECDLO CC(C)[C@@H](C(=O)Nc1ccc(N)cc1)[NH+]1C[C@@H](C)O[C@H](C)C1 ZINC000062461187 184238175 /nfs/dbraw/zinc/23/81/75/184238175.db2.gz VVTAOQQDEBYPQH-IOASZLSFSA-N 1 2 305.422 2.341 20 10 DECDLO O=[N+]([O-])c1ccc(O)c(C[NH2+]C[C@@H](O)CCc2ccccc2)c1 ZINC000273075389 130088545 /nfs/dbraw/zinc/08/85/45/130088545.db2.gz HWWAHACDRANMAW-INIZCTEOSA-N 1 2 316.357 2.384 20 10 DECDLO COc1cc(Cl)cc(C[N@@H+]2CC[S@](=O)[C@@H](C)[C@H]2C)c1O ZINC000273706811 130156275 /nfs/dbraw/zinc/15/62/75/130156275.db2.gz FKTHWRQBMIANPT-ARNPGYACSA-N 1 2 317.838 2.396 20 10 DECDLO COc1cc(Cl)cc(C[N@H+]2CC[S@](=O)[C@@H](C)[C@H]2C)c1O ZINC000273706811 130156279 /nfs/dbraw/zinc/15/62/79/130156279.db2.gz FKTHWRQBMIANPT-ARNPGYACSA-N 1 2 317.838 2.396 20 10 DECDLO COc1cc(Cl)cc(C[NH+]2CCN(CC(F)F)CC2)c1O ZINC000273722896 130159270 /nfs/dbraw/zinc/15/92/70/130159270.db2.gz IPMWLWJATWLUNP-UHFFFAOYSA-N 1 2 320.767 2.437 20 10 DECDLO C[NH+](C)C[C@H]1CN(Cc2cc(Cl)cc(Cl)c2O)CCO1 ZINC000128152740 289218213 /nfs/dbraw/zinc/21/82/13/289218213.db2.gz ZHPYVJFWCCFOJN-LBPRGKRZSA-N 1 2 319.232 2.461 20 10 DECDLO O=C(C1CC1)N1CCC[N@@H+](Cc2cccc(Cl)c2O)CC1 ZINC000119087290 401924661 /nfs/dbraw/zinc/92/46/61/401924661.db2.gz WPLMGVPLMJKSOL-UHFFFAOYSA-N 1 2 308.809 2.490 20 10 DECDLO O=C(C1CC1)N1CCC[N@H+](Cc2cccc(Cl)c2O)CC1 ZINC000119087290 401924664 /nfs/dbraw/zinc/92/46/64/401924664.db2.gz WPLMGVPLMJKSOL-UHFFFAOYSA-N 1 2 308.809 2.490 20 10 DECDLO CC(=O)c1cc(Cl)cc(C[N@@H+](C)CC(=O)NC(C)C)c1O ZINC000050152050 402026108 /nfs/dbraw/zinc/02/61/08/402026108.db2.gz WQIDWBOKTGFHIP-UHFFFAOYSA-N 1 2 312.797 2.205 20 10 DECDLO CC(=O)c1cc(Cl)cc(C[N@H+](C)CC(=O)NC(C)C)c1O ZINC000050152050 402026111 /nfs/dbraw/zinc/02/61/11/402026111.db2.gz WQIDWBOKTGFHIP-UHFFFAOYSA-N 1 2 312.797 2.205 20 10 DECDLO O=C(NCc1cc[nH+]c(N2CCCC2)c1)c1cccc(O)c1O ZINC000186846853 402467517 /nfs/dbraw/zinc/46/75/17/402467517.db2.gz SSSIVYVHCBLTPI-UHFFFAOYSA-N 1 2 313.357 2.023 20 10 DECDLO CS(=O)(=O)[C@H]1CCCC[N@H+](Cc2cccc(Cl)c2O)C1 ZINC000278799805 402872710 /nfs/dbraw/zinc/87/27/10/402872710.db2.gz XNAZZVBKXXVVEE-LBPRGKRZSA-N 1 2 317.838 2.445 20 10 DECDLO CS(=O)(=O)[C@H]1CCCC[N@@H+](Cc2cccc(Cl)c2O)C1 ZINC000278799805 402872712 /nfs/dbraw/zinc/87/27/12/402872712.db2.gz XNAZZVBKXXVVEE-LBPRGKRZSA-N 1 2 317.838 2.445 20 10 DECDLO CCOCc1cc(C[NH2+]Cc2nnc(CC)[nH]2)ccc1OC ZINC000294661496 403724841 /nfs/dbraw/zinc/72/48/41/403724841.db2.gz AJYBQXKEXRTAHF-UHFFFAOYSA-N 1 2 304.394 2.202 20 10 DECDLO CN(C)C(=O)C1([NH2+]Cc2cc([N+](=O)[O-])ccc2O)CCCCC1 ZINC000295073115 403751798 /nfs/dbraw/zinc/75/17/98/403751798.db2.gz RGLDISGEMMECBF-UHFFFAOYSA-N 1 2 321.377 2.181 20 10 DECDLO C[N@H+](Cc1cnns1)Cc1ccc(N2CCOCC2)cc1 ZINC000296489090 404271312 /nfs/dbraw/zinc/27/13/12/404271312.db2.gz KZGVHXDGDWVAAV-UHFFFAOYSA-N 1 2 304.419 2.007 20 10 DECDLO C[N@@H+](Cc1cnns1)Cc1ccc(N2CCOCC2)cc1 ZINC000296489090 404271316 /nfs/dbraw/zinc/27/13/16/404271316.db2.gz KZGVHXDGDWVAAV-UHFFFAOYSA-N 1 2 304.419 2.007 20 10 DECDLO COc1c(O)c(C[N@@H+]2CCC[C@H]2c2ncc[nH]2)ccc1[N+](=O)[O-] ZINC000364762117 404529937 /nfs/dbraw/zinc/52/99/37/404529937.db2.gz YCIQAUADUZNCKW-LBPRGKRZSA-N 1 2 318.333 2.369 20 10 DECDLO COc1c(O)c(C[N@H+]2CCC[C@H]2c2ncc[nH]2)ccc1[N+](=O)[O-] ZINC000364762117 404529944 /nfs/dbraw/zinc/52/99/44/404529944.db2.gz YCIQAUADUZNCKW-LBPRGKRZSA-N 1 2 318.333 2.369 20 10 DECDLO C[C@H]([NH2+]C[C@@H]1CCCN1CCCO)c1cc(F)cc(F)c1O ZINC000834850824 649854122 /nfs/dbraw/zinc/85/41/22/649854122.db2.gz PZGWYBMFNJDXRW-AAEUAGOBSA-N 1 2 314.376 2.168 20 10 DECDLO C[C@H]([NH2+]C[C@@H]1CCCCN1CCO)c1cc(F)cc(F)c1O ZINC000834849817 649854245 /nfs/dbraw/zinc/85/42/45/649854245.db2.gz GBRIJZSUSPTXQB-AAEUAGOBSA-N 1 2 314.376 2.168 20 10 DECDLO CCC[C@@H]1C(=O)NCC[N@@H+]1C/C=C/c1ccc(N(C)C)cc1 ZINC000835028038 649868575 /nfs/dbraw/zinc/86/85/75/649868575.db2.gz IRBRESNNHOOHHF-QQOXCAACSA-N 1 2 301.434 2.366 20 10 DECDLO CCC[C@@H]1C(=O)NCC[N@H+]1C/C=C/c1ccc(N(C)C)cc1 ZINC000835028038 649868573 /nfs/dbraw/zinc/86/85/73/649868573.db2.gz IRBRESNNHOOHHF-QQOXCAACSA-N 1 2 301.434 2.366 20 10 DECDLO COC(=O)N1CC[NH+](C/C=C/c2ccc(N(C)C)cc2)CC1 ZINC000835029382 649869005 /nfs/dbraw/zinc/86/90/05/649869005.db2.gz XINWWVQYWFIQDH-SNAWJCMRSA-N 1 2 303.406 2.150 20 10 DECDLO CCCN1CCC[N@H+](Cc2cc(F)cc(C(C)=O)c2O)CC1=O ZINC000189394627 519851826 /nfs/dbraw/zinc/85/18/26/519851826.db2.gz OYDVWFIRESOUII-UHFFFAOYSA-N 1 2 322.380 2.178 20 10 DECDLO CCCN1CCC[N@@H+](Cc2cc(F)cc(C(C)=O)c2O)CC1=O ZINC000189394627 519851827 /nfs/dbraw/zinc/85/18/27/519851827.db2.gz OYDVWFIRESOUII-UHFFFAOYSA-N 1 2 322.380 2.178 20 10 DECDLO CCN(CC)c1ccc(C[N@@H+]2CCC[C@@H](O)[C@@H]2C(=O)OC)cc1 ZINC000188776645 520893011 /nfs/dbraw/zinc/89/30/11/520893011.db2.gz AZLKWXLVKDVSEU-IAGOWNOFSA-N 1 2 320.433 2.031 20 10 DECDLO CCN(CC)c1ccc(C[N@H+]2CCC[C@@H](O)[C@@H]2C(=O)OC)cc1 ZINC000188776645 520893018 /nfs/dbraw/zinc/89/30/18/520893018.db2.gz AZLKWXLVKDVSEU-IAGOWNOFSA-N 1 2 320.433 2.031 20 10 DECDLO COC(=O)C[C@@H]1C[N@H+](Cc2cc(Cl)cc(C)c2O)CCO1 ZINC000180287497 523302037 /nfs/dbraw/zinc/30/20/37/523302037.db2.gz HPDQUTSTNKRVNC-CYBMUJFWSA-N 1 2 313.781 2.118 20 10 DECDLO COC(=O)C[C@@H]1C[N@@H+](Cc2cc(Cl)cc(C)c2O)CCO1 ZINC000180287497 523302047 /nfs/dbraw/zinc/30/20/47/523302047.db2.gz HPDQUTSTNKRVNC-CYBMUJFWSA-N 1 2 313.781 2.118 20 10 DECDLO Oc1ccccc1C[N@@H+](Cc1csnn1)C[C@H]1CCCO1 ZINC000160199102 526372330 /nfs/dbraw/zinc/37/23/30/526372330.db2.gz CWNXGIAOZRURMW-CQSZACIVSA-N 1 2 305.403 2.425 20 10 DECDLO Oc1ccccc1C[N@H+](Cc1csnn1)C[C@H]1CCCO1 ZINC000160199102 526372337 /nfs/dbraw/zinc/37/23/37/526372337.db2.gz CWNXGIAOZRURMW-CQSZACIVSA-N 1 2 305.403 2.425 20 10 DECDLO COCCN(C)CCC[NH2+]Cc1c(O)cc(C)cc1Cl ZINC000840877181 650370272 /nfs/dbraw/zinc/37/02/72/650370272.db2.gz YJCJKXJLGYPIET-UHFFFAOYSA-N 1 2 300.830 2.412 20 10 DECDLO C[C@H]([NH2+][C@@H](C)[C@H]1CN(C)CCO1)c1cc(F)cc(F)c1O ZINC000756762328 639692698 /nfs/dbraw/zinc/69/26/98/639692698.db2.gz XPJVOEJXTPUXMK-PKFCDNJMSA-N 1 2 300.349 2.040 20 10 DECDLO O=C(NCCc1ccc(O)c(O)c1)c1ccc(-n2cc[nH+]c2)cc1 ZINC000768904280 641141883 /nfs/dbraw/zinc/14/18/83/641141883.db2.gz SEIZOZORLXCUPT-UHFFFAOYSA-N 1 2 323.352 2.256 20 10 DECDLO CCOc1ccc(O)c(C[N@H+](C)Cc2nnc3ccccn32)c1 ZINC000769201599 641193443 /nfs/dbraw/zinc/19/34/43/641193443.db2.gz CCOSHHFYBZOZCO-UHFFFAOYSA-N 1 2 312.373 2.466 20 10 DECDLO CCOc1ccc(O)c(C[N@@H+](C)Cc2nnc3ccccn32)c1 ZINC000769201599 641193449 /nfs/dbraw/zinc/19/34/49/641193449.db2.gz CCOSHHFYBZOZCO-UHFFFAOYSA-N 1 2 312.373 2.466 20 10 DECDLO CC[N@H+](Cc1c(O)cccc1OC)[C@H](C)CS(=O)(=O)CC ZINC000769425715 641238708 /nfs/dbraw/zinc/23/87/08/641238708.db2.gz UDGMPOQGJAHCPK-GFCCVEGCSA-N 1 2 315.435 2.046 20 10 DECDLO CC[N@@H+](Cc1c(O)cccc1OC)[C@H](C)CS(=O)(=O)CC ZINC000769425715 641238714 /nfs/dbraw/zinc/23/87/14/641238714.db2.gz UDGMPOQGJAHCPK-GFCCVEGCSA-N 1 2 315.435 2.046 20 10 DECDLO C[C@@H](NC(=O)[C@@H]1CCn2cc[nH+]c2C1)c1ccc(N(C)C)cc1 ZINC000775405817 642040584 /nfs/dbraw/zinc/04/05/84/642040584.db2.gz VKERCJRXKGAKFT-UKRRQHHQSA-N 1 2 312.417 2.389 20 10 DECDLO CNC(=O)[C@H]1CCC[C@H]1[NH2+]Cc1cc(Cl)cc(F)c1O ZINC000776252589 642149114 /nfs/dbraw/zinc/14/91/14/642149114.db2.gz MPJIHJLDHQGBJE-CMPLNLGQSA-N 1 2 300.761 2.189 20 10 DECDLO CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)Cc1c[nH+]c[nH]1 ZINC000900293077 642309726 /nfs/dbraw/zinc/30/97/26/642309726.db2.gz UDJJOGCZMGKQGA-UHFFFAOYSA-N 1 2 300.406 2.455 20 10 DECDLO COc1ccc(O)c(C[N@@H+]2CCN(CC(C)C)C(=O)[C@H]2C)c1 ZINC000779202274 642472145 /nfs/dbraw/zinc/47/21/45/642472145.db2.gz MIBHHNGMEWCQMS-CYBMUJFWSA-N 1 2 306.406 2.090 20 10 DECDLO COc1ccc(O)c(C[N@H+]2CCN(CC(C)C)C(=O)[C@H]2C)c1 ZINC000779202274 642472149 /nfs/dbraw/zinc/47/21/49/642472149.db2.gz MIBHHNGMEWCQMS-CYBMUJFWSA-N 1 2 306.406 2.090 20 10 DECDLO Cc1ccc(C(=O)NCC[NH+]2Cc3ccccc3C2)c(O)c1O ZINC000780906196 642687597 /nfs/dbraw/zinc/68/75/97/642687597.db2.gz KMALQRVDJUHXMW-UHFFFAOYSA-N 1 2 312.369 2.152 20 10 DECDLO O=C(NCc1ccccc1Cn1cc[nH+]c1)c1cccc(O)c1O ZINC000790488931 643858941 /nfs/dbraw/zinc/85/89/41/643858941.db2.gz SUPSLFDDVDARCH-UHFFFAOYSA-N 1 2 323.352 2.273 20 10 DECDLO COc1ccc(N(C)CC[N@H+](C)Cc2cn(C3CC3)nn2)cc1 ZINC000906318832 644209903 /nfs/dbraw/zinc/20/99/03/644209903.db2.gz ZCGUCGWWEIHDGO-UHFFFAOYSA-N 1 2 315.421 2.190 20 10 DECDLO COc1ccc(N(C)CC[N@@H+](C)Cc2cn(C3CC3)nn2)cc1 ZINC000906318832 644209905 /nfs/dbraw/zinc/20/99/05/644209905.db2.gz ZCGUCGWWEIHDGO-UHFFFAOYSA-N 1 2 315.421 2.190 20 10 DECDLO CCCCN(Cc1ccccc1O)C(=O)Cc1c[nH+]cn1C ZINC000801551607 645413418 /nfs/dbraw/zinc/41/34/18/645413418.db2.gz PBJFHHUBPWRUHL-UHFFFAOYSA-N 1 2 301.390 2.497 20 10 DECDLO CCC[N@H+](Cc1cccc(Cl)c1O)[C@H]1CC(=O)N(C)C1=O ZINC000802655831 645541154 /nfs/dbraw/zinc/54/11/54/645541154.db2.gz FYLMDEGHOHILMD-LBPRGKRZSA-N 1 2 310.781 2.015 20 10 DECDLO CCC[N@@H+](Cc1cccc(Cl)c1O)[C@H]1CC(=O)N(C)C1=O ZINC000802655831 645541160 /nfs/dbraw/zinc/54/11/60/645541160.db2.gz FYLMDEGHOHILMD-LBPRGKRZSA-N 1 2 310.781 2.015 20 10 DECDLO COc1ccc(N2CC[NH+](Cc3cccc(F)c3O)CC2)nc1 ZINC000825305509 648738950 /nfs/dbraw/zinc/73/89/50/648738950.db2.gz LVQFXADSYZRHGQ-UHFFFAOYSA-N 1 2 317.364 2.257 20 10 DECDLO COc1cc(C[N@@H+]2CC(=O)N(C)C[C@@H]2C)c(O)c(C(C)(C)C)c1 ZINC000825629070 648790838 /nfs/dbraw/zinc/79/08/38/648790838.db2.gz QSMZOOCDPRCOAU-LBPRGKRZSA-N 1 2 320.433 2.361 20 10 DECDLO COc1cc(C[N@H+]2CC(=O)N(C)C[C@@H]2C)c(O)c(C(C)(C)C)c1 ZINC000825629070 648790843 /nfs/dbraw/zinc/79/08/43/648790843.db2.gz QSMZOOCDPRCOAU-LBPRGKRZSA-N 1 2 320.433 2.361 20 10 DECDLO Oc1c(F)cc(Cl)cc1CN1CC[NH+]([C@H]2CCOC2)CC1 ZINC000827121306 648975347 /nfs/dbraw/zinc/97/53/47/648975347.db2.gz ZBNAOWMTMYCYBM-ZDUSSCGKSA-N 1 2 314.788 2.091 20 10 DECDLO CC[C@H](C(=O)N[C@@H](C)c1ccccc1O)[N@@H+]1CCO[C@@H](CC)C1 ZINC000827964528 649112648 /nfs/dbraw/zinc/11/26/48/649112648.db2.gz OLOCEEWFLPSXDB-OFQRWUPVSA-N 1 2 320.433 2.459 20 10 DECDLO CC[C@H](C(=O)N[C@@H](C)c1ccccc1O)[N@H+]1CCO[C@@H](CC)C1 ZINC000827964528 649112649 /nfs/dbraw/zinc/11/26/49/649112649.db2.gz OLOCEEWFLPSXDB-OFQRWUPVSA-N 1 2 320.433 2.459 20 10 DECDLO C[C@H]([NH2+]C[C@@H]1CN(C2CC2)C(=O)O1)c1cc(F)cc(F)c1O ZINC000848572806 651473067 /nfs/dbraw/zinc/47/30/67/651473067.db2.gz VYPYPIUOSHSVJN-GZMMTYOYSA-N 1 2 312.316 2.304 20 10 DECDLO COc1cc(C[NH+]2CCN(c3ccc(OC)cc3)CC2)on1 ZINC000851714005 652213258 /nfs/dbraw/zinc/21/32/58/652213258.db2.gz KKENLWPKXWHVBU-UHFFFAOYSA-N 1 2 303.362 2.014 20 10 DECDLO CCN(CC)c1ccc(C[N@@H+]2C[C@H](C)O[C@H](CO)C2)cc1F ZINC000191532568 684431737 /nfs/dbraw/zinc/43/17/37/684431737.db2.gz SHCIHJPGXVOKKD-ZFWWWQNUSA-N 1 2 310.413 2.254 20 10 DECDLO CCN(CC)c1ccc(C[N@H+]2C[C@H](C)O[C@H](CO)C2)cc1F ZINC000191532568 684431742 /nfs/dbraw/zinc/43/17/42/684431742.db2.gz SHCIHJPGXVOKKD-ZFWWWQNUSA-N 1 2 310.413 2.254 20 10 DECDLO Cn1c[nH+]c2c1CCN(Cc1c(O)cccc1Br)C2 ZINC000862211483 686255882 /nfs/dbraw/zinc/25/58/82/686255882.db2.gz IMCNOGRNCWHQNW-UHFFFAOYSA-N 1 2 322.206 2.447 20 10 DECDLO CN1C[C@@H]([N@H+](C)Cc2cc(Cl)cc(F)c2O)CCC1=O ZINC000862428181 686301276 /nfs/dbraw/zinc/30/12/76/686301276.db2.gz MTSUOJYTGFWBQB-NSHDSACASA-N 1 2 300.761 2.237 20 10 DECDLO CN1C[C@@H]([N@@H+](C)Cc2cc(Cl)cc(F)c2O)CCC1=O ZINC000862428181 686301282 /nfs/dbraw/zinc/30/12/82/686301282.db2.gz MTSUOJYTGFWBQB-NSHDSACASA-N 1 2 300.761 2.237 20 10 DECDLO COC[C@]1(C)C[N@H+](Cc2cc(Cl)cc(OC)c2O)CCO1 ZINC000862552123 686321742 /nfs/dbraw/zinc/32/17/42/686321742.db2.gz TXVPPAKICYXEQS-HNNXBMFYSA-N 1 2 315.797 2.292 20 10 DECDLO COC[C@]1(C)C[N@@H+](Cc2cc(Cl)cc(OC)c2O)CCO1 ZINC000862552123 686321747 /nfs/dbraw/zinc/32/17/47/686321747.db2.gz TXVPPAKICYXEQS-HNNXBMFYSA-N 1 2 315.797 2.292 20 10 DECDLO COc1ccc([C@@H]2CN(C(=O)C3=CC(=O)CS3)CC[NH2+]2)cc1 ZINC000870146211 688497895 /nfs/dbraw/zinc/49/78/95/688497895.db2.gz VXGGUHFBWURRRG-AWEZNQCLSA-N 1 2 318.398 2.249 20 10 DECDLO O=C(C1=CC(=O)CS1)N1CC[NH2+][C@@H](c2ccc(F)cc2)C1 ZINC000874888109 689529574 /nfs/dbraw/zinc/52/95/74/689529574.db2.gz BAVKKDZLWURISM-CYBMUJFWSA-N 1 2 306.362 2.380 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@H+]2[C@@H]3CC[C@H]2CCN(C)C3)c1O ZINC000931724309 694464451 /nfs/dbraw/zinc/46/44/51/694464451.db2.gz CRNUEYGDQQRFJH-LSDHHAIUSA-N 1 2 306.381 2.402 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@@H+]2[C@@H]3CC[C@H]2CCN(C)C3)c1O ZINC000931724309 694464454 /nfs/dbraw/zinc/46/44/54/694464454.db2.gz CRNUEYGDQQRFJH-LSDHHAIUSA-N 1 2 306.381 2.402 20 10 DECDLO C[C@@H]1[C@H](NC(=O)C(F)(F)F)CCC[N@@H+]1Cc1ccc(N)cc1 ZINC001335289167 1150392977 /nfs/dbraw/zinc/39/29/77/1150392977.db2.gz KLUMSBMHWBUVCA-ZWNOBZJWSA-N 1 2 315.339 2.300 20 10 DECDLO C[C@@H]1[C@H](NC(=O)C(F)(F)F)CCC[N@H+]1Cc1ccc(N)cc1 ZINC001335289167 1150392980 /nfs/dbraw/zinc/39/29/80/1150392980.db2.gz KLUMSBMHWBUVCA-ZWNOBZJWSA-N 1 2 315.339 2.300 20 10 DECDLO Oc1cc(F)c(Br)cc1C[NH+]1CCC(O)CC1 ZINC001144299500 790849782 /nfs/dbraw/zinc/84/97/82/790849782.db2.gz YKJBWHHPXAKPML-UHFFFAOYSA-N 1 2 304.159 2.251 20 10 DECDLO COC(=O)Cc1cc[nH+]c(NCc2ccc(OC)cc2O)c1 ZINC001333723807 1150083828 /nfs/dbraw/zinc/08/38/28/1150083828.db2.gz YRJCYNZGAIKGDG-UHFFFAOYSA-N 1 2 302.330 2.123 20 10 DECDLO C[S@](=O)CCC[NH2+]Cc1cc(Br)cc(F)c1O ZINC000715792428 792511615 /nfs/dbraw/zinc/51/16/15/792511615.db2.gz POFSBPOUHQDDTK-KRWDZBQOSA-N 1 2 324.215 2.152 20 10 DECDLO COc1cc(C[NH+]2CC3(C2)CC(F)(F)CS3)cc(O)c1O ZINC001204345064 795702998 /nfs/dbraw/zinc/70/29/98/795702998.db2.gz GOKJMBQFVYNVCE-UHFFFAOYSA-N 1 2 317.357 2.433 20 10 DECDLO Oc1c(F)cccc1C[NH+]1CCN(c2nccc(Cl)n2)CC1 ZINC001138128497 796167015 /nfs/dbraw/zinc/16/70/15/796167015.db2.gz NULMYPIGNRYRNA-UHFFFAOYSA-N 1 2 322.771 2.297 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[NH+]1CC2(C1)CCCOC2 ZINC001139125118 796326904 /nfs/dbraw/zinc/32/69/04/796326904.db2.gz MMXVBQWNRKIIOM-UHFFFAOYSA-N 1 2 315.369 2.419 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CCCC[C@H](O)C1 ZINC001139127367 796329653 /nfs/dbraw/zinc/32/96/53/796329653.db2.gz UJNLIUCDPREIPD-LBPRGKRZSA-N 1 2 303.358 2.154 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CCCC[C@H](O)C1 ZINC001139127367 796329659 /nfs/dbraw/zinc/32/96/59/796329659.db2.gz UJNLIUCDPREIPD-LBPRGKRZSA-N 1 2 303.358 2.154 20 10 DECDLO CCN(CC)c1ccc(C[N@@H+]2CCO[C@@H](C(C)=O)C2)c(O)c1 ZINC001140856900 796584634 /nfs/dbraw/zinc/58/46/34/796584634.db2.gz PKWRFKLQNLPWBQ-QGZVFWFLSA-N 1 2 306.406 2.028 20 10 DECDLO CCN(CC)c1ccc(C[N@H+]2CCO[C@@H](C(C)=O)C2)c(O)c1 ZINC001140856900 796584638 /nfs/dbraw/zinc/58/46/38/796584638.db2.gz PKWRFKLQNLPWBQ-QGZVFWFLSA-N 1 2 306.406 2.028 20 10 DECDLO COCCOc1ccc(N2CC[NH+](Cc3cnco3)CC2)cc1 ZINC001140934165 796600747 /nfs/dbraw/zinc/60/07/47/796600747.db2.gz WDUWXTXBZACDRH-UHFFFAOYSA-N 1 2 317.389 2.022 20 10 DECDLO COc1cccc(C[NH+]2CC(C)(NC(=O)OC(C)(C)C)C2)c1O ZINC001203597314 800086952 /nfs/dbraw/zinc/08/69/52/800086952.db2.gz ZQEFNVCMIXPLEU-UHFFFAOYSA-N 1 2 322.405 2.500 20 10 DECDLO COc1cccc(C[N@@H+]2CCc3nc(Cl)ncc3C2)c1O ZINC001203595982 800087184 /nfs/dbraw/zinc/08/71/84/800087184.db2.gz WJJNOJHLBNSINQ-UHFFFAOYSA-N 1 2 305.765 2.403 20 10 DECDLO COc1cccc(C[N@H+]2CCc3nc(Cl)ncc3C2)c1O ZINC001203595982 800087190 /nfs/dbraw/zinc/08/71/90/800087190.db2.gz WJJNOJHLBNSINQ-UHFFFAOYSA-N 1 2 305.765 2.403 20 10 DECDLO COc1cc(C[N@@H+]2CCc3cc(O)ccc3C2)cc(O)c1O ZINC001204347814 800207244 /nfs/dbraw/zinc/20/72/44/800207244.db2.gz YSOGQWZTWKRJPF-UHFFFAOYSA-N 1 2 301.342 2.370 20 10 DECDLO COc1cc(C[N@H+]2CCc3cc(O)ccc3C2)cc(O)c1O ZINC001204347814 800207246 /nfs/dbraw/zinc/20/72/46/800207246.db2.gz YSOGQWZTWKRJPF-UHFFFAOYSA-N 1 2 301.342 2.370 20 10 DECDLO COc1cc(C[NH+]2CC(Oc3ccccc3)C2)c(O)cc1O ZINC001231636413 801701067 /nfs/dbraw/zinc/70/10/67/801701067.db2.gz UYZYLZNVFSFVRB-UHFFFAOYSA-N 1 2 301.342 2.370 20 10 DECDLO CCOC(=O)[C@]12C[C@H]1CC[N@@H+]2Cc1ccc(N(C)C)cc1OC ZINC001231851827 801737595 /nfs/dbraw/zinc/73/75/95/801737595.db2.gz NGGQFICVLAELFB-KDOFPFPSSA-N 1 2 318.417 2.289 20 10 DECDLO CCOC(=O)[C@]12C[C@H]1CC[N@H+]2Cc1ccc(N(C)C)cc1OC ZINC001231851827 801737600 /nfs/dbraw/zinc/73/76/00/801737600.db2.gz NGGQFICVLAELFB-KDOFPFPSSA-N 1 2 318.417 2.289 20 10 DECDLO COc1ccc(N2CCN(Cc3c[nH+]c(C)[nH]3)CC2)c(OC)c1 ZINC001232465279 801894062 /nfs/dbraw/zinc/89/40/62/801894062.db2.gz HCJDTNLDRUFGAY-UHFFFAOYSA-N 1 2 316.405 2.058 20 10 DECDLO COc1ccc(N2CCN(Cc3c[nH]c(C)[nH+]3)CC2)c(OC)c1 ZINC001232465279 801894070 /nfs/dbraw/zinc/89/40/70/801894070.db2.gz HCJDTNLDRUFGAY-UHFFFAOYSA-N 1 2 316.405 2.058 20 10 DECDLO Oc1ccc(Br)cc1C[NH+]1CCN(CCF)CC1 ZINC000402762738 801907750 /nfs/dbraw/zinc/90/77/50/801907750.db2.gz IEHHGEVKTLKJHH-UHFFFAOYSA-N 1 2 317.202 2.242 20 10 DECDLO CC(C)(C)OC(=O)C1CC[NH+](Cc2cc(O)c(O)c(O)c2)CC1 ZINC001233013691 802002664 /nfs/dbraw/zinc/00/26/64/802002664.db2.gz SBBHKHYEIVRDEM-UHFFFAOYSA-N 1 2 323.389 2.357 20 10 DECDLO COC(C[N@H+](C)Cc1c(O)cc(Br)cc1F)OC ZINC001233031245 802008954 /nfs/dbraw/zinc/00/89/54/802008954.db2.gz AEAOZPIWVNUKEU-UHFFFAOYSA-N 1 2 322.174 2.345 20 10 DECDLO COC(C[N@@H+](C)Cc1c(O)cc(Br)cc1F)OC ZINC001233031245 802008963 /nfs/dbraw/zinc/00/89/63/802008963.db2.gz AEAOZPIWVNUKEU-UHFFFAOYSA-N 1 2 322.174 2.345 20 10 DECDLO CC(C)N1CC[N@H+](Cc2ccc(C(F)(F)F)cc2O)CC1=O ZINC001233455068 802120900 /nfs/dbraw/zinc/12/09/00/802120900.db2.gz UUFKCXCELZAGRB-UHFFFAOYSA-N 1 2 316.323 2.464 20 10 DECDLO NC(=O)[C@H](F)C1CC[NH+](Cc2cccc(Cl)c2O)CC1 ZINC001462550813 1058848953 /nfs/dbraw/zinc/84/89/53/1058848953.db2.gz YKCOOJKKOYOZDQ-GFCCVEGCSA-N 1 2 300.761 2.081 20 10 DECDLO CCC(=O)N1CC[C@@H]([NH2+]Cc2cc(Cl)cc(F)c2O)C1 ZINC001474068211 1060809513 /nfs/dbraw/zinc/80/95/13/1060809513.db2.gz SUXZMPQYPXBLRR-LLVKDONJSA-N 1 2 300.761 2.285 20 10 DECDLO CC(C)(C)[C@@H](Cn1cc[nH+]c1)NC(=O)Cc1ccc(O)c(O)c1 ZINC001625595077 1078248481 /nfs/dbraw/zinc/24/84/81/1078248481.db2.gz CPDNZHIJDUMMMI-OAHLLOKOSA-N 1 2 317.389 2.068 20 10 DECDLO C[N@H+]1Cc2ccccc2[C@H](NC(=O)c2c(F)ccc(O)c2O)C1 ZINC001638553668 1078570419 /nfs/dbraw/zinc/57/04/19/1078570419.db2.gz DRDHTWCYPCZMKC-CYBMUJFWSA-N 1 2 316.332 2.153 20 10 DECDLO C[N@@H+]1Cc2ccccc2[C@H](NC(=O)c2c(F)ccc(O)c2O)C1 ZINC001638553668 1078570423 /nfs/dbraw/zinc/57/04/23/1078570423.db2.gz DRDHTWCYPCZMKC-CYBMUJFWSA-N 1 2 316.332 2.153 20 10 DECDLO Cc1ccc(C(=O)N2CCC(c3c[nH+]cn3C)CC2)c(O)c1O ZINC001520992527 1069196752 /nfs/dbraw/zinc/19/67/52/1069196752.db2.gz QJTSLKKSMNFEKZ-UHFFFAOYSA-N 1 2 315.373 2.160 20 10 DECDLO CC(C)(C[NH2+]Cc1cc(Cl)cc(F)c1O)N1CCOCC1 ZINC001648695958 1075006184 /nfs/dbraw/zinc/00/61/84/1075006184.db2.gz NQZIYVHNLFFXMK-UHFFFAOYSA-N 1 2 316.804 2.385 20 10 DECDLO C[C@H]([NH2+][C@@H]1CCOC(C)(C)C1)c1cccc(-c2nn[nH]n2)c1O ZINC001589952830 1076535047 /nfs/dbraw/zinc/53/50/47/1076535047.db2.gz DGQYSVMIAYCJGJ-WDEREUQCSA-N 1 2 317.393 2.181 20 10 DECDLO C[C@H]([NH2+]CC[C@H]1CCCCO1)c1cccc(-c2nn[nH]n2)c1O ZINC001589963759 1076538375 /nfs/dbraw/zinc/53/83/75/1076538375.db2.gz YDPZHFILSQUEQW-NWDGAFQWSA-N 1 2 317.393 2.182 20 10 DECDLO Cc1cc(O)c(C[NH2+]Cc2nc(C(N)=O)cs2)c(Cl)c1 ZINC001621008780 1077118129 /nfs/dbraw/zinc/11/81/29/1077118129.db2.gz HOEDTFJHUBSTLB-UHFFFAOYSA-N 1 2 311.794 2.199 20 10 DECDLO Oc1c(F)cc(Cl)cc1C[NH2+]CCOC[C@H]1CCCO1 ZINC001661488172 1080486904 /nfs/dbraw/zinc/48/69/04/1080486904.db2.gz QXUQWDWOJUTLHC-GFCCVEGCSA-N 1 2 303.761 2.470 20 10 DECDLO COc1ccc(C[NH2+]CCNC(=O)C(F)C(F)(F)F)cc1C ZINC001127737604 1080683284 /nfs/dbraw/zinc/68/32/84/1080683284.db2.gz RGUYECWDIYCKEP-GFCCVEGCSA-N 1 2 322.302 2.110 20 10 DECDLO COc1ccc(C[NH2+]CCNC(=O)[C@@H](F)C(F)(F)F)cc1C ZINC001127737604 1080683290 /nfs/dbraw/zinc/68/32/90/1080683290.db2.gz RGUYECWDIYCKEP-GFCCVEGCSA-N 1 2 322.302 2.110 20 10 DECDLO Oc1c(F)cc(Br)cc1C[N@H+]1C[C@@H]2COC[C@@H]2C1 ZINC000718153147 1088304941 /nfs/dbraw/zinc/30/49/41/1088304941.db2.gz IUCFMBFITUDIIQ-AOOOYVTPSA-N 1 2 316.170 2.372 20 10 DECDLO Oc1c(F)cc(Br)cc1C[N@@H+]1C[C@@H]2COC[C@@H]2C1 ZINC000718153147 1088304925 /nfs/dbraw/zinc/30/49/25/1088304925.db2.gz IUCFMBFITUDIIQ-AOOOYVTPSA-N 1 2 316.170 2.372 20 10 DECDLO CN1CC[C@@]2(CCC[N@@H+]2Cc2c(O)ccc(F)c2Cl)C1=O ZINC001274823507 1091431444 /nfs/dbraw/zinc/43/14/44/1091431444.db2.gz VMIWRKVUOFDRRI-HNNXBMFYSA-N 1 2 312.772 2.381 20 10 DECDLO CN1CC[C@@]2(CCC[N@H+]2Cc2c(O)ccc(F)c2Cl)C1=O ZINC001274823507 1091431447 /nfs/dbraw/zinc/43/14/47/1091431447.db2.gz VMIWRKVUOFDRRI-HNNXBMFYSA-N 1 2 312.772 2.381 20 10 DECDLO Oc1cc(C[N@@H+]2CCCOCC2)c(O)cc1Br ZINC001236771956 1138422676 /nfs/dbraw/zinc/42/26/76/1138422676.db2.gz IQSIMNWLZANLON-UHFFFAOYSA-N 1 2 302.168 2.083 20 10 DECDLO Oc1cc(C[N@H+]2CCCOCC2)c(O)cc1Br ZINC001236771956 1138422682 /nfs/dbraw/zinc/42/26/82/1138422682.db2.gz IQSIMNWLZANLON-UHFFFAOYSA-N 1 2 302.168 2.083 20 10 DECDLO CCn1nnc2c1CC[N@H+](Cc1c(C)cccc1O)[C@H]2COC ZINC001237486173 1138654079 /nfs/dbraw/zinc/65/40/79/1138654079.db2.gz OXRFWPWDCLYAGL-HNNXBMFYSA-N 1 2 316.405 2.058 20 10 DECDLO CCn1nnc2c1CC[N@@H+](Cc1c(C)cccc1O)[C@H]2COC ZINC001237486173 1138654089 /nfs/dbraw/zinc/65/40/89/1138654089.db2.gz OXRFWPWDCLYAGL-HNNXBMFYSA-N 1 2 316.405 2.058 20 10 DECDLO Cc1cc(F)cc(C[NH+]2CCN(C[C@@H]3CCCO3)CC2)c1O ZINC001238060530 1138819420 /nfs/dbraw/zinc/81/94/20/1138819420.db2.gz BVSJTSSSYGQVBJ-INIZCTEOSA-N 1 2 308.397 2.136 20 10 DECDLO CC[C@@H](C(=O)N(C)c1ccc(N)cc1)[N@@H+]1CCO[C@H](CC)C1 ZINC001340725906 1143412854 /nfs/dbraw/zinc/41/28/54/1143412854.db2.gz IIPNQDKSVXGVFS-CVEARBPZSA-N 1 2 305.422 2.121 20 10 DECDLO CC[C@@H](C(=O)N(C)c1ccc(N)cc1)[N@H+]1CCO[C@H](CC)C1 ZINC001340725906 1143412879 /nfs/dbraw/zinc/41/28/79/1143412879.db2.gz IIPNQDKSVXGVFS-CVEARBPZSA-N 1 2 305.422 2.121 20 10 DECDLO CCCNC(=O)[C@@H](C)[NH+]1CCN(c2ccc(OCC)cc2)CC1 ZINC001340946318 1143503997 /nfs/dbraw/zinc/50/39/97/1143503997.db2.gz UQKQNCCIIOEGSX-OAHLLOKOSA-N 1 2 319.449 2.122 20 10 DECDLO CCc1[nH]c(CNC(=O)c2ccc(N=NC(N)=O)cc2)c[nH+]1 ZINC001303974945 1147340238 /nfs/dbraw/zinc/34/02/38/1147340238.db2.gz QWYZUGUOIFLSAL-UHFFFAOYSA-N 1 2 300.322 2.065 20 10 DECDLO CCc1[nH]cc(CNC(=O)c2ccc(N=NC(N)=O)cc2)[nH+]1 ZINC001303974945 1147340243 /nfs/dbraw/zinc/34/02/43/1147340243.db2.gz QWYZUGUOIFLSAL-UHFFFAOYSA-N 1 2 300.322 2.065 20 10 DECDLO CCOC(=O)[C@@H](F)C1C[NH+](Cc2cc(F)c(F)cc2O)C1 ZINC001308786008 1147486377 /nfs/dbraw/zinc/48/63/77/1147486377.db2.gz VEGALWBPXBDYGY-ZDUSSCGKSA-N 1 2 303.280 2.003 20 10 DECDLO CN(C)c1ccc(C[N@@H+]2CCOC[C@H]2[C@H]2CCCO2)cc1F ZINC000377701405 529780324 /nfs/dbraw/zinc/78/03/24/529780324.db2.gz PAVKBOIRVYFCTB-DLBZAZTESA-N 1 2 308.397 2.272 20 10 DECDLO CN(C)c1ccc(C[N@H+]2CCOC[C@H]2[C@H]2CCCO2)cc1F ZINC000377701405 529780325 /nfs/dbraw/zinc/78/03/25/529780325.db2.gz PAVKBOIRVYFCTB-DLBZAZTESA-N 1 2 308.397 2.272 20 10 DECDLO O=[N+]([O-])c1ccc(O)c(C[NH2+]C[C@@H]2COC3(CCCC3)O2)c1 ZINC000271467069 129919236 /nfs/dbraw/zinc/91/92/36/129919236.db2.gz VCTYIQDLAXHZTP-CYBMUJFWSA-N 1 2 308.334 2.076 20 10 DECDLO C[C@@H]([NH2+]C[C@@H]1CCCS(=O)(=O)C1)c1ccc(F)c(F)c1O ZINC000287136617 131266266 /nfs/dbraw/zinc/26/62/66/131266266.db2.gz RYNGQLIKLSPNIK-ZJUUUORDSA-N 1 2 319.373 2.146 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@@H+]2CCO[C@@H]([C@@H]3CCCO3)C2)c1O ZINC000089153865 401937080 /nfs/dbraw/zinc/93/70/80/401937080.db2.gz FOSLZQKSWAXSGY-JKSUJKDBSA-N 1 2 323.364 2.114 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@H+]2CCO[C@@H]([C@@H]3CCCO3)C2)c1O ZINC000089153865 401937083 /nfs/dbraw/zinc/93/70/83/401937083.db2.gz FOSLZQKSWAXSGY-JKSUJKDBSA-N 1 2 323.364 2.114 20 10 DECDLO O=[N+]([O-])c1ccc(O)c(C[NH2+][C@]2(CO)CCc3ccccc32)c1 ZINC000135910651 401955337 /nfs/dbraw/zinc/95/53/37/401955337.db2.gz YDXBYJNFAPRMCJ-KRWDZBQOSA-N 1 2 314.341 2.224 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@@H+]2CCOC3(CCOCC3)C2)c1O ZINC000135626814 401948009 /nfs/dbraw/zinc/94/80/09/401948009.db2.gz HADVWTXENCXNKY-UHFFFAOYSA-N 1 2 323.364 2.115 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@H+]2CCOC3(CCOCC3)C2)c1O ZINC000135626814 401948011 /nfs/dbraw/zinc/94/80/11/401948011.db2.gz HADVWTXENCXNKY-UHFFFAOYSA-N 1 2 323.364 2.115 20 10 DECDLO Cc1[nH]ncc1C[N@@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000121327401 402028986 /nfs/dbraw/zinc/02/89/86/402028986.db2.gz WBKPPIXYILAHFX-UHFFFAOYSA-N 1 2 300.406 2.187 20 10 DECDLO Cc1[nH]ncc1C[N@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000121327401 402028990 /nfs/dbraw/zinc/02/89/90/402028990.db2.gz WBKPPIXYILAHFX-UHFFFAOYSA-N 1 2 300.406 2.187 20 10 DECDLO C[C@@]1(C(N)=O)CC[N@H+](Cc2cc(Cl)cc(Cl)c2O)C1 ZINC000235436939 402363823 /nfs/dbraw/zinc/36/38/23/402363823.db2.gz ZCRLDJDPOKFAKX-CYBMUJFWSA-N 1 2 303.189 2.396 20 10 DECDLO C[C@@]1(C(N)=O)CC[N@@H+](Cc2cc(Cl)cc(Cl)c2O)C1 ZINC000235436939 402363825 /nfs/dbraw/zinc/36/38/25/402363825.db2.gz ZCRLDJDPOKFAKX-CYBMUJFWSA-N 1 2 303.189 2.396 20 10 DECDLO CCc1nnc(C[N@@H+]2CCCN(c3ccc(OC)cc3)CC2)[nH]1 ZINC000181650541 402653340 /nfs/dbraw/zinc/65/33/40/402653340.db2.gz RIAMQMMQYJXBBL-UHFFFAOYSA-N 1 2 315.421 2.088 20 10 DECDLO CCc1nnc(C[N@H+]2CCCN(c3ccc(OC)cc3)CC2)[nH]1 ZINC000181650541 402653342 /nfs/dbraw/zinc/65/33/42/402653342.db2.gz RIAMQMMQYJXBBL-UHFFFAOYSA-N 1 2 315.421 2.088 20 10 DECDLO CC[C@@]1(C)C[N@@H+](Cc2ccc([N+](=O)[O-])c(OC)c2O)CCO1 ZINC000278373922 402863810 /nfs/dbraw/zinc/86/38/10/402863810.db2.gz KYKZSFDXZNLQKY-HNNXBMFYSA-N 1 2 310.350 2.310 20 10 DECDLO C[N@H+](CCS(=O)(=O)Cc1ccccc1)Cc1ccccc1O ZINC000279783679 402962058 /nfs/dbraw/zinc/96/20/58/402962058.db2.gz UOYYCOWEIGKFDR-UHFFFAOYSA-N 1 2 319.426 2.439 20 10 DECDLO C[N@@H+](CCS(=O)(=O)Cc1ccccc1)Cc1ccccc1O ZINC000279783679 402962059 /nfs/dbraw/zinc/96/20/59/402962059.db2.gz UOYYCOWEIGKFDR-UHFFFAOYSA-N 1 2 319.426 2.439 20 10 DECDLO CCCn1cc[nH+]c1CCCN(C)C(=O)c1cccc(O)c1O ZINC000277616627 403237235 /nfs/dbraw/zinc/23/72/35/403237235.db2.gz RFRFXXPYBSMQOJ-UHFFFAOYSA-N 1 2 317.389 2.409 20 10 DECDLO COCC[C@@H]1COCC[N@@H+]1Cc1cc(Cl)c(F)cc1O ZINC000293863732 403585328 /nfs/dbraw/zinc/58/53/28/403585328.db2.gz ILQDONQSCDMPDC-LLVKDONJSA-N 1 2 303.761 2.422 20 10 DECDLO COCC[C@@H]1COCC[N@H+]1Cc1cc(Cl)c(F)cc1O ZINC000293863732 403585332 /nfs/dbraw/zinc/58/53/32/403585332.db2.gz ILQDONQSCDMPDC-LLVKDONJSA-N 1 2 303.761 2.422 20 10 DECDLO COc1ccc(O)c(C[NH2+][C@H]2CS(=O)(=O)c3ccccc32)c1 ZINC000290312052 404119774 /nfs/dbraw/zinc/11/97/74/404119774.db2.gz CFHHWCNYEPJVGO-AWEZNQCLSA-N 1 2 319.382 2.019 20 10 DECDLO COc1cccc(C[N@@H+]2CCOC[C@H]2c2c(C)n[nH]c2C)c1O ZINC000360828208 404839901 /nfs/dbraw/zinc/83/99/01/404839901.db2.gz HXTYSGXFCQZYHF-AWEZNQCLSA-N 1 2 317.389 2.314 20 10 DECDLO COc1cccc(C[N@H+]2CCOC[C@H]2c2c(C)n[nH]c2C)c1O ZINC000360828208 404839905 /nfs/dbraw/zinc/83/99/05/404839905.db2.gz HXTYSGXFCQZYHF-AWEZNQCLSA-N 1 2 317.389 2.314 20 10 DECDLO CN1CCCN(C(=O)C=Cc2c[nH]c[nH+]2)c2cc(F)ccc21 ZINC000492807270 289923379 /nfs/dbraw/zinc/92/33/79/289923379.db2.gz AZGVFUSVKSRXJD-XQRVVYSFSA-N 1 2 300.337 2.435 20 10 DECDLO Cc1ccc(O)c(CNC(=O)NCCCCn2cc[nH+]c2)c1 ZINC001329979936 1149026864 /nfs/dbraw/zinc/02/68/64/1149026864.db2.gz RHXSMDPTFVIBHZ-UHFFFAOYSA-N 1 2 302.378 2.177 20 10 DECDLO CC[N@@H+](C/C=C/c1ccc(N(C)C)cc1)CCS(C)(=O)=O ZINC000835028184 649868800 /nfs/dbraw/zinc/86/88/00/649868800.db2.gz JSNZOSDGSJKVKU-VOTSOKGWSA-N 1 2 310.463 2.132 20 10 DECDLO CC[N@H+](C/C=C/c1ccc(N(C)C)cc1)CCS(C)(=O)=O ZINC000835028184 649868802 /nfs/dbraw/zinc/86/88/02/649868802.db2.gz JSNZOSDGSJKVKU-VOTSOKGWSA-N 1 2 310.463 2.132 20 10 DECDLO COC(=O)N1CC[NH+](C/C=C\c2ccc(N(C)C)cc2)CC1 ZINC000835029381 649869079 /nfs/dbraw/zinc/86/90/79/649869079.db2.gz XINWWVQYWFIQDH-PLNGDYQASA-N 1 2 303.406 2.150 20 10 DECDLO CC(C)[N@H+](CCS(C)(=O)=O)Cc1cccc(Cl)c1O ZINC000180500240 519650659 /nfs/dbraw/zinc/65/06/59/519650659.db2.gz RHMWKCNNJXIYHU-UHFFFAOYSA-N 1 2 305.827 2.301 20 10 DECDLO CC(C)[N@@H+](CCS(C)(=O)=O)Cc1cccc(Cl)c1O ZINC000180500240 519650662 /nfs/dbraw/zinc/65/06/62/519650662.db2.gz RHMWKCNNJXIYHU-UHFFFAOYSA-N 1 2 305.827 2.301 20 10 DECDLO CN(C)c1ccc(CN(C)C(=O)[C@H]2CCn3cc[nH+]c3C2)cc1 ZINC000157954328 522169511 /nfs/dbraw/zinc/16/95/11/522169511.db2.gz CPDPCXHVTGUSGI-HNNXBMFYSA-N 1 2 312.417 2.170 20 10 DECDLO CCOC(=O)[C@H](C)[NH2+]C1CCN(c2ccc(OC)cc2)CC1 ZINC000734156608 633341033 /nfs/dbraw/zinc/34/10/33/633341033.db2.gz SZYVRECNGHSRIP-ZDUSSCGKSA-N 1 2 306.406 2.205 20 10 DECDLO [NH2+]=C1Nc2nc3ccccc3n2[C@H](c2cccc(Cl)c2O)N1 ZINC000124702779 633403362 /nfs/dbraw/zinc/40/33/62/633403362.db2.gz HBEQGFBFYDABCC-CYBMUJFWSA-N 1 2 313.748 2.492 20 10 DECDLO O=C1C[C@@H]([C@H]2CCCC[N@H+]2Cc2cc(F)cc(F)c2O)CN1 ZINC000894095820 636111659 /nfs/dbraw/zinc/11/16/59/636111659.db2.gz SNWYWWLEGZNEKK-QMTHXVAHSA-N 1 2 310.344 2.161 20 10 DECDLO O=C1C[C@@H]([C@H]2CCCC[N@@H+]2Cc2cc(F)cc(F)c2O)CN1 ZINC000894095820 636111661 /nfs/dbraw/zinc/11/16/61/636111661.db2.gz SNWYWWLEGZNEKK-QMTHXVAHSA-N 1 2 310.344 2.161 20 10 DECDLO CO[C@@H]1CC[C@H]2OCC[N@H+](Cc3cc(F)cc(F)c3O)[C@@H]2C1 ZINC000894096751 636113069 /nfs/dbraw/zinc/11/30/69/636113069.db2.gz ZOQYGRIGEWIXQF-BPLDGKMQSA-N 1 2 313.344 2.439 20 10 DECDLO CO[C@@H]1CC[C@H]2OCC[N@@H+](Cc3cc(F)cc(F)c3O)[C@@H]2C1 ZINC000894096751 636113071 /nfs/dbraw/zinc/11/30/71/636113071.db2.gz ZOQYGRIGEWIXQF-BPLDGKMQSA-N 1 2 313.344 2.439 20 10 DECDLO OC[C@@H]1CSCC[N@@H+]1Cc1cccc(Br)c1O ZINC000877780438 636425897 /nfs/dbraw/zinc/42/58/97/636425897.db2.gz QRNQDSMHQHWKHZ-SNVBAGLBSA-N 1 2 318.236 2.064 20 10 DECDLO OC[C@@H]1CSCC[N@H+]1Cc1cccc(Br)c1O ZINC000877780438 636425900 /nfs/dbraw/zinc/42/59/00/636425900.db2.gz QRNQDSMHQHWKHZ-SNVBAGLBSA-N 1 2 318.236 2.064 20 10 DECDLO C[C@@H](CCO)[N@H+](C)Cc1cc(Br)cc(F)c1O ZINC000895149989 637671729 /nfs/dbraw/zinc/67/17/29/637671729.db2.gz VKNYOTDZWOLTQO-QMMMGPOBSA-N 1 2 306.175 2.497 20 10 DECDLO C[C@@H](CCO)[N@@H+](C)Cc1cc(Br)cc(F)c1O ZINC000895149989 637671733 /nfs/dbraw/zinc/67/17/33/637671733.db2.gz VKNYOTDZWOLTQO-QMMMGPOBSA-N 1 2 306.175 2.497 20 10 DECDLO COC(=O)c1ccc(O)c([C@@H](C)[NH2+][C@@H](C)c2csnn2)c1 ZINC000840885248 650371011 /nfs/dbraw/zinc/37/10/11/650371011.db2.gz AIDOKDUKETVEHO-BDAKNGLRSA-N 1 2 307.375 2.442 20 10 DECDLO CC(C)(CC[NH2+]Cc1cccc(Cl)c1O)S(C)(=O)=O ZINC000840960875 650395250 /nfs/dbraw/zinc/39/52/50/650395250.db2.gz WYJAIHRQVUOZAE-UHFFFAOYSA-N 1 2 305.827 2.349 20 10 DECDLO COC(=O)N[C@H]1CC[N@H+](Cc2c(O)ccc(Cl)c2F)C1 ZINC000895848161 638232234 /nfs/dbraw/zinc/23/22/34/638232234.db2.gz LTYAQEZLOQJPIO-QMMMGPOBSA-N 1 2 302.733 2.115 20 10 DECDLO COC(=O)N[C@H]1CC[N@@H+](Cc2c(O)ccc(Cl)c2F)C1 ZINC000895848161 638232238 /nfs/dbraw/zinc/23/22/38/638232238.db2.gz LTYAQEZLOQJPIO-QMMMGPOBSA-N 1 2 302.733 2.115 20 10 DECDLO Oc1c(F)cc(F)cc1C[NH+]1CCC2(CC1)C[C@H](O)CCO2 ZINC000897257072 639288443 /nfs/dbraw/zinc/28/84/43/639288443.db2.gz HUBGLEYKYVIFRG-CYBMUJFWSA-N 1 2 313.344 2.176 20 10 DECDLO CCNC(=O)C(C)(C)C[NH2+][C@H](C)c1cc(F)cc(F)c1O ZINC000756856767 639705102 /nfs/dbraw/zinc/70/51/02/639705102.db2.gz LKQUGFMWZWWDRY-SECBINFHSA-N 1 2 300.349 2.483 20 10 DECDLO C[C@@H]1C[N@H+](Cc2cc(Br)cc(F)c2O)C[C@@H]1O ZINC000897675785 640898562 /nfs/dbraw/zinc/89/85/62/640898562.db2.gz CAGVVBWZNXSKGU-HQJQHLMTSA-N 1 2 304.159 2.106 20 10 DECDLO C[C@@H]1C[N@@H+](Cc2cc(Br)cc(F)c2O)C[C@@H]1O ZINC000897675785 640898566 /nfs/dbraw/zinc/89/85/66/640898566.db2.gz CAGVVBWZNXSKGU-HQJQHLMTSA-N 1 2 304.159 2.106 20 10 DECDLO COc1ccc(O)c([C@@H](C)Nc2nc(N(C)C)nc(C)[nH+]2)c1 ZINC000768522924 641092501 /nfs/dbraw/zinc/09/25/01/641092501.db2.gz CRWLRIDEJRIWGK-SECBINFHSA-N 1 2 303.366 2.133 20 10 DECDLO COc1c(O)c(C[N@@H+]2C[C@H](C)O[C@@H](C)[C@@H]2C)ccc1[N+](=O)[O-] ZINC000775097978 642006665 /nfs/dbraw/zinc/00/66/65/642006665.db2.gz MZYHPYDOKTVONP-DCAQKATOSA-N 1 2 310.350 2.307 20 10 DECDLO COc1c(O)c(C[N@H+]2C[C@H](C)O[C@@H](C)[C@@H]2C)ccc1[N+](=O)[O-] ZINC000775097978 642006669 /nfs/dbraw/zinc/00/66/69/642006669.db2.gz MZYHPYDOKTVONP-DCAQKATOSA-N 1 2 310.350 2.307 20 10 DECDLO Oc1ccccc1C[N@@H+]1CCO[C@H](c2noc(C3CC3)n2)C1 ZINC000779005163 642454474 /nfs/dbraw/zinc/45/44/74/642454474.db2.gz GJSVWIZOPRYQIY-AWEZNQCLSA-N 1 2 301.346 2.226 20 10 DECDLO Oc1ccccc1C[N@H+]1CCO[C@H](c2noc(C3CC3)n2)C1 ZINC000779005163 642454478 /nfs/dbraw/zinc/45/44/78/642454478.db2.gz GJSVWIZOPRYQIY-AWEZNQCLSA-N 1 2 301.346 2.226 20 10 DECDLO C[C@H](C(=O)OCC(=O)c1ccc(O)c(O)c1)[N@H+]1[C@H](C)CC[C@@H]1C ZINC000783781566 643052305 /nfs/dbraw/zinc/05/23/05/643052305.db2.gz YRFSNEZUZKYBRD-GRYCIOLGSA-N 1 2 321.373 2.085 20 10 DECDLO C[C@H](C(=O)OCC(=O)c1ccc(O)c(O)c1)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000783781566 643052312 /nfs/dbraw/zinc/05/23/12/643052312.db2.gz YRFSNEZUZKYBRD-GRYCIOLGSA-N 1 2 321.373 2.085 20 10 DECDLO COC[C@H]1COCC[N@@H+]1Cc1cc(C(C)(C)C)cc(O)c1O ZINC000902564145 643070498 /nfs/dbraw/zinc/07/04/98/643070498.db2.gz OLLYHCJLPIRXIP-AWEZNQCLSA-N 1 2 309.406 2.243 20 10 DECDLO COC[C@H]1COCC[N@H+]1Cc1cc(C(C)(C)C)cc(O)c1O ZINC000902564145 643070502 /nfs/dbraw/zinc/07/05/02/643070502.db2.gz OLLYHCJLPIRXIP-AWEZNQCLSA-N 1 2 309.406 2.243 20 10 DECDLO COC(=O)c1cc(OCc2ccc(N)[nH+]c2)ccc1N(C)C ZINC000902616818 643086433 /nfs/dbraw/zinc/08/64/33/643086433.db2.gz HBBVGHNZXCFUSI-UHFFFAOYSA-N 1 2 301.346 2.095 20 10 DECDLO C[C@@H](NC(=O)[C@H]1CCc2[nH+]ccn2C1)c1ccc(N(C)C)cc1 ZINC000787299543 643478682 /nfs/dbraw/zinc/47/86/82/643478682.db2.gz IZMNPVAVHAFVDO-HIFRSBDPSA-N 1 2 312.417 2.389 20 10 DECDLO NC(=O)[C@@H]1[C@H]2CCC[C@@H]2C[N@@H+]1Cc1cc(Cl)cc(F)c1O ZINC000787422521 643493758 /nfs/dbraw/zinc/49/37/58/643493758.db2.gz DZYZZDFSURRUIY-WLTAIBSBSA-N 1 2 312.772 2.271 20 10 DECDLO NC(=O)[C@@H]1[C@H]2CCC[C@@H]2C[N@H+]1Cc1cc(Cl)cc(F)c1O ZINC000787422521 643493761 /nfs/dbraw/zinc/49/37/61/643493761.db2.gz DZYZZDFSURRUIY-WLTAIBSBSA-N 1 2 312.772 2.271 20 10 DECDLO CCOC(=O)[C@H]([NH2+]Cc1cc(C)ccc1O)[C@@H]1CCCOC1 ZINC000789578207 643750402 /nfs/dbraw/zinc/75/04/02/643750402.db2.gz BVIFEXRSYGSKBY-CZUORRHYSA-N 1 2 307.390 2.149 20 10 DECDLO C[N@H+](CCN1CCCC1=O)Cc1c(O)ccc(Cl)c1F ZINC000792167417 644082346 /nfs/dbraw/zinc/08/23/46/644082346.db2.gz INKXLCYLSZLWPE-UHFFFAOYSA-N 1 2 300.761 2.239 20 10 DECDLO C[N@@H+](CCN1CCCC1=O)Cc1c(O)ccc(Cl)c1F ZINC000792167417 644082351 /nfs/dbraw/zinc/08/23/51/644082351.db2.gz INKXLCYLSZLWPE-UHFFFAOYSA-N 1 2 300.761 2.239 20 10 DECDLO CCC[N@@H+]1CCC[C@H]1CNCc1ccc([N+](=O)[O-])c(OC)c1O ZINC000809715167 646267001 /nfs/dbraw/zinc/26/70/01/646267001.db2.gz BVZDXIWKJKUBMY-ZDUSSCGKSA-N 1 2 323.393 2.273 20 10 DECDLO CCC[N@H+]1CCC[C@H]1CNCc1ccc([N+](=O)[O-])c(OC)c1O ZINC000809715167 646267010 /nfs/dbraw/zinc/26/70/10/646267010.db2.gz BVZDXIWKJKUBMY-ZDUSSCGKSA-N 1 2 323.393 2.273 20 10 DECDLO CNC(=O)[C@H](CCSC)[NH2+]Cc1cc(Cl)cc(F)c1O ZINC000809785437 646283577 /nfs/dbraw/zinc/28/35/77/646283577.db2.gz WMCLMQQJAYLMHX-NSHDSACASA-N 1 2 320.817 2.142 20 10 DECDLO C[C@@H](C[S@@](C)=O)[NH2+]Cc1cccc(Br)c1O ZINC000164282284 646433012 /nfs/dbraw/zinc/43/30/12/646433012.db2.gz ZBAHMCYOKNRSJR-PWJLMRLQSA-N 1 2 306.225 2.011 20 10 DECDLO CC(=O)N1CCC([NH2+]Cc2cc(Cl)c(F)cc2O)CC1 ZINC000816530691 647148053 /nfs/dbraw/zinc/14/80/53/647148053.db2.gz QVPHIBARMRRGCV-UHFFFAOYSA-N 1 2 300.761 2.285 20 10 DECDLO C[C@H]([NH2+]C[C@@H]1C[NH2+]CCO1)c1ccc(Cl)c(Cl)c1[O-] ZINC000817984159 647400909 /nfs/dbraw/zinc/40/09/09/647400909.db2.gz VMGVCGPQSBAFRY-IUCAKERBSA-N 1 2 305.205 2.338 20 10 DECDLO COc1c(O)c(C[N@@H+]2C[C@@H](C)OCC23CCC3)ccc1[N+](=O)[O-] ZINC000846067392 651306095 /nfs/dbraw/zinc/30/60/95/651306095.db2.gz RHDUJLFAWYKEJE-LLVKDONJSA-N 1 2 322.361 2.452 20 10 DECDLO COc1c(O)c(C[N@H+]2C[C@@H](C)OCC23CCC3)ccc1[N+](=O)[O-] ZINC000846067392 651306096 /nfs/dbraw/zinc/30/60/96/651306096.db2.gz RHDUJLFAWYKEJE-LLVKDONJSA-N 1 2 322.361 2.452 20 10 DECDLO C[C@H]([NH2+]C[C@H]1CC(=O)N(C2CC2)C1)c1cc(F)cc(F)c1O ZINC000846205708 651315104 /nfs/dbraw/zinc/31/51/04/651315104.db2.gz KGQRQIZTKHHCDK-VHSXEESVSA-N 1 2 310.344 2.332 20 10 DECDLO O=C(Cc1cn2c([nH+]1)CCCC2)NCc1cc(Cl)ccc1O ZINC000846476774 651332770 /nfs/dbraw/zinc/33/27/70/651332770.db2.gz OQBOHFHHPKZTAM-UHFFFAOYSA-N 1 2 319.792 2.437 20 10 DECDLO CC[C@@H]1C(=O)NCC[N@H+]1Cc1cc(C(C)(C)C)cc(O)c1O ZINC000106854977 651395513 /nfs/dbraw/zinc/39/55/13/651395513.db2.gz LGYRHGWHHKNSDP-CYBMUJFWSA-N 1 2 306.406 2.106 20 10 DECDLO CC[C@@H]1C(=O)NCC[N@@H+]1Cc1cc(C(C)(C)C)cc(O)c1O ZINC000106854977 651395514 /nfs/dbraw/zinc/39/55/14/651395514.db2.gz LGYRHGWHHKNSDP-CYBMUJFWSA-N 1 2 306.406 2.106 20 10 DECDLO CO[C@H](C[NH2+][C@@H](C)c1cc(F)cc(F)c1O)[C@H]1CCOC1 ZINC000850484923 651936771 /nfs/dbraw/zinc/93/67/71/651936771.db2.gz ULDMSLVZKDBLKC-PKFCDNJMSA-N 1 2 301.333 2.373 20 10 DECDLO COc1cccc(O)c1C[N@@H+]1Cc2ccccc2N(C)C(=O)C1 ZINC000857881543 652195196 /nfs/dbraw/zinc/19/51/96/652195196.db2.gz WHJDTXRAZBYHBN-UHFFFAOYSA-N 1 2 312.369 2.379 20 10 DECDLO COc1cccc(O)c1C[N@H+]1Cc2ccccc2N(C)C(=O)C1 ZINC000857881543 652195198 /nfs/dbraw/zinc/19/51/98/652195198.db2.gz WHJDTXRAZBYHBN-UHFFFAOYSA-N 1 2 312.369 2.379 20 10 DECDLO CS(=O)(=O)CC1CC[NH+](Cc2cc(Cl)ccc2O)CC1 ZINC000380554393 685397143 /nfs/dbraw/zinc/39/71/43/685397143.db2.gz YEIQOXRFEBMRAR-UHFFFAOYSA-N 1 2 317.838 2.302 20 10 DECDLO C[S@](=O)CCC[NH2+]Cc1cccc(Br)c1O ZINC000116918456 684066791 /nfs/dbraw/zinc/06/67/91/684066791.db2.gz YDPLBEALWRAWLA-MRXNPFEDSA-N 1 2 306.225 2.013 20 10 DECDLO CC[S@@](=O)CC[NH2+]Cc1cccc(Br)c1O ZINC000124136203 684132306 /nfs/dbraw/zinc/13/23/06/684132306.db2.gz YQFCNVNMWBAQSY-INIZCTEOSA-N 1 2 306.225 2.013 20 10 DECDLO O=C(NCc1ccc2cccnc2c1O)[C@@H]1CCn2c[nH+]cc2C1 ZINC000862027021 686225739 /nfs/dbraw/zinc/22/57/39/686225739.db2.gz GZNXFNJHQJRMCR-CYBMUJFWSA-N 1 2 322.368 2.016 20 10 DECDLO C[C@@H]([NH2+][C@H]1CCN(CC(C)(C)O)C1)c1cc(F)cc(F)c1O ZINC000866414079 687565822 /nfs/dbraw/zinc/56/58/22/687565822.db2.gz ZJSDTNSRUPPVDP-PWSUYJOCSA-N 1 2 314.376 2.166 20 10 DECDLO O=C1CCCN1C1CC[NH+](Cc2ccc(F)c(F)c2O)CC1 ZINC000876690959 689904298 /nfs/dbraw/zinc/90/42/98/689904298.db2.gz WBIAKBQFPWYAIO-UHFFFAOYSA-N 1 2 310.344 2.257 20 10 DECDLO C[C@@H](C(=O)NC(C)(C)C)[N@H+](C)Cc1ccc(F)c(F)c1O ZINC000877424763 690108308 /nfs/dbraw/zinc/10/83/08/690108308.db2.gz OXKIVWSQQRNBSD-VIFPVBQESA-N 1 2 300.349 2.405 20 10 DECDLO C[C@@H](C(=O)NC(C)(C)C)[N@@H+](C)Cc1ccc(F)c(F)c1O ZINC000877424763 690108310 /nfs/dbraw/zinc/10/83/10/690108310.db2.gz OXKIVWSQQRNBSD-VIFPVBQESA-N 1 2 300.349 2.405 20 10 DECDLO CCOC(=O)[C@H]([NH2+]Cc1ccc(C)cc1O)[C@@H]1CCCOC1 ZINC000877468209 690122381 /nfs/dbraw/zinc/12/23/81/690122381.db2.gz BOEPUBDQLHWSQL-GDBMZVCRSA-N 1 2 307.390 2.149 20 10 DECDLO C[C@@H]1C[N@H+](Cc2ccc(F)c(F)c2O)CC2(CCOCC2)O1 ZINC000877487493 690128858 /nfs/dbraw/zinc/12/88/58/690128858.db2.gz WYEUALBUIRYMDN-LLVKDONJSA-N 1 2 313.344 2.440 20 10 DECDLO C[C@@H]1C[N@@H+](Cc2ccc(F)c(F)c2O)CC2(CCOCC2)O1 ZINC000877487493 690128861 /nfs/dbraw/zinc/12/88/61/690128861.db2.gz WYEUALBUIRYMDN-LLVKDONJSA-N 1 2 313.344 2.440 20 10 DECDLO Oc1ccc(Br)cc1CN1CC[NH2+]CC(F)(F)C1 ZINC001210813984 776956860 /nfs/dbraw/zinc/95/68/60/776956860.db2.gz ACNHHFMGLLVCMX-UHFFFAOYSA-N 1 2 321.165 2.195 20 10 DECDLO C[C@@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)Cn1cc[nH+]c1 ZINC001136892980 790518394 /nfs/dbraw/zinc/51/83/94/790518394.db2.gz MGASEXMJNWAWEV-NSHDSACASA-N 1 2 314.349 2.112 20 10 DECDLO C[C@@H]1C[N@H+](Cc2cc(Br)c(F)cc2O)CC[C@@H]1O ZINC001144298956 790848768 /nfs/dbraw/zinc/84/87/68/790848768.db2.gz MRNGUPNSIFSCKV-PELKAZGASA-N 1 2 318.186 2.497 20 10 DECDLO C[C@@H]1C[N@@H+](Cc2cc(Br)c(F)cc2O)CC[C@@H]1O ZINC001144298956 790848780 /nfs/dbraw/zinc/84/87/80/790848780.db2.gz MRNGUPNSIFSCKV-PELKAZGASA-N 1 2 318.186 2.497 20 10 DECDLO NC(=O)N=Nc1ccc(C(=O)N[C@@H]2CCC[N@H+](CCF)C2)cc1 ZINC001009677098 785504373 /nfs/dbraw/zinc/50/43/73/785504373.db2.gz VMUWOLKQOSCORC-CYBMUJFWSA-N 1 2 321.356 2.013 20 10 DECDLO NC(=O)N=Nc1ccc(C(=O)N[C@@H]2CCC[N@@H+](CCF)C2)cc1 ZINC001009677098 785504380 /nfs/dbraw/zinc/50/43/80/785504380.db2.gz VMUWOLKQOSCORC-CYBMUJFWSA-N 1 2 321.356 2.013 20 10 DECDLO CN1CC[C@@H]([NH2+]Cc2cc(Br)cc(F)c2O)C1 ZINC000715759361 792511274 /nfs/dbraw/zinc/51/12/74/792511274.db2.gz MISMYMSPVZFZGM-SNVBAGLBSA-N 1 2 303.175 2.088 20 10 DECDLO CCN(CC)c1ccc(C[N@@H+]2CCO[C@H](COC)C2)c(OC)c1 ZINC001138390107 796211289 /nfs/dbraw/zinc/21/12/89/796211289.db2.gz NWBDYJOYKGMGPF-KRWDZBQOSA-N 1 2 322.449 2.389 20 10 DECDLO CCN(CC)c1ccc(C[N@H+]2CCO[C@H](COC)C2)c(OC)c1 ZINC001138390107 796211291 /nfs/dbraw/zinc/21/12/91/796211291.db2.gz NWBDYJOYKGMGPF-KRWDZBQOSA-N 1 2 322.449 2.389 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CC[C@@H]2COC[C@@H]2C1 ZINC001139125050 796326493 /nfs/dbraw/zinc/32/64/93/796326493.db2.gz JXMYOLDVJKFOOZ-OLZOCXBDSA-N 1 2 315.369 2.275 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CC[C@@H]2COC[C@@H]2C1 ZINC001139125050 796326496 /nfs/dbraw/zinc/32/64/96/796326496.db2.gz JXMYOLDVJKFOOZ-OLZOCXBDSA-N 1 2 315.369 2.275 20 10 DECDLO Cc1ccc(C)n1-c1ccc(O)c(C(=O)N2CC[NH+](C)CC2)c1 ZINC001186830512 796449246 /nfs/dbraw/zinc/44/92/46/796449246.db2.gz RUENZIQKUIAVPO-UHFFFAOYSA-N 1 2 313.401 2.187 20 10 DECDLO CN(C)c1ccc(C[N@@H+]2CCO[C@@H]3C[C@H](CO)C[C@@H]32)c(Cl)c1 ZINC001140922270 796597506 /nfs/dbraw/zinc/59/75/06/796597506.db2.gz MKSQWWAUVXYTNE-OAUYIBNBSA-N 1 2 324.852 2.378 20 10 DECDLO CN(C)c1ccc(C[N@H+]2CCO[C@@H]3C[C@H](CO)C[C@@H]32)c(Cl)c1 ZINC001140922270 796597507 /nfs/dbraw/zinc/59/75/07/796597507.db2.gz MKSQWWAUVXYTNE-OAUYIBNBSA-N 1 2 324.852 2.378 20 10 DECDLO COc1cc(O)c(C[N@@H+]2CC[C@H]3CC[C@@H](C2)N3C)c(OC)c1 ZINC001141030770 796620943 /nfs/dbraw/zinc/62/09/43/796620943.db2.gz KKUAHDBPVJJTLQ-OLZOCXBDSA-N 1 2 306.406 2.078 20 10 DECDLO COc1cc(O)c(C[N@H+]2CC[C@H]3CC[C@@H](C2)N3C)c(OC)c1 ZINC001141030770 796620945 /nfs/dbraw/zinc/62/09/45/796620945.db2.gz KKUAHDBPVJJTLQ-OLZOCXBDSA-N 1 2 306.406 2.078 20 10 DECDLO CC(C)(C)OC(=O)NC[C@H]1COCC[N@@H+]1Cc1ccccc1O ZINC001203558514 800081279 /nfs/dbraw/zinc/08/12/79/800081279.db2.gz LMLNOYKBUBKERI-AWEZNQCLSA-N 1 2 322.405 2.118 20 10 DECDLO CC(C)(C)OC(=O)NC[C@H]1COCC[N@H+]1Cc1ccccc1O ZINC001203558514 800081282 /nfs/dbraw/zinc/08/12/82/800081282.db2.gz LMLNOYKBUBKERI-AWEZNQCLSA-N 1 2 322.405 2.118 20 10 DECDLO Oc1ccc(C[N@@H+]2CCO[C@H]3[C@H](OCC4CC4)CC[C@@H]32)cc1O ZINC001203876770 800138261 /nfs/dbraw/zinc/13/82/61/800138261.db2.gz IWLQMVCYHKSRIL-BMGDILEWSA-N 1 2 319.401 2.256 20 10 DECDLO Oc1ccc(C[N@H+]2CCO[C@H]3[C@H](OCC4CC4)CC[C@@H]32)cc1O ZINC001203876770 800138268 /nfs/dbraw/zinc/13/82/68/800138268.db2.gz IWLQMVCYHKSRIL-BMGDILEWSA-N 1 2 319.401 2.256 20 10 DECDLO COc1cc(C)cc(C[N@@H+]2CCN(CC(C)C)C(=O)[C@@H]2C)c1O ZINC001205489164 800363579 /nfs/dbraw/zinc/36/35/79/800363579.db2.gz LHAUCJMNPYWRAJ-AWEZNQCLSA-N 1 2 320.433 2.398 20 10 DECDLO COc1cc(C)cc(C[N@H+]2CCN(CC(C)C)C(=O)[C@@H]2C)c1O ZINC001205489164 800363586 /nfs/dbraw/zinc/36/35/86/800363586.db2.gz LHAUCJMNPYWRAJ-AWEZNQCLSA-N 1 2 320.433 2.398 20 10 DECDLO COc1cc(O)c(C[N@H+]2CCO[C@]3(CCOC3)C2)cc1Cl ZINC001232266675 801833541 /nfs/dbraw/zinc/83/35/41/801833541.db2.gz QYPHELGSSOSQEC-OAHLLOKOSA-N 1 2 313.781 2.046 20 10 DECDLO Cc1cccc(N2CC[NH+](Cc3cc(O)c(O)c(O)c3)CC2)c1 ZINC001233010127 802000936 /nfs/dbraw/zinc/00/09/36/802000936.db2.gz LKNKIOYCHRWNKL-UHFFFAOYSA-N 1 2 314.385 2.434 20 10 DECDLO COc1cc(Cl)cc(C[N@@H+]2C[C@H](F)C[C@@H](CO)C2)c1O ZINC001233287943 802064784 /nfs/dbraw/zinc/06/47/84/802064784.db2.gz OJOBIYOQFKXEQY-BXKDBHETSA-N 1 2 303.761 2.207 20 10 DECDLO COc1cc(Cl)cc(C[N@H+]2C[C@H](F)C[C@@H](CO)C2)c1O ZINC001233287943 802064791 /nfs/dbraw/zinc/06/47/91/802064791.db2.gz OJOBIYOQFKXEQY-BXKDBHETSA-N 1 2 303.761 2.207 20 10 DECDLO Cc1cnc(N2CC[NH+](Cc3c(O)ccc(F)c3F)CC2)nc1 ZINC001233336639 802080683 /nfs/dbraw/zinc/08/06/83/802080683.db2.gz UHHJIPGJUQBANC-UHFFFAOYSA-N 1 2 320.343 2.091 20 10 DECDLO CN(C)c1ccc([C@H]([NH3+])C[NH2+]Cc2cccc(C(=O)[O-])c2)cc1 ZINC001598314591 991300390 /nfs/dbraw/zinc/30/03/90/991300390.db2.gz ZCDUCPHZCUFVBY-QGZVFWFLSA-N 1 2 313.401 2.240 20 10 DECDLO CCC[C@](C)(O)C[NH2+][C@@H](CC)c1cccc(-c2nn[nH]n2)c1O ZINC001604127744 1070235458 /nfs/dbraw/zinc/23/54/58/1070235458.db2.gz FNSLFNREGQQICC-BBRMVZONSA-N 1 2 319.409 2.164 20 10 DECDLO CCc1cccc(C[N@H+](C)[C@H](COC2CCC2)C(=O)OC)c1O ZINC001461860272 1058724417 /nfs/dbraw/zinc/72/44/17/1058724417.db2.gz FOZIRLPPYPSPBL-MRXNPFEDSA-N 1 2 321.417 2.497 20 10 DECDLO CCc1cccc(C[N@@H+](C)[C@H](COC2CCC2)C(=O)OC)c1O ZINC001461860272 1058724437 /nfs/dbraw/zinc/72/44/37/1058724437.db2.gz FOZIRLPPYPSPBL-MRXNPFEDSA-N 1 2 321.417 2.497 20 10 DECDLO CC(=O)c1cn(C2C[NH+](Cc3cc(C(C)C)ccc3O)C2)nn1 ZINC001462660059 1058872995 /nfs/dbraw/zinc/87/29/95/1058872995.db2.gz NMAWQTQUHIIBNG-UHFFFAOYSA-N 1 2 314.389 2.367 20 10 DECDLO CN(Cc1ccc(N2CCCC2)cc1)C(=O)C[C@@H]([NH3+])C(F)F ZINC001578489738 1067118141 /nfs/dbraw/zinc/11/81/41/1067118141.db2.gz IVDZTFRAPWGFKB-CQSZACIVSA-N 1 2 311.376 2.228 20 10 DECDLO O=C(NCc1cc(O)ccc1O)c1ccc(Cn2cc[nH+]c2)cc1 ZINC001643879265 1078818142 /nfs/dbraw/zinc/81/81/42/1078818142.db2.gz IMEIADLFIMWOCJ-UHFFFAOYSA-N 1 2 323.352 2.273 20 10 DECDLO C[C@H]([NH2+]C[C@@H]1CCC[C@@H](C)O1)c1cccc(-c2nn[nH]n2)c1O ZINC001590244330 1076597085 /nfs/dbraw/zinc/59/70/85/1076597085.db2.gz TWANHOJGNSUIMK-WOPDTQHZSA-N 1 2 317.393 2.181 20 10 DECDLO CCOC[C@H]([NH2+][C@@H](C)c1cccc(-c2nn[nH]n2)c1O)C(C)C ZINC001590800446 1076678940 /nfs/dbraw/zinc/67/89/40/1076678940.db2.gz POGYWMYQTIWTSU-FZMZJTMJSA-N 1 2 319.409 2.284 20 10 DECDLO CCOCCCC[NH2+][C@H](CC)c1cccc(-c2nn[nH]n2)c1O ZINC001590811228 1076680294 /nfs/dbraw/zinc/68/02/94/1076680294.db2.gz RJCBNISZRTYXRS-CQSZACIVSA-N 1 2 319.409 2.430 20 10 DECDLO Cc1cccnc1CC[NH2+][C@@H](C)c1cccc(-c2nn[nH]n2)c1O ZINC001592263001 1076885260 /nfs/dbraw/zinc/88/52/60/1076885260.db2.gz JLUUPHXKJQKUML-LBPRGKRZSA-N 1 2 324.388 2.169 20 10 DECDLO COc1cc(O)c(C[N@H+]2C[C@H](F)C[C@H](CO)C2)c(Cl)c1 ZINC001236797280 1079942643 /nfs/dbraw/zinc/94/26/43/1079942643.db2.gz DMRJIVLDWFZWNV-VHSXEESVSA-N 1 2 303.761 2.207 20 10 DECDLO O=C1OCCN1CCC[NH2+]Cc1cc(Cl)cc(F)c1O ZINC001657080304 1080153440 /nfs/dbraw/zinc/15/34/40/1080153440.db2.gz QHVIWQZIORIFHN-UHFFFAOYSA-N 1 2 302.733 2.117 20 10 DECDLO CCS(=O)(=O)C[C@@H](C)[NH2+]Cc1cc(Cl)cc(F)c1O ZINC001657210321 1080164182 /nfs/dbraw/zinc/16/41/82/1080164182.db2.gz BDPMEMUWUANSGS-MRVPVSSYSA-N 1 2 309.790 2.098 20 10 DECDLO Cc1cc(N(C)C)ccc1C[NH2+]Cc1nc(C(F)(F)F)n[nH]1 ZINC001660956123 1080418280 /nfs/dbraw/zinc/41/82/80/1080418280.db2.gz GCMIUHCVGKPXTQ-UHFFFAOYSA-N 1 2 313.327 2.488 20 10 DECDLO Oc1cccc(F)c1C[N@H+]1C[C@@H]2[C@H](C1)OCCN2C1CCCC1 ZINC001276359456 1089242489 /nfs/dbraw/zinc/24/24/89/1089242489.db2.gz IHIIIJZBECCZLH-AEFFLSMTSA-N 1 2 320.408 2.359 20 10 DECDLO Oc1cccc(F)c1C[N@@H+]1C[C@@H]2[C@H](C1)OCCN2C1CCCC1 ZINC001276359456 1089242508 /nfs/dbraw/zinc/24/25/08/1089242508.db2.gz IHIIIJZBECCZLH-AEFFLSMTSA-N 1 2 320.408 2.359 20 10 DECDLO Oc1cccc(F)c1CN1C[C@@H]2[C@H](C1)OCC[N@@H+]2C1CCCC1 ZINC001276359456 1089242518 /nfs/dbraw/zinc/24/25/18/1089242518.db2.gz IHIIIJZBECCZLH-AEFFLSMTSA-N 1 2 320.408 2.359 20 10 DECDLO Oc1cccc(F)c1CN1C[C@@H]2[C@H](C1)OCC[N@H+]2C1CCCC1 ZINC001276359456 1089242532 /nfs/dbraw/zinc/24/25/32/1089242532.db2.gz IHIIIJZBECCZLH-AEFFLSMTSA-N 1 2 320.408 2.359 20 10 DECDLO O=C1CC[N@@H+](Cc2cc(Cl)cc(F)c2O)C[C@@H]2CCCN12 ZINC001237624272 1138721075 /nfs/dbraw/zinc/72/10/75/1138721075.db2.gz ROSXBBMHICSQIQ-LBPRGKRZSA-N 1 2 312.772 2.381 20 10 DECDLO O=C1CC[N@H+](Cc2cc(Cl)cc(F)c2O)C[C@@H]2CCCN12 ZINC001237624272 1138721083 /nfs/dbraw/zinc/72/10/83/1138721083.db2.gz ROSXBBMHICSQIQ-LBPRGKRZSA-N 1 2 312.772 2.381 20 10 DECDLO Nc1ncc(C[N@@H+]2CCc3cccc(O)c3C2)c(C(F)(F)F)n1 ZINC001249395717 1141881263 /nfs/dbraw/zinc/88/12/63/1141881263.db2.gz RQMNCKUGASLWAE-UHFFFAOYSA-N 1 2 324.306 2.342 20 10 DECDLO Nc1ncc(C[N@H+]2CCc3cccc(O)c3C2)c(C(F)(F)F)n1 ZINC001249395717 1141881265 /nfs/dbraw/zinc/88/12/65/1141881265.db2.gz RQMNCKUGASLWAE-UHFFFAOYSA-N 1 2 324.306 2.342 20 10 DECDLO COC(=O)[C@H](Cc1ccc(O)c(O)c1)[NH2+][C@H]1CCC[C@H](C)C1 ZINC001258806747 1144042682 /nfs/dbraw/zinc/04/26/82/1144042682.db2.gz BKJXDHROJVTYLU-UBHSHLNASA-N 1 2 307.390 2.350 20 10 DECDLO Oc1cc2c(cc1C[N@@H+]1CCC[C@H](c3ccn[nH]3)C1)OCO2 ZINC000121272172 402024806 /nfs/dbraw/zinc/02/48/06/402024806.db2.gz VTWOZWUXWKDXKR-NSHDSACASA-N 1 2 301.346 2.224 20 10 DECDLO Oc1cc2c(cc1C[N@H+]1CCC[C@H](c3ccn[nH]3)C1)OCO2 ZINC000121272172 402024810 /nfs/dbraw/zinc/02/48/10/402024810.db2.gz VTWOZWUXWKDXKR-NSHDSACASA-N 1 2 301.346 2.224 20 10 DECDLO CN1CCCc2cc(CNC(=O)[C@H]3CCn4cc[nH+]c4C3)ccc21 ZINC000161005500 402368728 /nfs/dbraw/zinc/36/87/28/402368728.db2.gz VPCJVDNQAVZDSI-INIZCTEOSA-N 1 2 324.428 2.144 20 10 DECDLO Cc1ccc(C(=O)N2CCC(c3[nH]cc[nH+]3)CC2)c(O)c1O ZINC000271299861 402855145 /nfs/dbraw/zinc/85/51/45/402855145.db2.gz SCIUBYGNEMMRAS-UHFFFAOYSA-N 1 2 301.346 2.149 20 10 DECDLO COC[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])c(OC)c1O)c1ccco1 ZINC000278553070 402867814 /nfs/dbraw/zinc/86/78/14/402867814.db2.gz ZLDNPWYSBUQSNG-LLVKDONJSA-N 1 2 322.317 2.379 20 10 DECDLO COc1ccc(N2CC[NH+](Cc3cc(OC)ccn3)CC2)cc1 ZINC000264474151 402882333 /nfs/dbraw/zinc/88/23/33/402882333.db2.gz YKCORVHWURHQRR-UHFFFAOYSA-N 1 2 313.401 2.421 20 10 DECDLO COc1ccc(N2CCN(Cc3cc(OC)cc[nH+]3)CC2)cc1 ZINC000264474151 402882334 /nfs/dbraw/zinc/88/23/34/402882334.db2.gz YKCORVHWURHQRR-UHFFFAOYSA-N 1 2 313.401 2.421 20 10 DECDLO CS(=O)(=O)[C@H]1CCC[N@H+](Cc2cccc(Cl)c2O)C1 ZINC000274132613 403029574 /nfs/dbraw/zinc/02/95/74/403029574.db2.gz PMDQZFFIRFZLQQ-NSHDSACASA-N 1 2 303.811 2.055 20 10 DECDLO CS(=O)(=O)[C@H]1CCC[N@@H+](Cc2cccc(Cl)c2O)C1 ZINC000274132613 403029576 /nfs/dbraw/zinc/02/95/76/403029576.db2.gz PMDQZFFIRFZLQQ-NSHDSACASA-N 1 2 303.811 2.055 20 10 DECDLO COC(=O)[C@H]1C[C@H](C)CC[N@@H+]1Cc1cc(OC)c(OC)cc1O ZINC000274951285 403098674 /nfs/dbraw/zinc/09/86/74/403098674.db2.gz SKRHPWIVGWYUTC-DGCLKSJQSA-N 1 2 323.389 2.183 20 10 DECDLO COC(=O)[C@H]1C[C@H](C)CC[N@H+]1Cc1cc(OC)c(OC)cc1O ZINC000274951285 403098677 /nfs/dbraw/zinc/09/86/77/403098677.db2.gz SKRHPWIVGWYUTC-DGCLKSJQSA-N 1 2 323.389 2.183 20 10 DECDLO CCC[NH+](CCC)c1ccc(CN[C@H](C(=O)OC)[C@@H](C)O)cc1 ZINC000276507242 403182119 /nfs/dbraw/zinc/18/21/19/403182119.db2.gz SQPLVKDTRUTGHR-PBHICJAKSA-N 1 2 322.449 2.325 20 10 DECDLO CN(C)C(=O)O[C@H]1CC[N@@H+](Cc2cc(Cl)c(F)cc2O)C1 ZINC000295069311 403749153 /nfs/dbraw/zinc/74/91/53/403749153.db2.gz HGMIATGCUPICQY-JTQLQIEISA-N 1 2 316.760 2.457 20 10 DECDLO C[C@H]([C@H](C)[N@H+](C)Cc1cc(Cl)c(F)cc1O)S(C)(=O)=O ZINC000295455601 403933324 /nfs/dbraw/zinc/93/33/24/403933324.db2.gz VLXHKJGPZCVLRK-DTWKUNHWSA-N 1 2 323.817 2.438 20 10 DECDLO C[C@H]([C@H](C)[N@@H+](C)Cc1cc(Cl)c(F)cc1O)S(C)(=O)=O ZINC000295455601 403933330 /nfs/dbraw/zinc/93/33/30/403933330.db2.gz VLXHKJGPZCVLRK-DTWKUNHWSA-N 1 2 323.817 2.438 20 10 DECDLO CCc1nnc(C[NH2+]Cc2ccc([N+](=O)[O-])c(OC)c2O)s1 ZINC000290813302 404322307 /nfs/dbraw/zinc/32/23/07/404322307.db2.gz GFHIEHMFGIOCFX-UHFFFAOYSA-N 1 2 324.362 2.013 20 10 DECDLO O=C([C@H]1CC[N@@H+](Cc2cccc(Cl)c2O)C1)N1CCCC1 ZINC000377827476 227202219 /nfs/dbraw/zinc/20/22/19/227202219.db2.gz WZUYGDIGOWYTTQ-ZDUSSCGKSA-N 1 2 308.809 2.490 20 10 DECDLO O=C([C@H]1CC[N@H+](Cc2cccc(Cl)c2O)C1)N1CCCC1 ZINC000377827476 227202223 /nfs/dbraw/zinc/20/22/23/227202223.db2.gz WZUYGDIGOWYTTQ-ZDUSSCGKSA-N 1 2 308.809 2.490 20 10 DECDLO Cc1ccc(C(=O)N2CC[C@@H](C)[C@H](n3cc[nH+]c3)C2)c(O)c1O ZINC000182606683 301514403 /nfs/dbraw/zinc/51/44/03/301514403.db2.gz ZEQPTTADWROMSR-BXUZGUMPSA-N 1 2 315.373 2.326 20 10 DECDLO CC[N@H+](C/C=C/c1ccc(N(C)C)cc1)[C@@H]1CCS(=O)(=O)C1 ZINC000835025015 649868199 /nfs/dbraw/zinc/86/81/99/649868199.db2.gz FQQRPAKGKJOROP-FUTAKVPZSA-N 1 2 322.474 2.275 20 10 DECDLO CC[N@@H+](C/C=C/c1ccc(N(C)C)cc1)[C@@H]1CCS(=O)(=O)C1 ZINC000835025015 649868202 /nfs/dbraw/zinc/86/82/02/649868202.db2.gz FQQRPAKGKJOROP-FUTAKVPZSA-N 1 2 322.474 2.275 20 10 DECDLO C[C@@H]([NH2+]Cc1nnc2n1CCCC2)c1ccc(F)c(F)c1O ZINC000187917673 525566360 /nfs/dbraw/zinc/56/63/60/525566360.db2.gz QXVDSNJNUUYCRG-SECBINFHSA-N 1 2 308.332 2.449 20 10 DECDLO OCC1CC[NH+](Cc2cc(Br)cc(F)c2O)CC1 ZINC000893920526 636065020 /nfs/dbraw/zinc/06/50/20/636065020.db2.gz BVLLTTDFMWWHDB-UHFFFAOYSA-N 1 2 318.186 2.498 20 10 DECDLO CC[C@@H]1C[N@H+](Cc2cc(Br)cc(F)c2O)C[C@@H]1O ZINC000894096794 636113264 /nfs/dbraw/zinc/11/32/64/636113264.db2.gz ZZSSJIWXXBBMMG-PELKAZGASA-N 1 2 318.186 2.497 20 10 DECDLO CC[C@@H]1C[N@@H+](Cc2cc(Br)cc(F)c2O)C[C@@H]1O ZINC000894096794 636113266 /nfs/dbraw/zinc/11/32/66/636113266.db2.gz ZZSSJIWXXBBMMG-PELKAZGASA-N 1 2 318.186 2.497 20 10 DECDLO CS(=O)(=O)[C@H]1CCCC[N@H+](Cc2cc(F)cc(F)c2O)C1 ZINC000894572946 637112012 /nfs/dbraw/zinc/11/20/12/637112012.db2.gz MHJCKHWQRJQLBU-LBPRGKRZSA-N 1 2 319.373 2.070 20 10 DECDLO CS(=O)(=O)[C@H]1CCCC[N@@H+](Cc2cc(F)cc(F)c2O)C1 ZINC000894572946 637112015 /nfs/dbraw/zinc/11/20/15/637112015.db2.gz MHJCKHWQRJQLBU-LBPRGKRZSA-N 1 2 319.373 2.070 20 10 DECDLO COC[C@H]1CC[N@@H+]1Cc1c2cc(F)ccc2n(C)c1C(=O)OC ZINC000894857685 637262821 /nfs/dbraw/zinc/26/28/21/637262821.db2.gz PBPFOXZOZFJEGH-GFCCVEGCSA-N 1 2 320.364 2.325 20 10 DECDLO COC[C@H]1CC[N@H+]1Cc1c2cc(F)ccc2n(C)c1C(=O)OC ZINC000894857685 637262822 /nfs/dbraw/zinc/26/28/22/637262822.db2.gz PBPFOXZOZFJEGH-GFCCVEGCSA-N 1 2 320.364 2.325 20 10 DECDLO CCNC(=O)N1CC[NH+](Cc2c(O)cc(C)cc2Cl)CC1 ZINC000840909557 650376374 /nfs/dbraw/zinc/37/63/74/650376374.db2.gz IQCVJWHBHHSFEH-UHFFFAOYSA-N 1 2 311.813 2.201 20 10 DECDLO CCN1CCC[C@H]([NH2+]Cc2cc(Cl)cc(F)c2O)C1=O ZINC000896733674 638656775 /nfs/dbraw/zinc/65/67/75/638656775.db2.gz MSRIPHQSCWNBBP-LBPRGKRZSA-N 1 2 300.761 2.285 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@@H+]2CCSC[C@H]2CCO)c1O ZINC000759726833 640108856 /nfs/dbraw/zinc/10/88/56/640108856.db2.gz HTBRNTXREIKZED-CYBMUJFWSA-N 1 2 313.394 2.034 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@H+]2CCSC[C@H]2CCO)c1O ZINC000759726833 640108859 /nfs/dbraw/zinc/10/88/59/640108859.db2.gz HTBRNTXREIKZED-CYBMUJFWSA-N 1 2 313.394 2.034 20 10 DECDLO CC[C@@]1(C)CC(=O)N(C[N@H+](C)Cc2ccc(N(C)C)cc2)C1=O ZINC000767961436 641036473 /nfs/dbraw/zinc/03/64/73/641036473.db2.gz CCXPHDCWTBTKDH-SFHVURJKSA-N 1 2 317.433 2.317 20 10 DECDLO CC[C@@]1(C)CC(=O)N(C[N@@H+](C)Cc2ccc(N(C)C)cc2)C1=O ZINC000767961436 641036478 /nfs/dbraw/zinc/03/64/78/641036478.db2.gz CCXPHDCWTBTKDH-SFHVURJKSA-N 1 2 317.433 2.317 20 10 DECDLO Cc1nc(N(C)C)nc(NCc2ccc(N(C)C)c(F)c2)[nH+]1 ZINC000768525919 641092716 /nfs/dbraw/zinc/09/27/16/641092716.db2.gz LCNXPHDETGJIIZ-UHFFFAOYSA-N 1 2 304.373 2.063 20 10 DECDLO CCN(C)c1ccc(C[N@@H+]2CC[C@@H](OC)C[C@@H]2C(=O)OC)cc1 ZINC000773830160 641827239 /nfs/dbraw/zinc/82/72/39/641827239.db2.gz FAHJTSJYYCFGAF-IAGOWNOFSA-N 1 2 320.433 2.295 20 10 DECDLO CCN(C)c1ccc(C[N@H+]2CC[C@@H](OC)C[C@@H]2C(=O)OC)cc1 ZINC000773830160 641827242 /nfs/dbraw/zinc/82/72/42/641827242.db2.gz FAHJTSJYYCFGAF-IAGOWNOFSA-N 1 2 320.433 2.295 20 10 DECDLO COc1c(O)c(C[N@@H+]2CCO[C@@H](C(C)C)C2)ccc1[N+](=O)[O-] ZINC000775055405 642000417 /nfs/dbraw/zinc/00/04/17/642000417.db2.gz CYFLGXNIVFGWKE-CYBMUJFWSA-N 1 2 310.350 2.166 20 10 DECDLO COc1c(O)c(C[N@H+]2CCO[C@@H](C(C)C)C2)ccc1[N+](=O)[O-] ZINC000775055405 642000418 /nfs/dbraw/zinc/00/04/18/642000418.db2.gz CYFLGXNIVFGWKE-CYBMUJFWSA-N 1 2 310.350 2.166 20 10 DECDLO Oc1c(Br)cccc1C[NH2+][C@@H]1CCn2ccnc2C1 ZINC000778188522 642350214 /nfs/dbraw/zinc/35/02/14/642350214.db2.gz HMQOJLXRQFMZRM-LLVKDONJSA-N 1 2 322.206 2.456 20 10 DECDLO O=C(N1CCCCC1)N1CC[NH+](Cc2cc(F)ccc2O)CC1 ZINC000778995410 642453517 /nfs/dbraw/zinc/45/35/17/642453517.db2.gz XYEPCTGJIQLRAX-UHFFFAOYSA-N 1 2 321.396 2.255 20 10 DECDLO O=C(NCCCSc1nccs1)[C@@H]1CCn2cc[nH+]c2C1 ZINC000156407259 646418916 /nfs/dbraw/zinc/41/89/16/646418916.db2.gz RSFTXOYEKGTNSC-LLVKDONJSA-N 1 2 322.459 2.201 20 10 DECDLO COc1ccc(N2CC[NH+](Cc3snnc3C)CC2)cc1 ZINC000821385310 648050028 /nfs/dbraw/zinc/05/00/28/648050028.db2.gz AKCWFOGFWUYIFZ-UHFFFAOYSA-N 1 2 304.419 2.177 20 10 DECDLO C[C@@H]1OCC[C@@H]1[N@H+](CCO)Cc1cc(Cl)cc(F)c1O ZINC000825129880 648708084 /nfs/dbraw/zinc/70/80/84/648708084.db2.gz HGZYEUBXJYUSIT-ZANVPECISA-N 1 2 303.761 2.156 20 10 DECDLO C[C@@H]1OCC[C@@H]1[N@@H+](CCO)Cc1cc(Cl)cc(F)c1O ZINC000825129880 648708086 /nfs/dbraw/zinc/70/80/86/648708086.db2.gz HGZYEUBXJYUSIT-ZANVPECISA-N 1 2 303.761 2.156 20 10 DECDLO C[C@@H]1C[N@H+](CCO)CCN1Cc1cc(Cl)cc(Cl)c1O ZINC000825337444 648745290 /nfs/dbraw/zinc/74/52/90/648745290.db2.gz GRNYECKLZXPZKF-SNVBAGLBSA-N 1 2 319.232 2.197 20 10 DECDLO C[C@@H]1C[N@@H+](CCO)CCN1Cc1cc(Cl)cc(Cl)c1O ZINC000825337444 648745296 /nfs/dbraw/zinc/74/52/96/648745296.db2.gz GRNYECKLZXPZKF-SNVBAGLBSA-N 1 2 319.232 2.197 20 10 DECDLO COc1cccc([C@@H](C)[NH2+]Cc2nc([C@@H]3CCCO3)n[nH]2)c1O ZINC000848558357 651470770 /nfs/dbraw/zinc/47/07/70/651470770.db2.gz PPRXNXRGSZJXCS-MFKMUULPSA-N 1 2 318.377 2.221 20 10 DECDLO COc1cc(O)c(C[N@H+](C)[C@@H](C)c2nc(C)no2)cc1OC ZINC000848926375 651564424 /nfs/dbraw/zinc/56/44/24/651564424.db2.gz VOWTWZLHUKFERA-VIFPVBQESA-N 1 2 307.350 2.294 20 10 DECDLO COc1cc(O)c(C[N@@H+](C)[C@@H](C)c2nc(C)no2)cc1OC ZINC000848926375 651564428 /nfs/dbraw/zinc/56/44/28/651564428.db2.gz VOWTWZLHUKFERA-VIFPVBQESA-N 1 2 307.350 2.294 20 10 DECDLO C[C@@H]1CN(C(=[NH2+])NCc2cc(Cl)cc(Cl)c2O)CCO1 ZINC000849028663 651588385 /nfs/dbraw/zinc/58/83/85/651588385.db2.gz UGQAUUPZQCLJTD-MRVPVSSYSA-N 1 2 318.204 2.444 20 10 DECDLO CN(C)c1cc(F)c(C[NH2+]Cc2ccnc(N(C)C)n2)cc1F ZINC000858155369 652268017 /nfs/dbraw/zinc/26/80/17/652268017.db2.gz HTHZPFFECAZJFD-UHFFFAOYSA-N 1 2 321.375 2.177 20 10 DECDLO CC[C@H](C)NC(=O)[C@H](C)[NH+]1CCN(c2ccc(OC)cc2)CC1 ZINC000042290051 683896051 /nfs/dbraw/zinc/89/60/51/683896051.db2.gz VNHCGDXVRVIDCJ-GJZGRUSLSA-N 1 2 319.449 2.120 20 10 DECDLO Oc1ccc(Br)cc1C[N@@H+]1CCC2(C1)OCCO2 ZINC000093012796 684047214 /nfs/dbraw/zinc/04/72/14/684047214.db2.gz PNELPUNULSYEEP-UHFFFAOYSA-N 1 2 314.179 2.104 20 10 DECDLO Oc1ccc(Br)cc1C[N@H+]1CCC2(C1)OCCO2 ZINC000093012796 684047215 /nfs/dbraw/zinc/04/72/15/684047215.db2.gz PNELPUNULSYEEP-UHFFFAOYSA-N 1 2 314.179 2.104 20 10 DECDLO C[C@@H]1OCC[N@H+](Cc2ccc(N3CCOCC3)c(F)c2)[C@H]1C ZINC000093418168 684049380 /nfs/dbraw/zinc/04/93/80/684049380.db2.gz YGHBSJHDRHLZFT-KBPBESRZSA-N 1 2 308.397 2.272 20 10 DECDLO C[C@@H]1OCC[N@@H+](Cc2ccc(N3CCOCC3)c(F)c2)[C@H]1C ZINC000093418168 684049383 /nfs/dbraw/zinc/04/93/83/684049383.db2.gz YGHBSJHDRHLZFT-KBPBESRZSA-N 1 2 308.397 2.272 20 10 DECDLO CC(C)NC(=O)C[N@H+](C)Cc1cccc(Br)c1O ZINC000133382607 684219217 /nfs/dbraw/zinc/21/92/17/684219217.db2.gz JLIPHOCENZLOLB-UHFFFAOYSA-N 1 2 315.211 2.111 20 10 DECDLO CC(C)NC(=O)C[N@@H+](C)Cc1cccc(Br)c1O ZINC000133382607 684219219 /nfs/dbraw/zinc/21/92/19/684219219.db2.gz JLIPHOCENZLOLB-UHFFFAOYSA-N 1 2 315.211 2.111 20 10 DECDLO CN(C)c1cc(F)c(C[N@H+](C)[C@H]2CCCCNC2=O)cc1F ZINC000862236946 686261865 /nfs/dbraw/zinc/26/18/65/686261865.db2.gz FTANQFKSGKKRAY-AWEZNQCLSA-N 1 2 311.376 2.131 20 10 DECDLO CN(C)c1cc(F)c(C[N@@H+](C)[C@H]2CCCCNC2=O)cc1F ZINC000862236946 686261866 /nfs/dbraw/zinc/26/18/66/686261866.db2.gz FTANQFKSGKKRAY-AWEZNQCLSA-N 1 2 311.376 2.131 20 10 DECDLO CN(C)c1cc(F)c(C[N@H+](C)C[C@H](O)C(F)(F)F)cc1F ZINC000862367551 686283979 /nfs/dbraw/zinc/28/39/79/686283979.db2.gz MWTCNMVUUJFCIT-LBPRGKRZSA-N 1 2 312.282 2.386 20 10 DECDLO CN(C)c1cc(F)c(C[N@@H+](C)C[C@H](O)C(F)(F)F)cc1F ZINC000862367551 686283982 /nfs/dbraw/zinc/28/39/82/686283982.db2.gz MWTCNMVUUJFCIT-LBPRGKRZSA-N 1 2 312.282 2.386 20 10 DECDLO CN(C)c1cc(F)c(C[N@@H+]2CCC(F)(F)[C@@H](CO)C2)cc1F ZINC000862373756 686284712 /nfs/dbraw/zinc/28/47/12/686284712.db2.gz WLUJGBUDFGNKNA-LLVKDONJSA-N 1 2 320.330 2.480 20 10 DECDLO CN(C)c1cc(F)c(C[N@H+]2CCC(F)(F)[C@@H](CO)C2)cc1F ZINC000862373756 686284719 /nfs/dbraw/zinc/28/47/19/686284719.db2.gz WLUJGBUDFGNKNA-LLVKDONJSA-N 1 2 320.330 2.480 20 10 DECDLO CN(C)c1cc(F)c(C[N@@H+]2CCC(F)(F)[C@H](CO)C2)cc1F ZINC000862373759 686285909 /nfs/dbraw/zinc/28/59/09/686285909.db2.gz WLUJGBUDFGNKNA-NSHDSACASA-N 1 2 320.330 2.480 20 10 DECDLO CN(C)c1cc(F)c(C[N@H+]2CCC(F)(F)[C@H](CO)C2)cc1F ZINC000862373759 686285913 /nfs/dbraw/zinc/28/59/13/686285913.db2.gz WLUJGBUDFGNKNA-NSHDSACASA-N 1 2 320.330 2.480 20 10 DECDLO CCON(CC)C(=O)C[NH2+]Cc1cc(Cl)cc(F)c1O ZINC000862452774 686304130 /nfs/dbraw/zinc/30/41/30/686304130.db2.gz OCDZCHNSCLQNMS-UHFFFAOYSA-N 1 2 304.749 2.074 20 10 DECDLO C[C@H]([NH2+][C@H]1CCN(CC(C)(C)O)C1)c1cc(F)cc(F)c1O ZINC000866414077 687565129 /nfs/dbraw/zinc/56/51/29/687565129.db2.gz ZJSDTNSRUPPVDP-JQWIXIFHSA-N 1 2 314.376 2.166 20 10 DECDLO O=C(NCCCCn1cc[nH+]c1)N1Cc2cccc(O)c2C1 ZINC000875134229 689577036 /nfs/dbraw/zinc/57/70/36/689577036.db2.gz ZJCHSPHEIHYJTK-UHFFFAOYSA-N 1 2 300.362 2.094 20 10 DECDLO COCC[N@H+](CC(=O)OC(C)(C)C)Cc1ccc(C)cc1O ZINC000876659036 689892683 /nfs/dbraw/zinc/89/26/83/689892683.db2.gz LQIRZIJQPUEIFE-UHFFFAOYSA-N 1 2 309.406 2.491 20 10 DECDLO COCC[N@@H+](CC(=O)OC(C)(C)C)Cc1ccc(C)cc1O ZINC000876659036 689892686 /nfs/dbraw/zinc/89/26/86/689892686.db2.gz LQIRZIJQPUEIFE-UHFFFAOYSA-N 1 2 309.406 2.491 20 10 DECDLO CCOC(=O)[C@@H]([NH2+]Cc1ccc(C)cc1O)C1CCOCC1 ZINC000877470052 690122945 /nfs/dbraw/zinc/12/29/45/690122945.db2.gz XVPLRQGXUWWFEB-INIZCTEOSA-N 1 2 307.390 2.149 20 10 DECDLO COc1cc(C[NH2+]Cc2cccc(Br)c2O)on1 ZINC000877635494 690174822 /nfs/dbraw/zinc/17/48/22/690174822.db2.gz TYFINCHJDCGZSX-UHFFFAOYSA-N 1 2 313.151 2.441 20 10 DECDLO COC1CCN(c2ccc(C[N@@H+]3CCO[C@@H](OC)C3)cc2)CC1 ZINC000878970341 690539914 /nfs/dbraw/zinc/53/99/14/690539914.db2.gz OETPOGPXDYEKGO-GOSISDBHSA-N 1 2 320.433 2.107 20 10 DECDLO COC1CCN(c2ccc(C[N@H+]3CCO[C@@H](OC)C3)cc2)CC1 ZINC000878970341 690539917 /nfs/dbraw/zinc/53/99/17/690539917.db2.gz OETPOGPXDYEKGO-GOSISDBHSA-N 1 2 320.433 2.107 20 10 DECDLO OC[C@H]1C[N@H+](Cc2c(O)cc(F)cc2F)C[C@@H]1C(F)(F)F ZINC001140582925 777369312 /nfs/dbraw/zinc/36/93/12/777369312.db2.gz PTLQSWWNYOBTHL-XCBNKYQSSA-N 1 2 311.250 2.273 20 10 DECDLO OC[C@H]1C[N@@H+](Cc2c(O)cc(F)cc2F)C[C@@H]1C(F)(F)F ZINC001140582925 777369320 /nfs/dbraw/zinc/36/93/20/777369320.db2.gz PTLQSWWNYOBTHL-XCBNKYQSSA-N 1 2 311.250 2.273 20 10 DECDLO C[S@@](=O)CCC[NH2+]Cc1cc(Br)cc(F)c1O ZINC000715792429 778148761 /nfs/dbraw/zinc/14/87/61/778148761.db2.gz POFSBPOUHQDDTK-QGZVFWFLSA-N 1 2 324.215 2.152 20 10 DECDLO O=C(CNc1ccc(Cn2cc[nH+]c2)cn1)c1ccc(O)c(O)c1 ZINC001170315654 786903911 /nfs/dbraw/zinc/90/39/11/786903911.db2.gz FFVFNYOJGSOCDW-UHFFFAOYSA-N 1 2 324.340 2.032 20 10 DECDLO O=C1CCC[C@]2(CCC[N@@H+](Cc3c(O)cc(F)cc3F)C2)N1 ZINC001140581214 796540831 /nfs/dbraw/zinc/54/08/31/796540831.db2.gz RWNUFBUPPIEVOD-MRXNPFEDSA-N 1 2 310.344 2.305 20 10 DECDLO O=C1CCC[C@]2(CCC[N@H+](Cc3c(O)cc(F)cc3F)C2)N1 ZINC001140581214 796540834 /nfs/dbraw/zinc/54/08/34/796540834.db2.gz RWNUFBUPPIEVOD-MRXNPFEDSA-N 1 2 310.344 2.305 20 10 DECDLO Cc1ccnc(O[C@@H]2CC[N@H+](Cc3c(O)cc(F)cc3F)C2)n1 ZINC001140585456 796541671 /nfs/dbraw/zinc/54/16/71/796541671.db2.gz JCUSJVWMLGVCQY-GFCCVEGCSA-N 1 2 321.327 2.422 20 10 DECDLO Cc1ccnc(O[C@@H]2CC[N@@H+](Cc3c(O)cc(F)cc3F)C2)n1 ZINC001140585456 796541672 /nfs/dbraw/zinc/54/16/72/796541672.db2.gz JCUSJVWMLGVCQY-GFCCVEGCSA-N 1 2 321.327 2.422 20 10 DECDLO COc1cccc(C[N@@H+]2C[C@@H]3C[C@H]2[C@@H](C(F)(F)F)O3)c1O ZINC001203596868 800086969 /nfs/dbraw/zinc/08/69/69/800086969.db2.gz QGUVLXBOPGDFKO-KWBADKCTSA-N 1 2 303.280 2.305 20 10 DECDLO COc1cccc(C[N@H+]2C[C@@H]3C[C@H]2[C@@H](C(F)(F)F)O3)c1O ZINC001203596868 800086978 /nfs/dbraw/zinc/08/69/78/800086978.db2.gz QGUVLXBOPGDFKO-KWBADKCTSA-N 1 2 303.280 2.305 20 10 DECDLO COc1ccc(N2CC[NH+](Cc3ccnn3C)CC2)c(C)c1 ZINC001206365032 800518838 /nfs/dbraw/zinc/51/88/38/800518838.db2.gz FPGCKJZFDMTXIE-UHFFFAOYSA-N 1 2 300.406 2.059 20 10 DECDLO COc1cc(C[N@@H+]2CCO[C@H](c3ccccn3)C2)c(O)cc1O ZINC001231638323 801701997 /nfs/dbraw/zinc/70/19/97/801701997.db2.gz XSDOXVRSEDSYOF-KRWDZBQOSA-N 1 2 316.357 2.075 20 10 DECDLO COc1cc(C[N@H+]2CCO[C@H](c3ccccn3)C2)c(O)cc1O ZINC001231638323 801701999 /nfs/dbraw/zinc/70/19/99/801701999.db2.gz XSDOXVRSEDSYOF-KRWDZBQOSA-N 1 2 316.357 2.075 20 10 DECDLO COC(=O)N1CCC[N@H+](Cc2cc(Cl)c(O)cc2O)CC1 ZINC001232260849 801830562 /nfs/dbraw/zinc/83/05/62/801830562.db2.gz RWIRZIUYCMPQNX-UHFFFAOYSA-N 1 2 314.769 2.025 20 10 DECDLO COC(=O)N1CCC[N@@H+](Cc2cc(Cl)c(O)cc2O)CC1 ZINC001232260849 801830568 /nfs/dbraw/zinc/83/05/68/801830568.db2.gz RWIRZIUYCMPQNX-UHFFFAOYSA-N 1 2 314.769 2.025 20 10 DECDLO CC[N@H+](Cc1c2ccccc2n(C)c1C(=O)OC)C1COC1 ZINC001232406487 801872168 /nfs/dbraw/zinc/87/21/68/801872168.db2.gz WSWPWTIMEBEMIO-UHFFFAOYSA-N 1 2 302.374 2.186 20 10 DECDLO CC[N@@H+](Cc1c2ccccc2n(C)c1C(=O)OC)C1COC1 ZINC001232406487 801872177 /nfs/dbraw/zinc/87/21/77/801872177.db2.gz WSWPWTIMEBEMIO-UHFFFAOYSA-N 1 2 302.374 2.186 20 10 DECDLO C[N@@H+](Cc1c(O)cc(Br)cc1F)CC1COC1 ZINC001233031771 802007541 /nfs/dbraw/zinc/00/75/41/802007541.db2.gz LTGZLKAUROAHSO-UHFFFAOYSA-N 1 2 304.159 2.372 20 10 DECDLO C[N@H+](Cc1c(O)cc(Br)cc1F)CC1COC1 ZINC001233031771 802007549 /nfs/dbraw/zinc/00/75/49/802007549.db2.gz LTGZLKAUROAHSO-UHFFFAOYSA-N 1 2 304.159 2.372 20 10 DECDLO C[C@H]1C(=O)N(C)CC[N@H+]1Cc1ccc(C(F)(F)F)cc1O ZINC001233454765 802121221 /nfs/dbraw/zinc/12/12/21/802121221.db2.gz JNEUIWKPYGERTJ-VIFPVBQESA-N 1 2 302.296 2.074 20 10 DECDLO C[N@@H+]1CC[C@H](Oc2ccc(O)c3c2C(=O)c2ccccc2C3=O)C1 ZINC001228213115 803331941 /nfs/dbraw/zinc/33/19/41/803331941.db2.gz UMPLPKZXEDRVPO-NSHDSACASA-N 1 2 323.348 2.251 20 10 DECDLO C[N@H+]1CC[C@H](Oc2ccc(O)c3c2C(=O)c2ccccc2C3=O)C1 ZINC001228213115 803331948 /nfs/dbraw/zinc/33/19/48/803331948.db2.gz UMPLPKZXEDRVPO-NSHDSACASA-N 1 2 323.348 2.251 20 10 DECDLO CC[C@@H]([NH2+]CC1CCOCC1)c1cccc(-c2nn[nH]n2)c1O ZINC001604056740 1070190665 /nfs/dbraw/zinc/19/06/65/1070190665.db2.gz VOVUGBINFKOADZ-CQSZACIVSA-N 1 2 317.393 2.040 20 10 DECDLO CC[C@@H]([NH2+]CCC[C@@H](C)CO)c1cccc(-c2nn[nH]n2)c1O ZINC001604056588 1070191156 /nfs/dbraw/zinc/19/11/56/1070191156.db2.gz VCQNXUCEMMUBQM-BXUZGUMPSA-N 1 2 319.409 2.022 20 10 DECDLO COC(C)(C)[C@@H](C)[NH2+][C@H](C)c1cccc(-c2nn[nH]n2)c1O ZINC001604995477 1070559243 /nfs/dbraw/zinc/55/92/43/1070559243.db2.gz IXYAHMKSIKZDPQ-NXEZZACHSA-N 1 2 305.382 2.036 20 10 DECDLO Cn1c[nH+]c(CCNC(=O)c2cc3cc(O)c(O)cc3s2)c1 ZINC001451041337 1056647005 /nfs/dbraw/zinc/64/70/05/1056647005.db2.gz NJWHDFZISAFQJU-UHFFFAOYSA-N 1 2 317.370 2.019 20 10 DECDLO CCOC(=O)C[N@H+](CCOCC(C)C)Cc1ccccc1O ZINC001460275865 1058288825 /nfs/dbraw/zinc/28/88/25/1058288825.db2.gz DWEUMXWZULJFJY-UHFFFAOYSA-N 1 2 309.406 2.430 20 10 DECDLO CCOC(=O)C[N@@H+](CCOCC(C)C)Cc1ccccc1O ZINC001460275865 1058288837 /nfs/dbraw/zinc/28/88/37/1058288837.db2.gz DWEUMXWZULJFJY-UHFFFAOYSA-N 1 2 309.406 2.430 20 10 DECDLO NC(=O)C1(C[NH2+]Cc2cc(Cl)cc(F)c2O)CCCC1 ZINC001461203098 1058611873 /nfs/dbraw/zinc/61/18/73/1058611873.db2.gz OTFUECVNORPRKM-UHFFFAOYSA-N 1 2 300.761 2.320 20 10 DECDLO C[C@@H]1C[N@H+](Cc2cc(F)c(F)cc2O)C[C@@]2(CCCOC2)O1 ZINC001462156932 1058771460 /nfs/dbraw/zinc/77/14/60/1058771460.db2.gz VKMSSGYQOZRPRV-BDJLRTHQSA-N 1 2 313.344 2.440 20 10 DECDLO C[C@@H]1C[N@@H+](Cc2cc(F)c(F)cc2O)C[C@@]2(CCCOC2)O1 ZINC001462156932 1058771481 /nfs/dbraw/zinc/77/14/81/1058771481.db2.gz VKMSSGYQOZRPRV-BDJLRTHQSA-N 1 2 313.344 2.440 20 10 DECDLO C[C@@H]1OCC[C@]12C[N@H+](Cc1cc(F)c(F)cc1O)C[C@@H](C)O2 ZINC001560803653 1075145915 /nfs/dbraw/zinc/14/59/15/1075145915.db2.gz CDCADHYADBIEQO-GDLVEWKHSA-N 1 2 313.344 2.439 20 10 DECDLO C[C@@H]1OCC[C@]12C[N@@H+](Cc1cc(F)c(F)cc1O)C[C@@H](C)O2 ZINC001560803653 1075145917 /nfs/dbraw/zinc/14/59/17/1075145917.db2.gz CDCADHYADBIEQO-GDLVEWKHSA-N 1 2 313.344 2.439 20 10 DECDLO Oc1c(Br)cccc1C[NH2+]C[C@H]1CC(F)(F)CN1 ZINC001580885831 1076014327 /nfs/dbraw/zinc/01/43/27/1076014327.db2.gz NXXDLWVADGZRNQ-SECBINFHSA-N 1 2 321.165 2.242 20 10 DECDLO C[C@@H]([NH2+]CC1CC(F)(F)C1)c1cccc(-c2nn[nH]n2)c1O ZINC001589974983 1076540322 /nfs/dbraw/zinc/54/03/22/1076540322.db2.gz DLEMBHVRCNRSFG-MRVPVSSYSA-N 1 2 309.320 2.268 20 10 DECDLO CCC[C@@H](C[NH2+][C@H](C)c1cccc(-c2nn[nH]n2)c1O)OCC ZINC001590556989 1076652031 /nfs/dbraw/zinc/65/20/31/1076652031.db2.gz DMKVSQDRYIFZAN-NEPJUHHUSA-N 1 2 319.409 2.428 20 10 DECDLO Cc1ncc(C[NH2+][C@H](C)c2cccc(-c3nn[nH]n3)c2O)s1 ZINC001592411419 1076910865 /nfs/dbraw/zinc/91/08/65/1076910865.db2.gz SGISHDQTPPGNBL-MRVPVSSYSA-N 1 2 316.390 2.188 20 10 DECDLO C[C@@H]1C[C@H](O)C[N@@H+]1Cc1cc(F)cc(Br)c1O ZINC001235296258 1084376781 /nfs/dbraw/zinc/37/67/81/1084376781.db2.gz HUFGYWHCVLHVRX-XCBNKYQSSA-N 1 2 304.159 2.249 20 10 DECDLO C[C@@H]1C[C@H](O)C[N@H+]1Cc1cc(F)cc(Br)c1O ZINC001235296258 1084376792 /nfs/dbraw/zinc/37/67/92/1084376792.db2.gz HUFGYWHCVLHVRX-XCBNKYQSSA-N 1 2 304.159 2.249 20 10 DECDLO OC[C@@H](Cc1ccc(O)cc1)[NH2+]Cc1cccc(Cl)c1O ZINC001308686214 1126168388 /nfs/dbraw/zinc/16/83/88/1126168388.db2.gz RRIDRGKPSWKHIR-CYBMUJFWSA-N 1 2 307.777 2.444 20 10 DECDLO Oc1cccc(F)c1C[N@H+]1C[C@H]2CC[C@@H](C1)N2Cc1cn[nH]c1 ZINC001276354078 1089229531 /nfs/dbraw/zinc/22/95/31/1089229531.db2.gz GPPPMAQQELVVDD-OKILXGFUSA-N 1 2 316.380 2.103 20 10 DECDLO Oc1cccc(F)c1C[N@@H+]1C[C@H]2CC[C@@H](C1)N2Cc1cn[nH]c1 ZINC001276354078 1089229543 /nfs/dbraw/zinc/22/95/43/1089229543.db2.gz GPPPMAQQELVVDD-OKILXGFUSA-N 1 2 316.380 2.103 20 10 DECDLO Oc1cccc(F)c1C[N@@H+]1C[C@@H]2OCCN(C3CCCC3)[C@H]2C1 ZINC001276359457 1089241981 /nfs/dbraw/zinc/24/19/81/1089241981.db2.gz IHIIIJZBECCZLH-WMZOPIPTSA-N 1 2 320.408 2.359 20 10 DECDLO Oc1cccc(F)c1C[N@H+]1C[C@@H]2OCCN(C3CCCC3)[C@H]2C1 ZINC001276359457 1089241995 /nfs/dbraw/zinc/24/19/95/1089241995.db2.gz IHIIIJZBECCZLH-WMZOPIPTSA-N 1 2 320.408 2.359 20 10 DECDLO Oc1cccc(F)c1CN1C[C@@H]2OCC[N@H+](C3CCCC3)[C@H]2C1 ZINC001276359457 1089242011 /nfs/dbraw/zinc/24/20/11/1089242011.db2.gz IHIIIJZBECCZLH-WMZOPIPTSA-N 1 2 320.408 2.359 20 10 DECDLO Oc1cccc(F)c1CN1C[C@@H]2OCC[N@@H+](C3CCCC3)[C@H]2C1 ZINC001276359457 1089242023 /nfs/dbraw/zinc/24/20/23/1089242023.db2.gz IHIIIJZBECCZLH-WMZOPIPTSA-N 1 2 320.408 2.359 20 10 DECDLO COc1ccc(C[N@@H+]2CCC[C@@]23CCN(C)C3=O)c(O)c1Cl ZINC001274657478 1091356659 /nfs/dbraw/zinc/35/66/59/1091356659.db2.gz YAIBOBZOTVVKJT-INIZCTEOSA-N 1 2 324.808 2.251 20 10 DECDLO COc1ccc(C[N@H+]2CCC[C@@]23CCN(C)C3=O)c(O)c1Cl ZINC001274657478 1091356668 /nfs/dbraw/zinc/35/66/68/1091356668.db2.gz YAIBOBZOTVVKJT-INIZCTEOSA-N 1 2 324.808 2.251 20 10 DECDLO COC[C@H]1CC[N@@H+]1Cc1cc(O)c(Br)cc1O ZINC001236764110 1138418324 /nfs/dbraw/zinc/41/83/24/1138418324.db2.gz FRODTNLTBGDGNE-SECBINFHSA-N 1 2 302.168 2.081 20 10 DECDLO COC[C@H]1CC[N@H+]1Cc1cc(O)c(Br)cc1O ZINC001236764110 1138418337 /nfs/dbraw/zinc/41/83/37/1138418337.db2.gz FRODTNLTBGDGNE-SECBINFHSA-N 1 2 302.168 2.081 20 10 DECDLO CC(=O)N[C@H]1CC[N@H+](Cc2cc(Cl)c(Cl)cc2O)C1 ZINC001236798650 1138431360 /nfs/dbraw/zinc/43/13/60/1138431360.db2.gz JHEKOBIDKYSPFJ-JTQLQIEISA-N 1 2 303.189 2.409 20 10 DECDLO CC(=O)N[C@H]1CC[N@@H+](Cc2cc(Cl)c(Cl)cc2O)C1 ZINC001236798650 1138431362 /nfs/dbraw/zinc/43/13/62/1138431362.db2.gz JHEKOBIDKYSPFJ-JTQLQIEISA-N 1 2 303.189 2.409 20 10 DECDLO COc1cc(C)c(C[N@H+](C)Cc2nnc3ccccn32)c(O)c1 ZINC001236809136 1138435286 /nfs/dbraw/zinc/43/52/86/1138435286.db2.gz TYXUHYDWTCUTBX-UHFFFAOYSA-N 1 2 312.373 2.384 20 10 DECDLO COc1cc(C)c(C[N@@H+](C)Cc2nnc3ccccn32)c(O)c1 ZINC001236809136 1138435289 /nfs/dbraw/zinc/43/52/89/1138435289.db2.gz TYXUHYDWTCUTBX-UHFFFAOYSA-N 1 2 312.373 2.384 20 10 DECDLO COc1ccc(C[N@@H+]2CC[C@@H](N(C)C(C)=O)C2)c(O)c1Cl ZINC001236810663 1138436964 /nfs/dbraw/zinc/43/69/64/1138436964.db2.gz XDBISDOGTKAJCQ-GFCCVEGCSA-N 1 2 312.797 2.107 20 10 DECDLO COc1ccc(C[N@H+]2CC[C@@H](N(C)C(C)=O)C2)c(O)c1Cl ZINC001236810663 1138436966 /nfs/dbraw/zinc/43/69/66/1138436966.db2.gz XDBISDOGTKAJCQ-GFCCVEGCSA-N 1 2 312.797 2.107 20 10 DECDLO COc1cc(O)c(C[N@@H+]2CCN[C@H](C(F)(F)F)C2)c(Cl)c1 ZINC001236995621 1138478033 /nfs/dbraw/zinc/47/80/33/1138478033.db2.gz KBACGEMDKUNJPV-LBPRGKRZSA-N 1 2 324.730 2.390 20 10 DECDLO COc1cc(O)c(C[N@H+]2CCN[C@H](C(F)(F)F)C2)c(Cl)c1 ZINC001236995621 1138478036 /nfs/dbraw/zinc/47/80/36/1138478036.db2.gz KBACGEMDKUNJPV-LBPRGKRZSA-N 1 2 324.730 2.390 20 10 DECDLO CN1CCC2(C[NH+](Cc3c(O)ccc(Cl)c3Cl)C2)C1=O ZINC001237087039 1138500490 /nfs/dbraw/zinc/50/04/90/1138500490.db2.gz SOHFJVJYVNYBCA-UHFFFAOYSA-N 1 2 315.200 2.363 20 10 DECDLO CNC(=O)C1CC[NH+](Cc2cc(F)cc(Cl)c2O)CC1 ZINC001237808121 1138798307 /nfs/dbraw/zinc/79/83/07/1138798307.db2.gz QYUAJTAYWDDELI-UHFFFAOYSA-N 1 2 300.761 2.143 20 10 DECDLO CC(=O)N[C@H]1CCC[N@H+](Cc2cc(F)cc(Cl)c2O)C1 ZINC001237812180 1138799886 /nfs/dbraw/zinc/79/98/86/1138799886.db2.gz DRQWBDXZLYJQKT-LBPRGKRZSA-N 1 2 300.761 2.285 20 10 DECDLO CC(=O)N[C@H]1CCC[N@@H+](Cc2cc(F)cc(Cl)c2O)C1 ZINC001237812180 1138799890 /nfs/dbraw/zinc/79/98/90/1138799890.db2.gz DRQWBDXZLYJQKT-LBPRGKRZSA-N 1 2 300.761 2.285 20 10 DECDLO Cc1cc(C[N@@H+]2C[C@H](F)C[C@H]2CO)c(O)cc1Br ZINC001250120679 1142084473 /nfs/dbraw/zinc/08/44/73/1142084473.db2.gz MKGYUJHGISRRCU-MNOVXSKESA-N 1 2 318.186 2.368 20 10 DECDLO Cc1cc(C[N@H+]2C[C@H](F)C[C@H]2CO)c(O)cc1Br ZINC001250120679 1142084483 /nfs/dbraw/zinc/08/44/83/1142084483.db2.gz MKGYUJHGISRRCU-MNOVXSKESA-N 1 2 318.186 2.368 20 10 DECDLO COc1ccc(C[NH2+]C(C)(C)c2noc(C)n2)c(O)c1OC ZINC001336709050 1142541316 /nfs/dbraw/zinc/54/13/16/1142541316.db2.gz FYQBGQVCAJBOSG-UHFFFAOYSA-N 1 2 307.350 2.126 20 10 DECDLO CC(C)N1CC[C@@H]([NH2+]Cc2cc(Cl)cc(F)c2O)C1=O ZINC001308272491 1147461996 /nfs/dbraw/zinc/46/19/96/1147461996.db2.gz BQUZZSWKHQCYQH-GFCCVEGCSA-N 1 2 300.761 2.284 20 10 DECDLO Cc1cc(C(=O)N(C)Cc2[nH+]ccn2C)c(C)n1-c1ccccn1 ZINC000063666469 354652059 /nfs/dbraw/zinc/65/20/59/354652059.db2.gz VHJSSRXWVVMZKW-UHFFFAOYSA-N 1 2 323.400 2.495 20 10 DECDLO CCCNC(=O)C[N@H+](CCC)Cc1cc(F)cc(C(C)=O)c1O ZINC000079400765 355308226 /nfs/dbraw/zinc/30/82/26/355308226.db2.gz NNSQHAMRHXJVPN-UHFFFAOYSA-N 1 2 324.396 2.472 20 10 DECDLO CCCNC(=O)C[N@@H+](CCC)Cc1cc(F)cc(C(C)=O)c1O ZINC000079400765 355308229 /nfs/dbraw/zinc/30/82/29/355308229.db2.gz NNSQHAMRHXJVPN-UHFFFAOYSA-N 1 2 324.396 2.472 20 10 DECDLO C[N@@H+]1CCc2ncnc(N3CCc4ccc(F)c(F)c43)c2C1 ZINC000450836871 283181256 /nfs/dbraw/zinc/18/12/56/283181256.db2.gz BQLPIZIZBZDPDB-UHFFFAOYSA-N 1 2 302.328 2.437 20 10 DECDLO C[N@H+]1CCc2ncnc(N3CCc4ccc(F)c(F)c43)c2C1 ZINC000450836871 283181257 /nfs/dbraw/zinc/18/12/57/283181257.db2.gz BQLPIZIZBZDPDB-UHFFFAOYSA-N 1 2 302.328 2.437 20 10 DECDLO C[C@@H]([NH2+]Cc1nnc2n1CCCC2)c1cc([N+](=O)[O-])ccc1O ZINC000274251168 296136376 /nfs/dbraw/zinc/13/63/76/296136376.db2.gz SGIUZJGTTZIXOX-SNVBAGLBSA-N 1 2 317.349 2.079 20 10 DECDLO CCS(=O)(=O)C[C@H](C)[N@H+](C)Cc1ccc(N(C)C)c(F)c1 ZINC000126483329 401696334 /nfs/dbraw/zinc/69/63/34/401696334.db2.gz HQXLSSHWGAFRSV-LBPRGKRZSA-N 1 2 316.442 2.147 20 10 DECDLO CCS(=O)(=O)C[C@H](C)[N@@H+](C)Cc1ccc(N(C)C)c(F)c1 ZINC000126483329 401696336 /nfs/dbraw/zinc/69/63/36/401696336.db2.gz HQXLSSHWGAFRSV-LBPRGKRZSA-N 1 2 316.442 2.147 20 10 DECDLO CC(=O)c1cc(Cl)cc(C[N@@H+]2CCCC[C@@H]2C(N)=O)c1O ZINC000050147485 402025739 /nfs/dbraw/zinc/02/57/39/402025739.db2.gz DOGONNGNJMQEPV-CYBMUJFWSA-N 1 2 310.781 2.088 20 10 DECDLO CC(=O)c1cc(Cl)cc(C[N@H+]2CCCC[C@@H]2C(N)=O)c1O ZINC000050147485 402025743 /nfs/dbraw/zinc/02/57/43/402025743.db2.gz DOGONNGNJMQEPV-CYBMUJFWSA-N 1 2 310.781 2.088 20 10 DECDLO Cc1cc(Br)cc(C[NH2+]CC(F)(F)CO)c1O ZINC000185661987 402367973 /nfs/dbraw/zinc/36/79/73/402367973.db2.gz IORLQBABPIOMNJ-UHFFFAOYSA-N 1 2 310.138 2.180 20 10 DECDLO Cc1ccc(C(=O)NCCCCNc2cccc[nH+]2)c(O)c1O ZINC000179482119 402591584 /nfs/dbraw/zinc/59/15/84/402591584.db2.gz XOMPILKZUNDXPF-UHFFFAOYSA-N 1 2 315.373 2.423 20 10 DECDLO Cc1nnc(C[N@@H+](C)Cc2ccc(N3CCOCC3)cc2)s1 ZINC000271435363 402870823 /nfs/dbraw/zinc/87/08/23/402870823.db2.gz OYDCHCFYABRVKG-UHFFFAOYSA-N 1 2 318.446 2.315 20 10 DECDLO Cc1nnc(C[N@H+](C)Cc2ccc(N3CCOCC3)cc2)s1 ZINC000271435363 402870825 /nfs/dbraw/zinc/87/08/25/402870825.db2.gz OYDCHCFYABRVKG-UHFFFAOYSA-N 1 2 318.446 2.315 20 10 DECDLO CCc1nnc([C@@H](C)[NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2O)[nH]1 ZINC000273539525 403013502 /nfs/dbraw/zinc/01/35/02/403013502.db2.gz YADLURKEKVBIHJ-DTWKUNHWSA-N 1 2 305.338 2.393 20 10 DECDLO Cn1cc(N2CC[NH+](Cc3cc(Cl)c(F)cc3O)CC2)cn1 ZINC000295062772 403747162 /nfs/dbraw/zinc/74/71/62/403747162.db2.gz ADPBPAHAEMXWPH-UHFFFAOYSA-N 1 2 324.787 2.240 20 10 DECDLO C[C@H]1CCN(C(=O)c2c(F)ccc(O)c2O)C[C@@H]1n1cc[nH+]c1 ZINC000295161953 403779840 /nfs/dbraw/zinc/77/98/40/403779840.db2.gz QRPITMRKRDZIED-JQWIXIFHSA-N 1 2 319.336 2.157 20 10 DECDLO CCN(CC)c1ccc(C[N@H+](C)Cc2nncn2C)cc1F ZINC000290254672 404099591 /nfs/dbraw/zinc/09/95/91/404099591.db2.gz WBNWUWHNGHXEDN-UHFFFAOYSA-N 1 2 305.401 2.432 20 10 DECDLO CCN(CC)c1ccc(C[N@@H+](C)Cc2nncn2C)cc1F ZINC000290254672 404099595 /nfs/dbraw/zinc/09/95/95/404099595.db2.gz WBNWUWHNGHXEDN-UHFFFAOYSA-N 1 2 305.401 2.432 20 10 DECDLO COc1cc(Cl)cc(C[NH2+][C@H]2CCc3cn[nH]c3C2)c1O ZINC000359961433 404810854 /nfs/dbraw/zinc/81/08/54/404810854.db2.gz SEXNZTWFUYURQT-LBPRGKRZSA-N 1 2 307.781 2.424 20 10 DECDLO C[C@H]([NH2+]C[C@H]1CCCN1CCCO)c1cc(F)cc(F)c1O ZINC000834850826 649854173 /nfs/dbraw/zinc/85/41/73/649854173.db2.gz PZGWYBMFNJDXRW-WCQYABFASA-N 1 2 314.376 2.168 20 10 DECDLO Cc1cc(NCc2ccc(N3CCOCC3)c(F)c2)nc[nH+]1 ZINC000301221986 336295373 /nfs/dbraw/zinc/29/53/73/336295373.db2.gz AYUZKMROTHNUAT-UHFFFAOYSA-N 1 2 302.353 2.373 20 10 DECDLO CN(C)c1ccc(/C=C/C[N@@H+]2CCN(C)C(=O)C2(C)C)cc1 ZINC000835025105 649867923 /nfs/dbraw/zinc/86/79/23/649867923.db2.gz FAVZQWUJJOQSHQ-VOTSOKGWSA-N 1 2 301.434 2.318 20 10 DECDLO CN(C)c1ccc(/C=C/C[N@H+]2CCN(C)C(=O)C2(C)C)cc1 ZINC000835025105 649867924 /nfs/dbraw/zinc/86/79/24/649867924.db2.gz FAVZQWUJJOQSHQ-VOTSOKGWSA-N 1 2 301.434 2.318 20 10 DECDLO CCS(=O)(=O)C[C@@H](C)[N@H+](C)Cc1c(O)cccc1Cl ZINC000126495500 521647271 /nfs/dbraw/zinc/64/72/71/521647271.db2.gz SVIILIVTDAPWOG-SNVBAGLBSA-N 1 2 305.827 2.301 20 10 DECDLO CCS(=O)(=O)C[C@@H](C)[N@@H+](C)Cc1c(O)cccc1Cl ZINC000126495500 521647276 /nfs/dbraw/zinc/64/72/76/521647276.db2.gz SVIILIVTDAPWOG-SNVBAGLBSA-N 1 2 305.827 2.301 20 10 DECDLO Cc1cccc(C[N@@H+]2CCNC(=O)[C@@H]2c2cccs2)c1O ZINC000373216983 534709143 /nfs/dbraw/zinc/70/91/43/534709143.db2.gz PFTORTASGKUNJX-AWEZNQCLSA-N 1 2 302.399 2.435 20 10 DECDLO Cc1cccc(C[N@H+]2CCNC(=O)[C@@H]2c2cccs2)c1O ZINC000373216983 534709150 /nfs/dbraw/zinc/70/91/50/534709150.db2.gz PFTORTASGKUNJX-AWEZNQCLSA-N 1 2 302.399 2.435 20 10 DECDLO COc1cc(N(C)C(=O)C=Cc2c[nH]c[nH+]2)cc(OC)c1OC ZINC000492811887 536822435 /nfs/dbraw/zinc/82/24/35/536822435.db2.gz LRXJVNAMMOLJSO-WAYWQWQTSA-N 1 2 317.345 2.112 20 10 DECDLO Cc1[nH+]cc2n1C[C@@H](C(=O)NCc1cccc(Cl)c1O)CC2 ZINC000890759053 623197938 /nfs/dbraw/zinc/19/79/38/623197938.db2.gz AUMLJOZOPWISMU-LBPRGKRZSA-N 1 2 319.792 2.429 20 10 DECDLO COc1ccc(O)c([C@H](C)NC(=O)[C@@H]2CCn3cc[nH+]c3C2)c1 ZINC000161404035 625039655 /nfs/dbraw/zinc/03/96/55/625039655.db2.gz NSPFDJNSGJVSIL-NWDGAFQWSA-N 1 2 315.373 2.037 20 10 DECDLO C[N@H+](CC(=O)NCc1ccco1)Cc1cc(F)cc(F)c1O ZINC000893901759 636058588 /nfs/dbraw/zinc/05/85/88/636058588.db2.gz DOFSGILMOPUCJD-UHFFFAOYSA-N 1 2 310.300 2.012 20 10 DECDLO C[N@@H+](CC(=O)NCc1ccco1)Cc1cc(F)cc(F)c1O ZINC000893901759 636058591 /nfs/dbraw/zinc/05/85/91/636058591.db2.gz DOFSGILMOPUCJD-UHFFFAOYSA-N 1 2 310.300 2.012 20 10 DECDLO O=C1C[C@H]([C@H]2CCCC[N@H+]2Cc2cc(F)cc(F)c2O)CN1 ZINC000894095818 636111483 /nfs/dbraw/zinc/11/14/83/636111483.db2.gz SNWYWWLEGZNEKK-IINYFYTJSA-N 1 2 310.344 2.161 20 10 DECDLO O=C1C[C@H]([C@H]2CCCC[N@@H+]2Cc2cc(F)cc(F)c2O)CN1 ZINC000894095818 636111484 /nfs/dbraw/zinc/11/14/84/636111484.db2.gz SNWYWWLEGZNEKK-IINYFYTJSA-N 1 2 310.344 2.161 20 10 DECDLO Cc1cc(C(=O)NCCc2cn(C)c[nH+]2)c(C)n1-c1ccccn1 ZINC000837715076 650255206 /nfs/dbraw/zinc/25/52/06/650255206.db2.gz AYSSEQUIQXCPFK-UHFFFAOYSA-N 1 2 323.400 2.195 20 10 DECDLO COc1ccc(C[N@@H+]2CCOC[C@@H]2CC(F)F)c(O)c1OC ZINC000894429773 637034976 /nfs/dbraw/zinc/03/49/76/637034976.db2.gz KVBOHWZLFLZTOL-NSHDSACASA-N 1 2 317.332 2.265 20 10 DECDLO COc1ccc(C[N@H+]2CCOC[C@@H]2CC(F)F)c(O)c1OC ZINC000894429773 637034979 /nfs/dbraw/zinc/03/49/79/637034979.db2.gz KVBOHWZLFLZTOL-NSHDSACASA-N 1 2 317.332 2.265 20 10 DECDLO Oc1cccc(Br)c1C[N@@H+]1CCCn2nncc2C1 ZINC000895757706 638184927 /nfs/dbraw/zinc/18/49/27/638184927.db2.gz WMYROQHLNQEQHL-UHFFFAOYSA-N 1 2 323.194 2.152 20 10 DECDLO Oc1cccc(Br)c1C[N@H+]1CCCn2nncc2C1 ZINC000895757706 638184929 /nfs/dbraw/zinc/18/49/29/638184929.db2.gz WMYROQHLNQEQHL-UHFFFAOYSA-N 1 2 323.194 2.152 20 10 DECDLO C[C@H]([NH2+]CCN1CCOC(C)(C)C1)c1cc(F)cc(F)c1O ZINC000756542514 639671019 /nfs/dbraw/zinc/67/10/19/639671019.db2.gz AWOSMRWSGZRAJI-NSHDSACASA-N 1 2 314.376 2.432 20 10 DECDLO C[C@@H](C[NH2+][C@@H](C)c1cc(F)cc(F)c1O)CN1CCOCC1 ZINC000756591056 639678320 /nfs/dbraw/zinc/67/83/20/639678320.db2.gz DYKFNJSWPCSINP-RYUDHWBXSA-N 1 2 314.376 2.289 20 10 DECDLO COc1ccc(O)c([C@H](C)NC(=O)N[C@@H](C)Cn2cc[nH+]c2)c1 ZINC000103512871 639767498 /nfs/dbraw/zinc/76/74/98/639767498.db2.gz BENRHXDEIVLSPI-RYUDHWBXSA-N 1 2 318.377 2.046 20 10 DECDLO C[C@H]([NH2+][C@H](CO)C1CCOCC1)c1cc(F)cc(F)c1O ZINC000757656536 639864362 /nfs/dbraw/zinc/86/43/62/639864362.db2.gz BAIQEZUWWVPVFQ-LKFCYVNXSA-N 1 2 301.333 2.109 20 10 DECDLO COC(=O)C(C)(C)[N@H+](C)Cc1ccc(N2CCOCC2)c(F)c1 ZINC000769306394 641213486 /nfs/dbraw/zinc/21/34/86/641213486.db2.gz UBTGHGZEZJYQHV-UHFFFAOYSA-N 1 2 324.396 2.046 20 10 DECDLO COC(=O)C(C)(C)[N@@H+](C)Cc1ccc(N2CCOCC2)c(F)c1 ZINC000769306394 641213490 /nfs/dbraw/zinc/21/34/90/641213490.db2.gz UBTGHGZEZJYQHV-UHFFFAOYSA-N 1 2 324.396 2.046 20 10 DECDLO COCC[N@H+](Cc1c(O)ccc(Cl)c1F)[C@@H]1CCOC1 ZINC000787333872 641285682 /nfs/dbraw/zinc/28/56/82/641285682.db2.gz DLWDTHQVNXYOJK-SNVBAGLBSA-N 1 2 303.761 2.422 20 10 DECDLO COCC[N@@H+](Cc1c(O)ccc(Cl)c1F)[C@@H]1CCOC1 ZINC000787333872 641285688 /nfs/dbraw/zinc/28/56/88/641285688.db2.gz DLWDTHQVNXYOJK-SNVBAGLBSA-N 1 2 303.761 2.422 20 10 DECDLO COC(=O)[C@H](COC(C)C)[N@H+](C)Cc1cc(C)c(C)cc1O ZINC000770354172 641358939 /nfs/dbraw/zinc/35/89/39/641358939.db2.gz FFCYYZVADJTNDO-HNNXBMFYSA-N 1 2 309.406 2.407 20 10 DECDLO COC(=O)[C@H](COC(C)C)[N@@H+](C)Cc1cc(C)c(C)cc1O ZINC000770354172 641358946 /nfs/dbraw/zinc/35/89/46/641358946.db2.gz FFCYYZVADJTNDO-HNNXBMFYSA-N 1 2 309.406 2.407 20 10 DECDLO C[C@@H](NC(=O)N[C@@H](C)Cn1cc[nH+]c1)c1ccc(N(C)C)cc1 ZINC000773238780 641746925 /nfs/dbraw/zinc/74/69/25/641746925.db2.gz XBBRBHIAWPDJTB-UONOGXRCSA-N 1 2 315.421 2.398 20 10 DECDLO Cc1ccc(C(=O)N[C@@H](Cn2cc[nH+]c2)C(C)(C)C)c(O)c1O ZINC000780907657 642688244 /nfs/dbraw/zinc/68/82/44/642688244.db2.gz RUJBDLGUSYPACR-ZDUSSCGKSA-N 1 2 317.389 2.447 20 10 DECDLO C[C@@H](C(=O)OCC(=O)c1ccc(O)c(O)c1)[N@H+]1[C@H](C)CC[C@@H]1C ZINC000783781569 643052537 /nfs/dbraw/zinc/05/25/37/643052537.db2.gz YRFSNEZUZKYBRD-TUAOUCFPSA-N 1 2 321.373 2.085 20 10 DECDLO C[C@@H](C(=O)OCC(=O)c1ccc(O)c(O)c1)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000783781569 643052541 /nfs/dbraw/zinc/05/25/41/643052541.db2.gz YRFSNEZUZKYBRD-TUAOUCFPSA-N 1 2 321.373 2.085 20 10 DECDLO O=C(NCCCSc1nccs1)[C@@H]1CCc2[nH+]ccn2C1 ZINC000786974454 643436769 /nfs/dbraw/zinc/43/67/69/643436769.db2.gz JROVOWAVBJZFQE-LLVKDONJSA-N 1 2 322.459 2.201 20 10 DECDLO COCC[N@H+](Cc1cc(Cl)cc(F)c1O)[C@@H]1CCOC1 ZINC000787333692 643483564 /nfs/dbraw/zinc/48/35/64/643483564.db2.gz AFSXMTTUIVDLRS-GFCCVEGCSA-N 1 2 303.761 2.422 20 10 DECDLO COCC[N@@H+](Cc1cc(Cl)cc(F)c1O)[C@@H]1CCOC1 ZINC000787333692 643483568 /nfs/dbraw/zinc/48/35/68/643483568.db2.gz AFSXMTTUIVDLRS-GFCCVEGCSA-N 1 2 303.761 2.422 20 10 DECDLO C[C@@H]([NH2+][C@@H](C)c1nnnn1C1CC1)c1cc(F)cc(F)c1O ZINC000790758141 643889018 /nfs/dbraw/zinc/88/90/18/643889018.db2.gz XGFGURMEDPOMSG-SFYZADRCSA-N 1 2 309.320 2.404 20 10 DECDLO COCCO[C@@H]1CC[N@H+](Cc2c(O)ccc(Cl)c2F)C1 ZINC000792180666 644085534 /nfs/dbraw/zinc/08/55/34/644085534.db2.gz RHGDFPNPNFLUNC-SNVBAGLBSA-N 1 2 303.761 2.422 20 10 DECDLO COCCO[C@@H]1CC[N@@H+](Cc2c(O)ccc(Cl)c2F)C1 ZINC000792180666 644085538 /nfs/dbraw/zinc/08/55/38/644085538.db2.gz RHGDFPNPNFLUNC-SNVBAGLBSA-N 1 2 303.761 2.422 20 10 DECDLO O=[N+]([O-])c1cc(Cl)cc(C[N@@H+]2CC[C@@H]3[NH2+]CC[C@H]3C2)c1[O-] ZINC000843128900 650901841 /nfs/dbraw/zinc/90/18/41/650901841.db2.gz YUTUNZNSXGXSAA-CABZTGNLSA-N 1 2 311.769 2.138 20 10 DECDLO O=[N+]([O-])c1cc(Cl)cc(C[N@H+]2CC[C@@H]3[NH2+]CC[C@H]3C2)c1[O-] ZINC000843128900 650901843 /nfs/dbraw/zinc/90/18/43/650901843.db2.gz YUTUNZNSXGXSAA-CABZTGNLSA-N 1 2 311.769 2.138 20 10 DECDLO O=[N+]([O-])c1cc(Cl)cc(C[N@@H+]2CC[C@H]3[NH2+]CC[C@@H]3C2)c1[O-] ZINC000843128899 650902331 /nfs/dbraw/zinc/90/23/31/650902331.db2.gz YUTUNZNSXGXSAA-BXKDBHETSA-N 1 2 311.769 2.138 20 10 DECDLO O=[N+]([O-])c1cc(Cl)cc(C[N@H+]2CC[C@H]3[NH2+]CC[C@@H]3C2)c1[O-] ZINC000843128899 650902333 /nfs/dbraw/zinc/90/23/33/650902333.db2.gz YUTUNZNSXGXSAA-BXKDBHETSA-N 1 2 311.769 2.138 20 10 DECDLO Cc1cc(N(C)C)ccc1CNC(=O)CCc1c[nH+]cn1C ZINC000793517315 644265477 /nfs/dbraw/zinc/26/54/77/644265477.db2.gz XKRQHALSMYSEMQ-UHFFFAOYSA-N 1 2 300.406 2.044 20 10 DECDLO CC[C@@H]([NH2+]Cc1nnnn1CC1CC1)c1ccc(F)cc1O ZINC000796944966 644816574 /nfs/dbraw/zinc/81/65/74/644816574.db2.gz HVJBNFQPLATBAD-CYBMUJFWSA-N 1 2 305.357 2.169 20 10 DECDLO CN(C)c1ccc(C[N@H+](C)CN2Cc3cccnc3C2=O)cc1 ZINC000839955142 645489857 /nfs/dbraw/zinc/48/98/57/645489857.db2.gz ZVANBCFFPQQFCX-UHFFFAOYSA-N 1 2 310.401 2.193 20 10 DECDLO CN(C)c1ccc(C[N@@H+](C)CN2Cc3cccnc3C2=O)cc1 ZINC000839955142 645489861 /nfs/dbraw/zinc/48/98/61/645489861.db2.gz ZVANBCFFPQQFCX-UHFFFAOYSA-N 1 2 310.401 2.193 20 10 DECDLO CNC(=O)[C@H](CCSC)[NH2+]Cc1cccc(Cl)c1O ZINC000809784769 646284086 /nfs/dbraw/zinc/28/40/86/646284086.db2.gz MXSVCGHUAALAMD-NSHDSACASA-N 1 2 302.827 2.003 20 10 DECDLO O=S1CCC([NH2+]Cc2cccc(Br)c2O)CC1 ZINC000157973245 646582939 /nfs/dbraw/zinc/58/29/39/646582939.db2.gz WICFIULLRYLRQG-UHFFFAOYSA-N 1 2 318.236 2.155 20 10 DECDLO CCOC[C@H](C(=O)OC)[N@H+](C)Cc1ccc(N(C)C)c(C)c1 ZINC000815074737 646963891 /nfs/dbraw/zinc/96/38/91/646963891.db2.gz CHCLOBVMUJGUDT-MRXNPFEDSA-N 1 2 308.422 2.071 20 10 DECDLO CCOC[C@H](C(=O)OC)[N@@H+](C)Cc1ccc(N(C)C)c(C)c1 ZINC000815074737 646963893 /nfs/dbraw/zinc/96/38/93/646963893.db2.gz CHCLOBVMUJGUDT-MRXNPFEDSA-N 1 2 308.422 2.071 20 10 DECDLO CN(C)c1ccc(CN(C)C(=O)[C@H]2CCc3c[nH+]cn3C2)cc1 ZINC000816822406 647186575 /nfs/dbraw/zinc/18/65/75/647186575.db2.gz JIIIAQDPGJEQAF-HNNXBMFYSA-N 1 2 312.417 2.170 20 10 DECDLO CC(C)C[C@@H](C(=O)NCc1ccc(O)c(O)c1)n1cc[nH+]c1 ZINC000821070434 647984292 /nfs/dbraw/zinc/98/42/92/647984292.db2.gz BOFJQRXRIKUUKO-ZDUSSCGKSA-N 1 2 303.362 2.198 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@H+](C)C[C@H](O)C(F)(F)F)c1O ZINC000181338442 648624406 /nfs/dbraw/zinc/62/44/06/648624406.db2.gz XCITXCQVUVFDSQ-NSHDSACASA-N 1 2 309.259 2.089 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@@H+](C)C[C@H](O)C(F)(F)F)c1O ZINC000181338442 648624408 /nfs/dbraw/zinc/62/44/08/648624408.db2.gz XCITXCQVUVFDSQ-NSHDSACASA-N 1 2 309.259 2.089 20 10 DECDLO O=C1OCCN1[C@H]1CC[N@@H+](Cc2cc(Cl)cc(F)c2O)C1 ZINC000826999962 648959368 /nfs/dbraw/zinc/95/93/68/648959368.db2.gz FLYYTYSYOSZBPU-NSHDSACASA-N 1 2 314.744 2.211 20 10 DECDLO O=C1OCCN1[C@H]1CC[N@H+](Cc2cc(Cl)cc(F)c2O)C1 ZINC000826999962 648959371 /nfs/dbraw/zinc/95/93/71/648959371.db2.gz FLYYTYSYOSZBPU-NSHDSACASA-N 1 2 314.744 2.211 20 10 DECDLO C[C@H]1CC[C@H]([NH2+]Cc2cccc(Cl)c2O)CS1(=O)=O ZINC000827173750 648986336 /nfs/dbraw/zinc/98/63/36/648986336.db2.gz ZZXSZDNDMSZEHS-ONGXEEELSA-N 1 2 303.811 2.101 20 10 DECDLO C[C@@H](NC(=O)[C@H]1CCc2c[nH+]cn2C1)c1ccc(N(C)C)cc1 ZINC000844138566 651082348 /nfs/dbraw/zinc/08/23/48/651082348.db2.gz HYOXVXDRFMUHIB-HIFRSBDPSA-N 1 2 312.417 2.389 20 10 DECDLO COc1ccc(C[NH2+]Cc2nc([C@H]3CCCO3)n[nH]2)cc1C ZINC000848562480 651471227 /nfs/dbraw/zinc/47/12/27/651471227.db2.gz KIUUSKATTNRXLK-CQSZACIVSA-N 1 2 302.378 2.263 20 10 DECDLO CCOC(=O)[C@@H]([NH2+]Cc1cccc(CC)c1O)[C@H]1CCCOC1 ZINC000848906968 651554568 /nfs/dbraw/zinc/55/45/68/651554568.db2.gz YWFYDLPHCAOPTF-HOTGVXAUSA-N 1 2 321.417 2.403 20 10 DECDLO COc1cc(O)c(C[N@H+](C)[C@H](C)c2nc(C)no2)cc1OC ZINC000848926373 651564806 /nfs/dbraw/zinc/56/48/06/651564806.db2.gz VOWTWZLHUKFERA-SECBINFHSA-N 1 2 307.350 2.294 20 10 DECDLO COc1cc(O)c(C[N@@H+](C)[C@H](C)c2nc(C)no2)cc1OC ZINC000848926373 651564811 /nfs/dbraw/zinc/56/48/11/651564811.db2.gz VOWTWZLHUKFERA-SECBINFHSA-N 1 2 307.350 2.294 20 10 DECDLO [NH2+]=C(NCc1cc(Cl)cc(Cl)c1O)NC[C@H]1CCCO1 ZINC000849028759 651588340 /nfs/dbraw/zinc/58/83/40/651588340.db2.gz XGXRRJMZHJBDKX-SNVBAGLBSA-N 1 2 318.204 2.492 20 10 DECDLO Cc1nnc([C@H](C)[NH2+]Cc2cccc(Br)c2O)[nH]1 ZINC000392448001 685449284 /nfs/dbraw/zinc/44/92/84/685449284.db2.gz FGGLDYNYWNLXMH-ZETCQYMHSA-N 1 2 311.183 2.432 20 10 DECDLO CC(C)C(=O)NCC[N@H+](C)Cc1cc(F)c(N(C)C)cc1F ZINC000862253820 686267082 /nfs/dbraw/zinc/26/70/82/686267082.db2.gz UOWJEIXUMRCHMV-UHFFFAOYSA-N 1 2 313.392 2.235 20 10 DECDLO CC(C)C(=O)NCC[N@@H+](C)Cc1cc(F)c(N(C)C)cc1F ZINC000862253820 686267084 /nfs/dbraw/zinc/26/70/84/686267084.db2.gz UOWJEIXUMRCHMV-UHFFFAOYSA-N 1 2 313.392 2.235 20 10 DECDLO COC(=O)[C@@H]1C[N@@H+](Cc2cc(Cl)c(C)cc2O)C[C@@H](C)O1 ZINC000862487446 686309233 /nfs/dbraw/zinc/30/92/33/686309233.db2.gz PLTQGEWMAULGQL-YGRLFVJLSA-N 1 2 313.781 2.116 20 10 DECDLO OC[C@@H]1CSCC[N@@H+]1Cc1ccc(Br)cc1O ZINC000877780696 690226220 /nfs/dbraw/zinc/22/62/20/690226220.db2.gz ZJRDDPSLMDKYNA-LLVKDONJSA-N 1 2 318.236 2.064 20 10 DECDLO OC[C@@H]1CSCC[N@H+]1Cc1ccc(Br)cc1O ZINC000877780696 690226223 /nfs/dbraw/zinc/22/62/23/690226223.db2.gz ZJRDDPSLMDKYNA-LLVKDONJSA-N 1 2 318.236 2.064 20 10 DECDLO C[N@@H+]1CCN(C(=O)c2c(F)ccc(O)c2O)C[C@H]1C(C)(C)C ZINC000880611803 690943009 /nfs/dbraw/zinc/94/30/09/690943009.db2.gz CPETXPGHKNASCX-LBPRGKRZSA-N 1 2 310.369 2.039 20 10 DECDLO C[N@H+]1CCN(C(=O)c2c(F)ccc(O)c2O)C[C@H]1C(C)(C)C ZINC000880611803 690943013 /nfs/dbraw/zinc/94/30/13/690943013.db2.gz CPETXPGHKNASCX-LBPRGKRZSA-N 1 2 310.369 2.039 20 10 DECDLO C[N@@H+]1CC[C@H]1CNC(=O)NCc1cc(Cl)cc(Cl)c1O ZINC000925421369 693270159 /nfs/dbraw/zinc/27/01/59/693270159.db2.gz DLRGSEBXSYKJFJ-JTQLQIEISA-N 1 2 318.204 2.202 20 10 DECDLO C[N@H+]1CC[C@H]1CNC(=O)NCc1cc(Cl)cc(Cl)c1O ZINC000925421369 693270164 /nfs/dbraw/zinc/27/01/64/693270164.db2.gz DLRGSEBXSYKJFJ-JTQLQIEISA-N 1 2 318.204 2.202 20 10 DECDLO COC[C@@H](CC[NH2+]Cc1cccc(Br)c1O)OC ZINC000694299094 777778782 /nfs/dbraw/zinc/77/87/82/777778782.db2.gz MLMIFKNXSKGAEM-LLVKDONJSA-N 1 2 318.211 2.296 20 10 DECDLO C[C@@H]1CC[N@H+](Cc2cc(Br)c(F)cc2O)C[C@H]1O ZINC001144298331 790846855 /nfs/dbraw/zinc/84/68/55/790846855.db2.gz BRRDZLNXHJINSB-AMIZOPFISA-N 1 2 318.186 2.497 20 10 DECDLO C[C@@H]1CC[N@@H+](Cc2cc(Br)c(F)cc2O)C[C@H]1O ZINC001144298331 790846870 /nfs/dbraw/zinc/84/68/70/790846870.db2.gz BRRDZLNXHJINSB-AMIZOPFISA-N 1 2 318.186 2.497 20 10 DECDLO O=C(Cc1c[nH+]c[nH]1)N(Cc1ccco1)Cc1ccccc1O ZINC001137343395 788313431 /nfs/dbraw/zinc/31/34/31/788313431.db2.gz NPFINAUPWJCBLN-UHFFFAOYSA-N 1 2 311.341 2.480 20 10 DECDLO C[C@@H](C[NH2+]Cc1cc(Br)cc(F)c1O)N(C)C ZINC000715778463 792511165 /nfs/dbraw/zinc/51/11/65/792511165.db2.gz METWYEHAYLYXQG-QMMMGPOBSA-N 1 2 305.191 2.334 20 10 DECDLO Oc1c(F)cc(Br)cc1C[NH2+]C[C@@H]1CCOC1 ZINC000715759319 792512037 /nfs/dbraw/zinc/51/20/37/792512037.db2.gz LQVDUBPIFZXBJN-QMMMGPOBSA-N 1 2 304.159 2.420 20 10 DECDLO CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C[C@H]([NH3+])C(F)F ZINC001122025831 795719045 /nfs/dbraw/zinc/71/90/45/795719045.db2.gz JGCGYNDPWURBOR-AWEZNQCLSA-N 1 2 313.392 2.472 20 10 DECDLO CCN(CC)c1ccc(C[N@@H+]2CC[C@@H](O)[C@@H](F)C2)c(OC)c1 ZINC001138386837 796208796 /nfs/dbraw/zinc/20/87/96/796208796.db2.gz XTLFHWJTBVWKQW-JKSUJKDBSA-N 1 2 310.413 2.446 20 10 DECDLO CCN(CC)c1ccc(C[N@H+]2CC[C@@H](O)[C@@H](F)C2)c(OC)c1 ZINC001138386837 796208799 /nfs/dbraw/zinc/20/87/99/796208799.db2.gz XTLFHWJTBVWKQW-JKSUJKDBSA-N 1 2 310.413 2.446 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CCC[C@H](C)[C@H]1CO ZINC001139126531 796327178 /nfs/dbraw/zinc/32/71/78/796327178.db2.gz IUSQDBOGCMMQSJ-XHDPSFHLSA-N 1 2 317.385 2.400 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CCC[C@H](C)[C@H]1CO ZINC001139126531 796327181 /nfs/dbraw/zinc/32/71/81/796327181.db2.gz IUSQDBOGCMMQSJ-XHDPSFHLSA-N 1 2 317.385 2.400 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CC[C@@H](C)[C@@H](O)C1 ZINC001139126683 796327883 /nfs/dbraw/zinc/32/78/83/796327883.db2.gz MQIFTXDOLOVNEC-BMIGLBTASA-N 1 2 303.358 2.010 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CC[C@@H](C)[C@@H](O)C1 ZINC001139126683 796327884 /nfs/dbraw/zinc/32/78/84/796327884.db2.gz MQIFTXDOLOVNEC-BMIGLBTASA-N 1 2 303.358 2.010 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CCC[C@H](O)[C@@H](C)C1 ZINC001139127489 796328795 /nfs/dbraw/zinc/32/87/95/796328795.db2.gz WZOBKWOATSVQET-WFASDCNBSA-N 1 2 317.385 2.400 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CCC[C@H](O)[C@@H](C)C1 ZINC001139127489 796328800 /nfs/dbraw/zinc/32/88/00/796328800.db2.gz WZOBKWOATSVQET-WFASDCNBSA-N 1 2 317.385 2.400 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CCC[C@H](O)[C@H](C)C1 ZINC001139127483 796329502 /nfs/dbraw/zinc/32/95/02/796329502.db2.gz WZOBKWOATSVQET-DOMZBBRYSA-N 1 2 317.385 2.400 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CCC[C@H](O)[C@H](C)C1 ZINC001139127483 796329504 /nfs/dbraw/zinc/32/95/04/796329504.db2.gz WZOBKWOATSVQET-DOMZBBRYSA-N 1 2 317.385 2.400 20 10 DECDLO CC(=O)[C@H]1CC[N@H+](Cc2c(O)ccc3c(C)cc(=O)oc32)C1 ZINC001139132934 796330337 /nfs/dbraw/zinc/33/03/37/796330337.db2.gz CRSODJANESRDCJ-LBPRGKRZSA-N 1 2 301.342 2.218 20 10 DECDLO CC(=O)[C@H]1CC[N@@H+](Cc2c(O)ccc3c(C)cc(=O)oc32)C1 ZINC001139132934 796330340 /nfs/dbraw/zinc/33/03/40/796330340.db2.gz CRSODJANESRDCJ-LBPRGKRZSA-N 1 2 301.342 2.218 20 10 DECDLO CCOC[C@@H]1C[N@H+](Cc2cc(F)ccc2O)Cc2ncn(C)c21 ZINC001140063172 796472232 /nfs/dbraw/zinc/47/22/32/796472232.db2.gz MFEIBGMHQAWGCI-ZDUSSCGKSA-N 1 2 319.380 2.401 20 10 DECDLO CCOC[C@@H]1C[N@@H+](Cc2cc(F)ccc2O)Cc2ncn(C)c21 ZINC001140063172 796472238 /nfs/dbraw/zinc/47/22/38/796472238.db2.gz MFEIBGMHQAWGCI-ZDUSSCGKSA-N 1 2 319.380 2.401 20 10 DECDLO Fc1cc(N2CCOCC2)ccc1C[N@@H+]1CCOC2(CC2)C1 ZINC001140667445 796554390 /nfs/dbraw/zinc/55/43/90/796554390.db2.gz STIZBJOKGMKURH-UHFFFAOYSA-N 1 2 306.381 2.027 20 10 DECDLO Fc1cc(N2CCOCC2)ccc1C[N@H+]1CCOC2(CC2)C1 ZINC001140667445 796554394 /nfs/dbraw/zinc/55/43/94/796554394.db2.gz STIZBJOKGMKURH-UHFFFAOYSA-N 1 2 306.381 2.027 20 10 DECDLO CSc1nc(NCCc2cc(O)c(O)cc2O)cc(C)[nH+]1 ZINC001157239634 798168432 /nfs/dbraw/zinc/16/84/32/798168432.db2.gz HDBGOJLCSDAEBU-UHFFFAOYSA-N 1 2 307.375 2.278 20 10 DECDLO COc1c[nH+]c(NCc2ccc(O)c(O)c2)nc1NC(C)C ZINC001158994826 798500820 /nfs/dbraw/zinc/50/08/20/798500820.db2.gz XXPSSJTZDZSBKS-UHFFFAOYSA-N 1 2 304.350 2.329 20 10 DECDLO CC(C)C(=O)N[C@@H]1[C@H]2C[N@H+](Cc3cccc(Cl)c3O)C[C@H]21 ZINC001231911347 801748579 /nfs/dbraw/zinc/74/85/79/801748579.db2.gz KQZNWRKPOCUMRR-IMRBUKKESA-N 1 2 308.809 2.248 20 10 DECDLO CC(C)C(=O)N[C@@H]1[C@H]2C[N@@H+](Cc3cccc(Cl)c3O)C[C@H]21 ZINC001231911347 801748584 /nfs/dbraw/zinc/74/85/84/801748584.db2.gz KQZNWRKPOCUMRR-IMRBUKKESA-N 1 2 308.809 2.248 20 10 DECDLO COc1cc(O)c(C[N@@H+]2C[C@H](CO)C[C@H](F)C2)cc1Cl ZINC001232266070 801833951 /nfs/dbraw/zinc/83/39/51/801833951.db2.gz IJDKZZZFIMMIAZ-KOLCDFICSA-N 1 2 303.761 2.207 20 10 DECDLO COC(=O)c1c(C[N@@H+]2CCOC3(CC3)C2)c2ccccc2n1C ZINC001232404357 801872932 /nfs/dbraw/zinc/87/29/32/801872932.db2.gz SCNJFGFWMXOSKU-UHFFFAOYSA-N 1 2 314.385 2.330 20 10 DECDLO COC(=O)c1c(C[N@H+]2CCOC3(CC3)C2)c2ccccc2n1C ZINC001232404357 801872936 /nfs/dbraw/zinc/87/29/36/801872936.db2.gz SCNJFGFWMXOSKU-UHFFFAOYSA-N 1 2 314.385 2.330 20 10 DECDLO CCOC(=O)c1nc[nH]c1C[N@H+](C)Cc1ccc(N(C)C)cc1 ZINC001232921472 801983270 /nfs/dbraw/zinc/98/32/70/801983270.db2.gz KUTCJVBQLMQVHO-UHFFFAOYSA-N 1 2 316.405 2.284 20 10 DECDLO CCOC(=O)c1nc[nH]c1C[N@@H+](C)Cc1ccc(N(C)C)cc1 ZINC001232921472 801983274 /nfs/dbraw/zinc/98/32/74/801983274.db2.gz KUTCJVBQLMQVHO-UHFFFAOYSA-N 1 2 316.405 2.284 20 10 DECDLO C[C@@H]1C[C@H](O)C[N@@H+]1Cc1c(O)cc(Br)cc1F ZINC001233027643 802005682 /nfs/dbraw/zinc/00/56/82/802005682.db2.gz VXJKICXFEGDGBV-APPZFPTMSA-N 1 2 304.159 2.249 20 10 DECDLO C[C@@H]1C[C@H](O)C[N@H+]1Cc1c(O)cc(Br)cc1F ZINC001233027643 802005690 /nfs/dbraw/zinc/00/56/90/802005690.db2.gz VXJKICXFEGDGBV-APPZFPTMSA-N 1 2 304.159 2.249 20 10 DECDLO CN1C[C@]2(CC1=O)CCCC[N@@H+]2Cc1ccc(F)c(F)c1O ZINC001233074013 802020721 /nfs/dbraw/zinc/02/07/21/802020721.db2.gz GEKCFWCBVXWHKJ-MRXNPFEDSA-N 1 2 310.344 2.257 20 10 DECDLO CN1C[C@]2(CC1=O)CCCC[N@H+]2Cc1ccc(F)c(F)c1O ZINC001233074013 802020727 /nfs/dbraw/zinc/02/07/27/802020727.db2.gz GEKCFWCBVXWHKJ-MRXNPFEDSA-N 1 2 310.344 2.257 20 10 DECDLO CCOC(=O)[C@@H]1C[N@H+](Cc2cc(C(C)(C)C)ccc2O)CCO1 ZINC001233286127 802064356 /nfs/dbraw/zinc/06/43/56/802064356.db2.gz GOTSKTSSFJDHKX-INIZCTEOSA-N 1 2 321.417 2.454 20 10 DECDLO CCOC(=O)[C@@H]1C[N@@H+](Cc2cc(C(C)(C)C)ccc2O)CCO1 ZINC001233286127 802064360 /nfs/dbraw/zinc/06/43/60/802064360.db2.gz GOTSKTSSFJDHKX-INIZCTEOSA-N 1 2 321.417 2.454 20 10 DECDLO COc1cc(Cl)cc(C[N@@H+]2C[C@H](F)C[C@H](CO)C2)c1O ZINC001233287945 802064996 /nfs/dbraw/zinc/06/49/96/802064996.db2.gz OJOBIYOQFKXEQY-JOYOIKCWSA-N 1 2 303.761 2.207 20 10 DECDLO COc1cc(Cl)cc(C[N@H+]2C[C@H](F)C[C@H](CO)C2)c1O ZINC001233287945 802065002 /nfs/dbraw/zinc/06/50/02/802065002.db2.gz OJOBIYOQFKXEQY-JOYOIKCWSA-N 1 2 303.761 2.207 20 10 DECDLO COc1cc(Cl)cc(C[N@@H+]2CC(=O)NC3(CCCC3)C2)c1O ZINC001233291165 802065778 /nfs/dbraw/zinc/06/57/78/802065778.db2.gz OTTOGISXJLLRDC-UHFFFAOYSA-N 1 2 324.808 2.299 20 10 DECDLO COc1cc(Cl)cc(C[N@H+]2CC(=O)NC3(CCCC3)C2)c1O ZINC001233291165 802065784 /nfs/dbraw/zinc/06/57/84/802065784.db2.gz OTTOGISXJLLRDC-UHFFFAOYSA-N 1 2 324.808 2.299 20 10 DECDLO O=C(N[C@@H]1CCC[N@@H+](Cc2c(O)ccc(F)c2F)C1)C1CC1 ZINC001233336748 802078906 /nfs/dbraw/zinc/07/89/06/802078906.db2.gz YADJNPBOYOGMOC-LLVKDONJSA-N 1 2 310.344 2.161 20 10 DECDLO O=C(N[C@@H]1CCC[N@H+](Cc2c(O)ccc(F)c2F)C1)C1CC1 ZINC001233336748 802078913 /nfs/dbraw/zinc/07/89/13/802078913.db2.gz YADJNPBOYOGMOC-LLVKDONJSA-N 1 2 310.344 2.161 20 10 DECDLO Oc1ccc(F)c(F)c1C[N@H+]1CC[C@@H](Oc2ncccn2)C1 ZINC001233336279 802078972 /nfs/dbraw/zinc/07/89/72/802078972.db2.gz GGPBILOKDLZZGA-SNVBAGLBSA-N 1 2 307.300 2.114 20 10 DECDLO Cc1cnc(O[C@@H]2CC[N@@H+](Cc3c(O)ccc(F)c3F)C2)nc1 ZINC001233336160 802079390 /nfs/dbraw/zinc/07/93/90/802079390.db2.gz ARXXKWGZRMBMEX-LLVKDONJSA-N 1 2 321.327 2.422 20 10 DECDLO C[C@@H]([NH2+]C[C@]1(C)CC1(F)F)c1cccc(-c2nn[nH]n2)c1O ZINC001603656698 1070021671 /nfs/dbraw/zinc/02/16/71/1070021671.db2.gz IAORIHZVNXKSNG-OQPBUACISA-N 1 2 309.320 2.268 20 10 DECDLO CNC(=O)C[N@H+](Cc1ccccc1)Cc1cc(F)cc(F)c1O ZINC001621488612 1078175245 /nfs/dbraw/zinc/17/52/45/1078175245.db2.gz HVRMZIKQTXWEMO-UHFFFAOYSA-N 1 2 320.339 2.419 20 10 DECDLO CNC(=O)C[N@@H+](Cc1ccccc1)Cc1cc(F)cc(F)c1O ZINC001621488612 1078175250 /nfs/dbraw/zinc/17/52/50/1078175250.db2.gz HVRMZIKQTXWEMO-UHFFFAOYSA-N 1 2 320.339 2.419 20 10 DECDLO O=C(NCc1ccc(O)c(O)c1)c1cccc(Cn2cc[nH+]c2)c1 ZINC001635959433 1078462715 /nfs/dbraw/zinc/46/27/15/1078462715.db2.gz JHMJAMYOJTYKCT-UHFFFAOYSA-N 1 2 323.352 2.273 20 10 DECDLO C[C@H]1C[C@@H](CO)[N@H+](Cc2cc(F)cc(Br)c2O)C1 ZINC001235293897 1079011272 /nfs/dbraw/zinc/01/12/72/1079011272.db2.gz CWWXLMUNCJFBNI-KWQFWETISA-N 1 2 318.186 2.497 20 10 DECDLO C[C@H]1C[C@@H](CO)[N@@H+](Cc2cc(F)cc(Br)c2O)C1 ZINC001235293897 1079011281 /nfs/dbraw/zinc/01/12/81/1079011281.db2.gz CWWXLMUNCJFBNI-KWQFWETISA-N 1 2 318.186 2.497 20 10 DECDLO C[C@H]([NH2+]C[C@@H]1CCOC1(C)C)c1cccc(-c2nn[nH]n2)c1O ZINC001589962091 1076537312 /nfs/dbraw/zinc/53/73/12/1076537312.db2.gz GJRIIEQYKPIKTN-QWRGUYRKSA-N 1 2 317.393 2.038 20 10 DECDLO CC[C@@H]([NH2+]C[C@@H]1CCCCO1)c1cccc(-c2nn[nH]n2)c1O ZINC001590468138 1076634130 /nfs/dbraw/zinc/63/41/30/1076634130.db2.gz SRLHMXFFQGYTOY-SMDDNHRTSA-N 1 2 317.393 2.182 20 10 DECDLO CCOCC(C)(C)C[NH2+][C@H](C)c1cccc(-c2nn[nH]n2)c1O ZINC001590799696 1076678626 /nfs/dbraw/zinc/67/86/26/1076678626.db2.gz PNHZVIJHJANKHR-LLVKDONJSA-N 1 2 319.409 2.286 20 10 DECDLO CCOC[C@H]([NH2+][C@H](C)c1cccc(-c2nn[nH]n2)c1O)C(C)C ZINC001590800447 1076678964 /nfs/dbraw/zinc/67/89/64/1076678964.db2.gz POGYWMYQTIWTSU-RISCZKNCSA-N 1 2 319.409 2.284 20 10 DECDLO Cc1cccc(CC[NH2+][C@@H](C)c2cccc(-c3nn[nH]n3)c2O)n1 ZINC001592229688 1076877456 /nfs/dbraw/zinc/87/74/56/1076877456.db2.gz PVDARFCFUKCEHG-LBPRGKRZSA-N 1 2 324.388 2.169 20 10 DECDLO OC[C@H]([NH2+]Cc1cc(Cl)cc(F)c1O)C1CCOCC1 ZINC001620918031 1076889960 /nfs/dbraw/zinc/88/99/60/1076889960.db2.gz BHNZKEDJQCRZAG-ZDUSSCGKSA-N 1 2 303.761 2.062 20 10 DECDLO CN(C)c1ccc(CNc2ccc(N(C)CCO)c[nH+]2)cc1F ZINC001657469302 1080174349 /nfs/dbraw/zinc/17/43/49/1080174349.db2.gz ZYYSEBHZOZGVBO-UHFFFAOYSA-N 1 2 318.396 2.327 20 10 DECDLO CC[N@H+](CC(=O)OC)Cc1ccc(OCC(F)(F)F)cc1O ZINC001237062521 1080414971 /nfs/dbraw/zinc/41/49/71/1080414971.db2.gz MNDTUPNDGOIDBX-UHFFFAOYSA-N 1 2 321.295 2.328 20 10 DECDLO CC[N@@H+](CC(=O)OC)Cc1ccc(OCC(F)(F)F)cc1O ZINC001237062521 1080414977 /nfs/dbraw/zinc/41/49/77/1080414977.db2.gz MNDTUPNDGOIDBX-UHFFFAOYSA-N 1 2 321.295 2.328 20 10 DECDLO Cc1ccnc(NC(=O)C[N@@H+](C)Cc2cc(F)c(F)cc2O)c1 ZINC001665236847 1081003414 /nfs/dbraw/zinc/00/34/14/1081003414.db2.gz AFWFDCRARCFTIJ-UHFFFAOYSA-N 1 2 321.327 2.444 20 10 DECDLO Cc1ccnc(NC(=O)C[N@H+](C)Cc2cc(F)c(F)cc2O)c1 ZINC001665236847 1081003420 /nfs/dbraw/zinc/00/34/20/1081003420.db2.gz AFWFDCRARCFTIJ-UHFFFAOYSA-N 1 2 321.327 2.444 20 10 DECDLO CC(C)NC(=O)N1CCC12C[NH+](Cc1ccc(Cl)cc1O)C2 ZINC001275272572 1091648262 /nfs/dbraw/zinc/64/82/62/1091648262.db2.gz VRUNNVJQQUEHPZ-UHFFFAOYSA-N 1 2 323.824 2.424 20 10 DECDLO COc1cc(O)c(C[N@@H+]2CC[C@@](C)(O)[C@@H](F)C2)c(Cl)c1 ZINC001236797147 1138431049 /nfs/dbraw/zinc/43/10/49/1138431049.db2.gz CJMZDWAZDSKPOW-UONOGXRCSA-N 1 2 303.761 2.349 20 10 DECDLO COc1cc(O)c(C[N@H+]2CC[C@@](C)(O)[C@@H](F)C2)c(Cl)c1 ZINC001236797147 1138431055 /nfs/dbraw/zinc/43/10/55/1138431055.db2.gz CJMZDWAZDSKPOW-UONOGXRCSA-N 1 2 303.761 2.349 20 10 DECDLO COc1ccc(C[N@@H+]2CCCN(C(C)=O)CC2)c(O)c1Cl ZINC001236800671 1138431098 /nfs/dbraw/zinc/43/10/98/1138431098.db2.gz CMJCKGGWSCXGFM-UHFFFAOYSA-N 1 2 312.797 2.108 20 10 DECDLO COc1ccc(C[N@H+]2CCCN(C(C)=O)CC2)c(O)c1Cl ZINC001236800671 1138431105 /nfs/dbraw/zinc/43/11/05/1138431105.db2.gz CMJCKGGWSCXGFM-UHFFFAOYSA-N 1 2 312.797 2.108 20 10 DECDLO COc1ccc(C[N@@H+]2CCC[C@@H](n3ccnn3)C2)c(O)c1Cl ZINC001236809290 1138435519 /nfs/dbraw/zinc/43/55/19/1138435519.db2.gz KTQNMUUOLCDQBU-GFCCVEGCSA-N 1 2 322.796 2.483 20 10 DECDLO COc1ccc(C[N@H+]2CCC[C@@H](n3ccnn3)C2)c(O)c1Cl ZINC001236809290 1138435526 /nfs/dbraw/zinc/43/55/26/1138435526.db2.gz KTQNMUUOLCDQBU-GFCCVEGCSA-N 1 2 322.796 2.483 20 10 DECDLO Oc1cccc(OC(F)(F)F)c1C[NH+]1CC2(CC(O)C2)C1 ZINC001237118713 1138507280 /nfs/dbraw/zinc/50/72/80/1138507280.db2.gz ASEOWNQMBIMZEF-UHFFFAOYSA-N 1 2 303.280 2.248 20 10 DECDLO COC(=O)C1C[NH+](Cc2cc(Br)c(C)cc2O)C1 ZINC001237675798 1138749131 /nfs/dbraw/zinc/74/91/31/1138749131.db2.gz BGQAWWWIXPSAAY-UHFFFAOYSA-N 1 2 314.179 2.068 20 10 DECDLO CCOC(=O)C[N@H+](C)Cc1cc(Br)c(C)cc1O ZINC001237681935 1138754564 /nfs/dbraw/zinc/75/45/64/1138754564.db2.gz ULOBHZZJCBIOKF-UHFFFAOYSA-N 1 2 316.195 2.458 20 10 DECDLO CCOC(=O)C[N@@H+](C)Cc1cc(Br)c(C)cc1O ZINC001237681935 1138754579 /nfs/dbraw/zinc/75/45/79/1138754579.db2.gz ULOBHZZJCBIOKF-UHFFFAOYSA-N 1 2 316.195 2.458 20 10 DECDLO CN(Cc1ccccc1O)c1nnc(C[NH+]2CCCCC2)n1C ZINC001338562039 1142863540 /nfs/dbraw/zinc/86/35/40/1142863540.db2.gz SMDQTJGXEGHURN-UHFFFAOYSA-N 1 2 315.421 2.143 20 10 DECDLO C[C@@H]([NH2+]CC1(CS(C)(=O)=O)CC1)c1ccc(F)c(F)c1O ZINC000187792373 296118099 /nfs/dbraw/zinc/11/80/99/296118099.db2.gz UCQATWMEKHSUQP-SECBINFHSA-N 1 2 319.373 2.146 20 10 DECDLO CCN(CC)c1ccc(C[N@@H+]2CCO[C@@H](CC(=O)OC)C2)cc1 ZINC000093458740 193255548 /nfs/dbraw/zinc/25/55/48/193255548.db2.gz NMHABOFSZQECBK-KRWDZBQOSA-N 1 2 320.433 2.297 20 10 DECDLO CCN(CC)c1ccc(C[N@H+]2CCO[C@@H](CC(=O)OC)C2)cc1 ZINC000093458740 193255549 /nfs/dbraw/zinc/25/55/49/193255549.db2.gz NMHABOFSZQECBK-KRWDZBQOSA-N 1 2 320.433 2.297 20 10 DECDLO Cc1ccc(C(=O)N2CCC[C@H](c3[nH]cc[nH+]3)C2)c(O)c1O ZINC000272723258 130056829 /nfs/dbraw/zinc/05/68/29/130056829.db2.gz FUBJEQQYCMNYDG-NSHDSACASA-N 1 2 301.346 2.149 20 10 DECDLO C[C@@H]([NH2+][C@@H](C)C(=O)NC(C)(C)C)c1cc([N+](=O)[O-])ccc1O ZINC000273361972 130111209 /nfs/dbraw/zinc/11/12/09/130111209.db2.gz APHPNMLZUSAUTA-ZJUUUORDSA-N 1 2 309.366 2.254 20 10 DECDLO COC(=O)c1ccc(O)c([C@H](C)N[C@H]2CC[N@@H+]3CCCC[C@@H]23)c1 ZINC000273420885 130118880 /nfs/dbraw/zinc/11/88/80/130118880.db2.gz RZQADRJJSFZPRI-RCBQFDQVSA-N 1 2 318.417 2.456 20 10 DECDLO COC(=O)c1ccc(O)c([C@H](C)N[C@H]2CC[N@H+]3CCCC[C@@H]23)c1 ZINC000273420885 130118881 /nfs/dbraw/zinc/11/88/81/130118881.db2.gz RZQADRJJSFZPRI-RCBQFDQVSA-N 1 2 318.417 2.456 20 10 DECDLO CCN(C)c1ccc([C@@H](C)[NH2+][C@@H](C(N)=O)c2ccccn2)cc1 ZINC000297348329 132011591 /nfs/dbraw/zinc/01/15/91/132011591.db2.gz OZTLROFZBALJKI-CXAGYDPISA-N 1 2 312.417 2.415 20 10 DECDLO O=S1(=O)CC[C@H](C[NH2+]Cc2cc(Cl)cc(Cl)c2O)C1 ZINC000038082862 401921579 /nfs/dbraw/zinc/92/15/79/401921579.db2.gz RHVGTMSKBSTBAG-MRVPVSSYSA-N 1 2 324.229 2.223 20 10 DECDLO CC(C)c1[nH+]c2c(n1C)CCN(C(=O)Cc1ccc(N)cc1)C2 ZINC000168405928 402496603 /nfs/dbraw/zinc/49/66/03/402496603.db2.gz BLPUOIGHDRDYEL-UHFFFAOYSA-N 1 2 312.417 2.253 20 10 DECDLO CC[C@H]1CO[C@@H](C)C[N@@H+]1Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000278284105 402862546 /nfs/dbraw/zinc/86/25/46/402862546.db2.gz UAMUJYULMQEHTJ-JQWIXIFHSA-N 1 2 310.350 2.308 20 10 DECDLO CC[C@H]1CO[C@@H](C)C[N@H+]1Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000278284105 402862548 /nfs/dbraw/zinc/86/25/48/402862548.db2.gz UAMUJYULMQEHTJ-JQWIXIFHSA-N 1 2 310.350 2.308 20 10 DECDLO COC[C@H]([NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1O)[C@H]1CCCO1 ZINC000278628685 402869066 /nfs/dbraw/zinc/86/90/66/402869066.db2.gz CPNRHXBRFABDBS-VZJVUDMVSA-N 1 2 310.350 2.145 20 10 DECDLO CN(Cc1ccccc1O)C(=O)C1CC[NH+](CC(F)F)CC1 ZINC000280702643 403028159 /nfs/dbraw/zinc/02/81/59/403028159.db2.gz FMJVCQAYRPUJNQ-UHFFFAOYSA-N 1 2 312.360 2.328 20 10 DECDLO COc1cc(Cl)cc(C[N@@H+]2CC[C@@H](C)[S@@](=O)CC2)c1O ZINC000277348397 403207764 /nfs/dbraw/zinc/20/77/64/403207764.db2.gz DHRWIFMVHULCFU-SBKAZYGRSA-N 1 2 317.838 2.397 20 10 DECDLO COc1cc(Cl)cc(C[N@H+]2CC[C@@H](C)[S@@](=O)CC2)c1O ZINC000277348397 403207767 /nfs/dbraw/zinc/20/77/67/403207767.db2.gz DHRWIFMVHULCFU-SBKAZYGRSA-N 1 2 317.838 2.397 20 10 DECDLO C[C@H]([NH2+]Cc1cc(Cl)c(F)cc1O)[C@H](C)N1CCOCC1 ZINC000293736520 403551447 /nfs/dbraw/zinc/55/14/47/403551447.db2.gz WVXMEWNPUGTGFS-QWRGUYRKSA-N 1 2 316.804 2.384 20 10 DECDLO CC[N@H+](Cc1cc(Cl)c(F)cc1O)[C@H](C)CS(C)(=O)=O ZINC000295328652 403858082 /nfs/dbraw/zinc/85/80/82/403858082.db2.gz LUKHPZOCLWVRDK-SECBINFHSA-N 1 2 323.817 2.440 20 10 DECDLO CC[N@@H+](Cc1cc(Cl)c(F)cc1O)[C@H](C)CS(C)(=O)=O ZINC000295328652 403858089 /nfs/dbraw/zinc/85/80/89/403858089.db2.gz LUKHPZOCLWVRDK-SECBINFHSA-N 1 2 323.817 2.440 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@H+]2CC[C@@H](OC(=O)N(C)C)C2)c1O ZINC000296682198 404313192 /nfs/dbraw/zinc/31/31/92/404313192.db2.gz LMNTVMWCFOMIQT-CYBMUJFWSA-N 1 2 324.352 2.006 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@@H+]2CC[C@@H](OC(=O)N(C)C)C2)c1O ZINC000296682198 404313202 /nfs/dbraw/zinc/31/32/02/404313202.db2.gz LMNTVMWCFOMIQT-CYBMUJFWSA-N 1 2 324.352 2.006 20 10 DECDLO C[C@@H]1OCC[C@@]1(O)C[NH2+]Cc1cc(Cl)cc(Cl)c1O ZINC000227970892 225208628 /nfs/dbraw/zinc/20/86/28/225208628.db2.gz ZJTRACSXQLOACR-ISVAXAHUSA-N 1 2 306.189 2.329 20 10 DECDLO CC[C@H]([NH2+]CCCNS(C)(=O)=O)c1cccc(Cl)c1O ZINC000287755512 288040803 /nfs/dbraw/zinc/04/08/03/288040803.db2.gz QMMLGNXIGFJDFZ-LBPRGKRZSA-N 1 2 320.842 2.026 20 10 DECDLO C[C@H]1CCN(C(=O)c2cccc(O)c2O)C[C@H]1n1cc[nH+]c1 ZINC000193133484 299960266 /nfs/dbraw/zinc/96/02/66/299960266.db2.gz KTFGTUYHCNTHGR-WCQYABFASA-N 1 2 301.346 2.018 20 10 DECDLO CCCN(Cc1ccccc1O)C(=O)CCc1[nH+]ccn1C ZINC001349310954 1151240239 /nfs/dbraw/zinc/24/02/39/1151240239.db2.gz OANDQDVJJAHHKZ-UHFFFAOYSA-N 1 2 301.390 2.497 20 10 DECDLO COC(=O)[C@]1(F)CC[N@H+](C/C=C/c2ccc(N(C)C)cc2)C1 ZINC000835030040 649869129 /nfs/dbraw/zinc/86/91/29/649869129.db2.gz VKQQHMVNLQASCR-BDUNBXCCSA-N 1 2 306.381 2.353 20 10 DECDLO COC(=O)[C@]1(F)CC[N@@H+](C/C=C/c2ccc(N(C)C)cc2)C1 ZINC000835030040 649869130 /nfs/dbraw/zinc/86/91/30/649869130.db2.gz VKQQHMVNLQASCR-BDUNBXCCSA-N 1 2 306.381 2.353 20 10 DECDLO COC(=O)[C@@]1(F)CC[N@H+](C/C=C\c2ccc(N(C)C)cc2)C1 ZINC000835030047 649869241 /nfs/dbraw/zinc/86/92/41/649869241.db2.gz VKQQHMVNLQASCR-VGOKWCNXSA-N 1 2 306.381 2.353 20 10 DECDLO COC(=O)[C@@]1(F)CC[N@@H+](C/C=C\c2ccc(N(C)C)cc2)C1 ZINC000835030047 649869243 /nfs/dbraw/zinc/86/92/43/649869243.db2.gz VKQQHMVNLQASCR-VGOKWCNXSA-N 1 2 306.381 2.353 20 10 DECDLO COC[C@H]1C[N@H+](Cc2cc(Cl)cc(OC)c2O)C[C@@H](C)O1 ZINC000188357537 522870943 /nfs/dbraw/zinc/87/09/43/522870943.db2.gz GVAVTZIBJUPPQY-ZWNOBZJWSA-N 1 2 315.797 2.290 20 10 DECDLO COC[C@H]1C[N@@H+](Cc2cc(Cl)cc(OC)c2O)C[C@@H](C)O1 ZINC000188357537 522870950 /nfs/dbraw/zinc/87/09/50/522870950.db2.gz GVAVTZIBJUPPQY-ZWNOBZJWSA-N 1 2 315.797 2.290 20 10 DECDLO CC[N@H+](C[C@@H]1CCNC(=O)CC1)c1ccc(OC)c(OC)c1 ZINC000295655505 528682061 /nfs/dbraw/zinc/68/20/61/528682061.db2.gz HADWFJPZECKKEG-ZDUSSCGKSA-N 1 2 306.406 2.446 20 10 DECDLO CC[N@@H+](C[C@@H]1CCNC(=O)CC1)c1ccc(OC)c(OC)c1 ZINC000295655505 528682069 /nfs/dbraw/zinc/68/20/69/528682069.db2.gz HADWFJPZECKKEG-ZDUSSCGKSA-N 1 2 306.406 2.446 20 10 DECDLO CC[C@@H]1COCC[N@@H+]1Cc1ccc(N2CCOCC2)c(F)c1 ZINC000091981031 624649877 /nfs/dbraw/zinc/64/98/77/624649877.db2.gz XCDYJEJMSYNURX-OAHLLOKOSA-N 1 2 308.397 2.273 20 10 DECDLO CC[C@@H]1COCC[N@H+]1Cc1ccc(N2CCOCC2)c(F)c1 ZINC000091981031 624649879 /nfs/dbraw/zinc/64/98/79/624649879.db2.gz XCDYJEJMSYNURX-OAHLLOKOSA-N 1 2 308.397 2.273 20 10 DECDLO COc1cc(C)cc(C[N@@H+]2CCN(CC(C)C)C(=O)C2)c1O ZINC000894498612 637070506 /nfs/dbraw/zinc/07/05/06/637070506.db2.gz ZSZMAJACOIMCGC-UHFFFAOYSA-N 1 2 306.406 2.009 20 10 DECDLO COc1cc(C)cc(C[N@H+]2CCN(CC(C)C)C(=O)C2)c1O ZINC000894498612 637070507 /nfs/dbraw/zinc/07/05/07/637070507.db2.gz ZSZMAJACOIMCGC-UHFFFAOYSA-N 1 2 306.406 2.009 20 10 DECDLO C[C@H]1C[C@@H](O)C[N@@H+]1Cc1cc(Br)cc(F)c1O ZINC000894538808 637096903 /nfs/dbraw/zinc/09/69/03/637096903.db2.gz MEWLEZCNOLATPX-OIBJUYFYSA-N 1 2 304.159 2.249 20 10 DECDLO C[C@H]1C[C@@H](O)C[N@H+]1Cc1cc(Br)cc(F)c1O ZINC000894538808 637096905 /nfs/dbraw/zinc/09/69/05/637096905.db2.gz MEWLEZCNOLATPX-OIBJUYFYSA-N 1 2 304.159 2.249 20 10 DECDLO C[C@@H]1C[C@@H](O)C[N@@H+]1Cc1cc(Br)cc(F)c1O ZINC000894538807 637096947 /nfs/dbraw/zinc/09/69/47/637096947.db2.gz MEWLEZCNOLATPX-GMSGAONNSA-N 1 2 304.159 2.249 20 10 DECDLO C[C@@H]1C[C@@H](O)C[N@H+]1Cc1cc(Br)cc(F)c1O ZINC000894538807 637096949 /nfs/dbraw/zinc/09/69/49/637096949.db2.gz MEWLEZCNOLATPX-GMSGAONNSA-N 1 2 304.159 2.249 20 10 DECDLO CC1(C)CC(=O)NCC[N@@H+]1Cc1c(O)ccc(Cl)c1F ZINC000895400317 638004800 /nfs/dbraw/zinc/00/48/00/638004800.db2.gz NWRSPAOOJUQWDT-UHFFFAOYSA-N 1 2 300.761 2.285 20 10 DECDLO CC1(C)CC(=O)NCC[N@H+]1Cc1c(O)ccc(Cl)c1F ZINC000895400317 638004807 /nfs/dbraw/zinc/00/48/07/638004807.db2.gz NWRSPAOOJUQWDT-UHFFFAOYSA-N 1 2 300.761 2.285 20 10 DECDLO COCCN1CCC[C@H]1C[NH2+][C@@H](C)c1cc(F)cc(F)c1O ZINC000756531832 639669547 /nfs/dbraw/zinc/66/95/47/639669547.db2.gz BEHOGKPZBCKIQD-AAEUAGOBSA-N 1 2 314.376 2.432 20 10 DECDLO CCn1c[nH+]cc1CN(C)c1ccc(OCC(=O)OC)cc1 ZINC000841872696 650587792 /nfs/dbraw/zinc/58/77/92/650587792.db2.gz NNLVWCGRFMZFSJ-UHFFFAOYSA-N 1 2 303.362 2.091 20 10 DECDLO OCC[C@H]([NH2+]Cc1cc(Cl)cc(F)c1O)C1CCOCC1 ZINC000764678926 640676224 /nfs/dbraw/zinc/67/62/24/640676224.db2.gz OZHGVIALCVJTPB-AWEZNQCLSA-N 1 2 317.788 2.452 20 10 DECDLO CCOC(=O)C[N@H+](Cc1cc2c(cc1O)OCO2)C1CCC1 ZINC000768530921 641093414 /nfs/dbraw/zinc/09/34/14/641093414.db2.gz PIARPKHWNLGFPF-UHFFFAOYSA-N 1 2 307.346 2.039 20 10 DECDLO CCOC(=O)C[N@@H+](Cc1cc2c(cc1O)OCO2)C1CCC1 ZINC000768530921 641093419 /nfs/dbraw/zinc/09/34/19/641093419.db2.gz PIARPKHWNLGFPF-UHFFFAOYSA-N 1 2 307.346 2.039 20 10 DECDLO CC[C@H](C[N@H+](CC(=O)OC)Cc1cc(Cl)ccc1O)OC ZINC000842152849 650660888 /nfs/dbraw/zinc/66/08/88/650660888.db2.gz IXQHCNAYCQJMAC-CYBMUJFWSA-N 1 2 315.797 2.446 20 10 DECDLO CC[C@H](C[N@@H+](CC(=O)OC)Cc1cc(Cl)ccc1O)OC ZINC000842152849 650660889 /nfs/dbraw/zinc/66/08/89/650660889.db2.gz IXQHCNAYCQJMAC-CYBMUJFWSA-N 1 2 315.797 2.446 20 10 DECDLO CC[C@@H](C(=O)N(C)Cc1ccccc1O)[N@@H+]1CCO[C@H](CC)C1 ZINC000774043028 641855614 /nfs/dbraw/zinc/85/56/14/641855614.db2.gz IMNVPCMSLIPXNH-CVEARBPZSA-N 1 2 320.433 2.240 20 10 DECDLO CC[C@@H](C(=O)N(C)Cc1ccccc1O)[N@H+]1CCO[C@H](CC)C1 ZINC000774043028 641855621 /nfs/dbraw/zinc/85/56/21/641855621.db2.gz IMNVPCMSLIPXNH-CVEARBPZSA-N 1 2 320.433 2.240 20 10 DECDLO CCCC[N@H+](C)CCNCc1ccc([N+](=O)[O-])c(OC)c1O ZINC000775013610 641993986 /nfs/dbraw/zinc/99/39/86/641993986.db2.gz WZJBXMVROPHAEU-UHFFFAOYSA-N 1 2 311.382 2.131 20 10 DECDLO CCCC[N@@H+](C)CCNCc1ccc([N+](=O)[O-])c(OC)c1O ZINC000775013610 641993990 /nfs/dbraw/zinc/99/39/90/641993990.db2.gz WZJBXMVROPHAEU-UHFFFAOYSA-N 1 2 311.382 2.131 20 10 DECDLO CC(=O)N[C@H]1CCC[N@H+](Cc2cc(Cl)cc(F)c2O)C1 ZINC000775652745 642073610 /nfs/dbraw/zinc/07/36/10/642073610.db2.gz QNYKLILFBDFLFW-LBPRGKRZSA-N 1 2 300.761 2.285 20 10 DECDLO CC(=O)N[C@H]1CCC[N@@H+](Cc2cc(Cl)cc(F)c2O)C1 ZINC000775652745 642073613 /nfs/dbraw/zinc/07/36/13/642073613.db2.gz QNYKLILFBDFLFW-LBPRGKRZSA-N 1 2 300.761 2.285 20 10 DECDLO COc1cc(O)c(CNc2ccc(N(C)C)c[nH+]2)cc1OC ZINC000776250387 642149488 /nfs/dbraw/zinc/14/94/88/642149488.db2.gz ICXDHWKAHXZKQP-UHFFFAOYSA-N 1 2 303.362 2.483 20 10 DECDLO COc1c(C)c[nH+]c(CNC(=O)c2cccc(O)c2O)c1C ZINC000776342558 642160175 /nfs/dbraw/zinc/16/01/75/642160175.db2.gz FDZGLDLSSSFTNV-UHFFFAOYSA-N 1 2 302.330 2.048 20 10 DECDLO CCC[C@]1(C)C(=O)NCC[N@H+]1Cc1ccc(N(C)C)c(F)c1 ZINC000783740372 643045776 /nfs/dbraw/zinc/04/57/76/643045776.db2.gz ICAZJQOGBWUIRQ-QGZVFWFLSA-N 1 2 307.413 2.382 20 10 DECDLO CCC[C@]1(C)C(=O)NCC[N@@H+]1Cc1ccc(N(C)C)c(F)c1 ZINC000783740372 643045783 /nfs/dbraw/zinc/04/57/83/643045783.db2.gz ICAZJQOGBWUIRQ-QGZVFWFLSA-N 1 2 307.413 2.382 20 10 DECDLO C[C@H]([NH2+]Cc1cccc(Br)c1O)c1ncnn1C ZINC000788972040 643666293 /nfs/dbraw/zinc/66/62/93/643666293.db2.gz UCSMIABXKQNIHJ-QMMMGPOBSA-N 1 2 311.183 2.134 20 10 DECDLO CN(C)c1[nH+]cc(/C=C2\c3cccc4c3N(CCC4)C2=O)n1C ZINC000817345260 647272620 /nfs/dbraw/zinc/27/26/20/647272620.db2.gz FSLZNOVYZYTPFF-XNTDXEJSSA-N 1 2 308.385 2.320 20 10 DECDLO O=C(NCc1cc[nH+]c(N2CCCC2)c1)C1=CC(=O)CS1 ZINC000731867671 647517686 /nfs/dbraw/zinc/51/76/86/647517686.db2.gz PBYQRSABVJMIEL-UHFFFAOYSA-N 1 2 303.387 2.379 20 10 DECDLO CCNC(=O)N1CC[NH+](Cc2cc(Cl)c(C)cc2O)CC1 ZINC000824542158 648606984 /nfs/dbraw/zinc/60/69/84/648606984.db2.gz PBSWLPKYIWEOMN-UHFFFAOYSA-N 1 2 311.813 2.201 20 10 DECDLO Oc1c(Cl)cccc1C[N@@H+]1C[C@H](O)C[C@@H]1[C@@H]1CCCOC1 ZINC000824655719 648630613 /nfs/dbraw/zinc/63/06/13/648630613.db2.gz ZKZBQCXUUKINHU-UMVBOHGHSA-N 1 2 311.809 2.407 20 10 DECDLO Oc1c(Cl)cccc1C[N@H+]1C[C@H](O)C[C@@H]1[C@@H]1CCCOC1 ZINC000824655719 648630615 /nfs/dbraw/zinc/63/06/15/648630615.db2.gz ZKZBQCXUUKINHU-UMVBOHGHSA-N 1 2 311.809 2.407 20 10 DECDLO CO[C@H]1COCC[C@@H]1C[NH2+]Cc1cc(Cl)cc(F)c1O ZINC000824710234 648640546 /nfs/dbraw/zinc/64/05/46/648640546.db2.gz WCWIQMWLNZVJEP-RNCFNFMXSA-N 1 2 303.761 2.326 20 10 DECDLO C[C@@H]1CN(Cc2c(O)ccc(Cl)c2F)C[C@H](C)[N@@H+]1CCO ZINC000824926477 648673679 /nfs/dbraw/zinc/67/36/79/648673679.db2.gz OVKBPEBUGGOSQH-PHIMTYICSA-N 1 2 316.804 2.072 20 10 DECDLO OC[C@]1(F)CC[N@H+](Cc2ccc(Br)cc2O)C1 ZINC000825811427 648814012 /nfs/dbraw/zinc/81/40/12/648814012.db2.gz HGDWAUSBIGLSIV-LBPRGKRZSA-N 1 2 304.159 2.061 20 10 DECDLO OC[C@]1(F)CC[N@@H+](Cc2ccc(Br)cc2O)C1 ZINC000825811427 648814013 /nfs/dbraw/zinc/81/40/13/648814013.db2.gz HGDWAUSBIGLSIV-LBPRGKRZSA-N 1 2 304.159 2.061 20 10 DECDLO COC(=O)C[C@@H]1COCC[N@@H+]1Cc1cc(Cl)c(C)cc1O ZINC000825940139 648829525 /nfs/dbraw/zinc/82/95/25/648829525.db2.gz NLEGTXFINJSEBR-GFCCVEGCSA-N 1 2 313.781 2.118 20 10 DECDLO COC(=O)C[C@@H]1COCC[N@H+]1Cc1cc(Cl)c(C)cc1O ZINC000825940139 648829527 /nfs/dbraw/zinc/82/95/27/648829527.db2.gz NLEGTXFINJSEBR-GFCCVEGCSA-N 1 2 313.781 2.118 20 10 DECDLO COc1ccc(N(C)CC[N@H+](C)Cc2nccc(C)n2)cc1 ZINC000844400653 651123289 /nfs/dbraw/zinc/12/32/89/651123289.db2.gz FJANMYKEZHXXRU-UHFFFAOYSA-N 1 2 300.406 2.362 20 10 DECDLO COc1ccc(N(C)CC[N@@H+](C)Cc2nccc(C)n2)cc1 ZINC000844400653 651123290 /nfs/dbraw/zinc/12/32/90/651123290.db2.gz FJANMYKEZHXXRU-UHFFFAOYSA-N 1 2 300.406 2.362 20 10 DECDLO COC(=O)[C@H]([NH2+]Cc1ccccc1O)[C@@H]1CCC[C@H](OC)C1 ZINC000846109725 651308354 /nfs/dbraw/zinc/30/83/54/651308354.db2.gz VETCRUXUBJSRRG-IVMMDQJWSA-N 1 2 307.390 2.229 20 10 DECDLO CCOc1cccc(C[NH2+]Cc2nc([C@@H]3CCCO3)n[nH]2)c1O ZINC000848561649 651471260 /nfs/dbraw/zinc/47/12/60/651471260.db2.gz AXGVNJPQGBZGNU-ZDUSSCGKSA-N 1 2 318.377 2.050 20 10 DECDLO CCON(CC)C(=O)C[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000858220236 652281848 /nfs/dbraw/zinc/28/18/48/652281848.db2.gz PROGHZGQPQZFQT-UHFFFAOYSA-N 1 2 304.749 2.074 20 10 DECDLO Oc1c(Br)cccc1C[NH2+]CCc1cnccn1 ZINC000390034266 685438230 /nfs/dbraw/zinc/43/82/30/685438230.db2.gz ZZVFSHLSQGRYES-UHFFFAOYSA-N 1 2 308.179 2.277 20 10 DECDLO COc1ccc(N2CCN(c3cc[nH+]c(C)n3)CC2)cc1F ZINC000133635186 684221220 /nfs/dbraw/zinc/22/12/20/684221220.db2.gz SCTPYRNJSRSQKS-UHFFFAOYSA-N 1 2 302.353 2.259 20 10 DECDLO CN(C)c1cc(F)c(C[N@@H+]2C[C@@H]3CCC[C@H]3[C@H]2C(N)=O)cc1F ZINC000862338798 686278816 /nfs/dbraw/zinc/27/88/16/686278816.db2.gz UXEXAZYZNFXCND-IETSOEAISA-N 1 2 323.387 2.117 20 10 DECDLO CN(C)c1cc(F)c(C[N@H+]2C[C@@H]3CCC[C@H]3[C@H]2C(N)=O)cc1F ZINC000862338798 686278817 /nfs/dbraw/zinc/27/88/17/686278817.db2.gz UXEXAZYZNFXCND-IETSOEAISA-N 1 2 323.387 2.117 20 10 DECDLO Cc1nc(N(C)Cc2ccc(N3CCCCC3)cc2)nc(N)[nH+]1 ZINC000865419279 687204990 /nfs/dbraw/zinc/20/49/90/687204990.db2.gz VNJLKFGVPRHYTR-UHFFFAOYSA-N 1 2 312.421 2.389 20 10 DECDLO C[C@@H]([NH2+]Cc1nnc(C2CCOCC2)[nH]1)c1ccc(F)cc1O ZINC000866440511 687574124 /nfs/dbraw/zinc/57/41/24/687574124.db2.gz GVSXOQBYZUWGKZ-SNVBAGLBSA-N 1 2 320.368 2.394 20 10 DECDLO Cc1cnc(C[NH2+]Cc2ccc(N3CCC(O)CC3)c(F)c2)o1 ZINC000876965497 689984846 /nfs/dbraw/zinc/98/48/46/689984846.db2.gz ICQWWFFIQBTVKF-UHFFFAOYSA-N 1 2 319.380 2.373 20 10 DECDLO CCOC(=O)[C@@H]1CSCC[N@@H+]1Cc1cc(C)c(C)cc1O ZINC000887556384 692399244 /nfs/dbraw/zinc/39/92/44/692399244.db2.gz LCWJHAWILSRUOJ-AWEZNQCLSA-N 1 2 309.431 2.490 20 10 DECDLO CCOC(=O)[C@@H]1CSCC[N@H+]1Cc1cc(C)c(C)cc1O ZINC000887556384 692399246 /nfs/dbraw/zinc/39/92/46/692399246.db2.gz LCWJHAWILSRUOJ-AWEZNQCLSA-N 1 2 309.431 2.490 20 10 DECDLO CCNc1cc(CNC(=O)NCc2ccccc2O)cc[nH+]1 ZINC001347507076 1151073458 /nfs/dbraw/zinc/07/34/58/1151073458.db2.gz PJIVRJMQGYYYPD-UHFFFAOYSA-N 1 2 300.362 2.218 20 10 DECDLO COCc1n[nH]c(C[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3C)n1 ZINC001333327663 1150034343 /nfs/dbraw/zinc/03/43/43/1150034343.db2.gz OKZYQZDLJOJYKU-WDEREUQCSA-N 1 2 302.378 2.303 20 10 DECDLO C[C@@H](C[S@@](C)=O)[NH2+]Cc1cc(Br)cc(F)c1O ZINC000715792394 778149989 /nfs/dbraw/zinc/14/99/89/778149989.db2.gz OQVQIGSVLVSPPU-BWKAKNAASA-N 1 2 324.215 2.150 20 10 DECDLO COC(=O)c1cccc2c1C[N@H+](Cc1c(O)cc(O)cc1O)C2 ZINC001144509085 790940800 /nfs/dbraw/zinc/94/08/00/790940800.db2.gz KNQFEDVLQIZBCS-UHFFFAOYSA-N 1 2 315.325 2.106 20 10 DECDLO COC(=O)c1cccc2c1C[N@@H+](Cc1c(O)cc(O)cc1O)C2 ZINC001144509085 790940811 /nfs/dbraw/zinc/94/08/11/790940811.db2.gz KNQFEDVLQIZBCS-UHFFFAOYSA-N 1 2 315.325 2.106 20 10 DECDLO Oc1cc(O)c(C[NH+]2CCN(CC3CCCC3)CC2)c(O)c1 ZINC001144509568 790941036 /nfs/dbraw/zinc/94/10/36/790941036.db2.gz ZREDWEXZWZTFLG-UHFFFAOYSA-N 1 2 306.406 2.111 20 10 DECDLO C[C@@H]1COC[C@H]1[NH2+]Cc1cc(Br)cc(F)c1O ZINC000715713965 792507939 /nfs/dbraw/zinc/50/79/39/792507939.db2.gz SVZOCHGCCSIQKC-RDDDGLTNSA-N 1 2 304.159 2.418 20 10 DECDLO CNC(=O)OC[C@@H]1CCCC[N@@H+]1Cc1cc(F)c(F)cc1O ZINC001182175407 795620902 /nfs/dbraw/zinc/62/09/02/795620902.db2.gz XQBXFINOROTSSM-NSHDSACASA-N 1 2 314.332 2.381 20 10 DECDLO CNC(=O)OC[C@@H]1CCCC[N@H+]1Cc1cc(F)c(F)cc1O ZINC001182175407 795620905 /nfs/dbraw/zinc/62/09/05/795620905.db2.gz XQBXFINOROTSSM-NSHDSACASA-N 1 2 314.332 2.381 20 10 DECDLO C[N@@H+]1Cc2ccccc2[C@H]1CNC(=O)c1c(F)ccc(O)c1O ZINC001184152013 795997264 /nfs/dbraw/zinc/99/72/64/795997264.db2.gz CTLOCIRBGAXOKZ-CYBMUJFWSA-N 1 2 316.332 2.153 20 10 DECDLO C[N@H+]1Cc2ccccc2[C@H]1CNC(=O)c1c(F)ccc(O)c1O ZINC001184152013 795997272 /nfs/dbraw/zinc/99/72/72/795997272.db2.gz CTLOCIRBGAXOKZ-CYBMUJFWSA-N 1 2 316.332 2.153 20 10 DECDLO Oc1cccc(F)c1C[NH+]1CCN(Cc2ccncc2)CC1 ZINC001137837906 796144201 /nfs/dbraw/zinc/14/42/01/796144201.db2.gz YMTUTZWSCINVPN-UHFFFAOYSA-N 1 2 301.365 2.244 20 10 DECDLO CCOC[C@@H]1C[N@H+](Cc2c(O)cccc2F)Cc2c1cnn2C ZINC001137832658 796144211 /nfs/dbraw/zinc/14/42/11/796144211.db2.gz CNNGDTLFAFSXQM-LBPRGKRZSA-N 1 2 319.380 2.401 20 10 DECDLO CCOC[C@@H]1C[N@@H+](Cc2c(O)cccc2F)Cc2c1cnn2C ZINC001137832658 796144213 /nfs/dbraw/zinc/14/42/13/796144213.db2.gz CNNGDTLFAFSXQM-LBPRGKRZSA-N 1 2 319.380 2.401 20 10 DECDLO CCOC[C@H]1C[N@H+](Cc2cccc(F)c2O)Cc2ncn(C)c21 ZINC001138125501 796167003 /nfs/dbraw/zinc/16/70/03/796167003.db2.gz QRAMUJUGLFPKPD-CYBMUJFWSA-N 1 2 319.380 2.401 20 10 DECDLO CCOC[C@H]1C[N@@H+](Cc2cccc(F)c2O)Cc2ncn(C)c21 ZINC001138125501 796167005 /nfs/dbraw/zinc/16/70/05/796167005.db2.gz QRAMUJUGLFPKPD-CYBMUJFWSA-N 1 2 319.380 2.401 20 10 DECDLO COc1ccc(C[N@@H+]2CC[C@@](O)(C(F)(F)F)[C@@H](F)C2)c(O)c1 ZINC001203620965 796293645 /nfs/dbraw/zinc/29/36/45/796293645.db2.gz LGTIDXXOVMDTHR-STQMWFEESA-N 1 2 323.286 2.238 20 10 DECDLO COc1ccc(C[N@H+]2CC[C@@](O)(C(F)(F)F)[C@@H](F)C2)c(O)c1 ZINC001203620965 796293651 /nfs/dbraw/zinc/29/36/51/796293651.db2.gz LGTIDXXOVMDTHR-STQMWFEESA-N 1 2 323.286 2.238 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CCC[C@@H](C)[C@H]1CO ZINC001139126529 796327513 /nfs/dbraw/zinc/32/75/13/796327513.db2.gz IUSQDBOGCMMQSJ-IAQYHMDHSA-N 1 2 317.385 2.400 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CCC[C@@H](C)[C@H]1CO ZINC001139126529 796327517 /nfs/dbraw/zinc/32/75/17/796327517.db2.gz IUSQDBOGCMMQSJ-IAQYHMDHSA-N 1 2 317.385 2.400 20 10 DECDLO Cc1cncnc1O[C@@H]1CC[N@H+](Cc2c(O)cc(F)cc2F)C1 ZINC001140585540 796541574 /nfs/dbraw/zinc/54/15/74/796541574.db2.gz MZWMQZRRIZHKFL-GFCCVEGCSA-N 1 2 321.327 2.422 20 10 DECDLO Cc1cncnc1O[C@@H]1CC[N@@H+](Cc2c(O)cc(F)cc2F)C1 ZINC001140585540 796541577 /nfs/dbraw/zinc/54/15/77/796541577.db2.gz MZWMQZRRIZHKFL-GFCCVEGCSA-N 1 2 321.327 2.422 20 10 DECDLO CN(C)c1ccc(C[N@@H+]2CCO[C@]3(CCOC3)C2)c(Cl)c1 ZINC001140922151 796597379 /nfs/dbraw/zinc/59/73/79/796597379.db2.gz IDZSIPGKARBXMS-MRXNPFEDSA-N 1 2 310.825 2.397 20 10 DECDLO CN(C)c1ccc(C[N@H+]2CCO[C@]3(CCOC3)C2)c(Cl)c1 ZINC001140922151 796597384 /nfs/dbraw/zinc/59/73/84/796597384.db2.gz IDZSIPGKARBXMS-MRXNPFEDSA-N 1 2 310.825 2.397 20 10 DECDLO CN(C)c1ccc(C[N@@H+]2CCO[C@@H]3C[C@H](CO)C[C@H]32)c(Cl)c1 ZINC001140922268 796597594 /nfs/dbraw/zinc/59/75/94/796597594.db2.gz MKSQWWAUVXYTNE-CSMYWGQOSA-N 1 2 324.852 2.378 20 10 DECDLO CN(C)c1ccc(C[N@H+]2CCO[C@@H]3C[C@H](CO)C[C@H]32)c(Cl)c1 ZINC001140922268 796597597 /nfs/dbraw/zinc/59/75/97/796597597.db2.gz MKSQWWAUVXYTNE-CSMYWGQOSA-N 1 2 324.852 2.378 20 10 DECDLO Oc1c(Cl)cccc1C[NH2+]C[C@@H]1COC2(CCOCC2)O1 ZINC001204975676 800279915 /nfs/dbraw/zinc/27/99/15/800279915.db2.gz LONFNGNQYHDVQP-GFCCVEGCSA-N 1 2 313.781 2.057 20 10 DECDLO COc1ccc(N2CC[NH+](Cc3ccncc3OC)CC2)cc1 ZINC001206438874 800533132 /nfs/dbraw/zinc/53/31/32/800533132.db2.gz WBXOFPKJOFJZJN-UHFFFAOYSA-N 1 2 313.401 2.421 20 10 DECDLO COc1cc(Cl)cc(C[N@@H+]2CCN(C(C)=O)[C@H](C)C2)c1O ZINC001233290759 802064444 /nfs/dbraw/zinc/06/44/44/802064444.db2.gz UEBKFRFADZYJQT-SNVBAGLBSA-N 1 2 312.797 2.107 20 10 DECDLO COc1cc(Cl)cc(C[N@H+]2CCN(C(C)=O)[C@H](C)C2)c1O ZINC001233290759 802064450 /nfs/dbraw/zinc/06/44/50/802064450.db2.gz UEBKFRFADZYJQT-SNVBAGLBSA-N 1 2 312.797 2.107 20 10 DECDLO C[C@H](C[C@H]1CCOC1)[NH2+][C@@H](C)c1cccc(-c2nn[nH]n2)c1O ZINC001603465037 1069974889 /nfs/dbraw/zinc/97/48/89/1069974889.db2.gz CWKYVHHFTORWGR-GRYCIOLGSA-N 1 2 317.393 2.038 20 10 DECDLO C[C@@H](C[NH2+][C@@H](C)c1cccc(-c2nn[nH]n2)c1O)c1ccncc1 ZINC001603551789 1069985771 /nfs/dbraw/zinc/98/57/71/1069985771.db2.gz GGXWVCHBZXVJJV-RYUDHWBXSA-N 1 2 324.388 2.422 20 10 DECDLO C[C@@H]([NH2+]C[C@H]1CCO[C@H](C)C1)c1cccc(-c2nn[nH]n2)c1O ZINC001603851267 1070121858 /nfs/dbraw/zinc/12/18/58/1070121858.db2.gz WGHCEJLFKNVYGA-UTUOFQBUSA-N 1 2 317.393 2.038 20 10 DECDLO CN(C)C(=O)O[C@@H]1CCC[N@H+](Cc2cc(F)c(F)cc2O)C1 ZINC001621345427 1078172603 /nfs/dbraw/zinc/17/26/03/1078172603.db2.gz STKWYFRYGGYRAQ-LLVKDONJSA-N 1 2 314.332 2.333 20 10 DECDLO CN(C)C(=O)O[C@@H]1CCC[N@@H+](Cc2cc(F)c(F)cc2O)C1 ZINC001621345427 1078172610 /nfs/dbraw/zinc/17/26/10/1078172610.db2.gz STKWYFRYGGYRAQ-LLVKDONJSA-N 1 2 314.332 2.333 20 10 DECDLO COc1c(O)c(C[NH2+]Cc2cc(C3CC3)no2)ccc1[N+](=O)[O-] ZINC001561003827 1075149090 /nfs/dbraw/zinc/14/90/90/1075149090.db2.gz LCDSUCXUYXVYGN-UHFFFAOYSA-N 1 2 319.317 2.464 20 10 DECDLO C[C@H]([NH2+][C@@H](C)[C@H]1CCCOC1)c1cccc(-c2nn[nH]n2)c1O ZINC001589949971 1076532625 /nfs/dbraw/zinc/53/26/25/1076532625.db2.gz PDXMTHXRNWOBBM-SRVKXCTJSA-N 1 2 317.393 2.038 20 10 DECDLO C[C@@H]([NH2+][C@@H](CO)CC(C)(C)C)c1cccc(-c2nn[nH]n2)c1O ZINC001589953879 1076534993 /nfs/dbraw/zinc/53/49/93/1076534993.db2.gz WTLXHVOTMOKNKT-GHMZBOCLSA-N 1 2 319.409 2.020 20 10 DECDLO C[C@@H]([NH2+]CC1SCCS1)c1cccc(-c2nn[nH]n2)c1O ZINC001589963246 1076538694 /nfs/dbraw/zinc/53/86/94/1076538694.db2.gz KRBIXCZTIUWURP-MRVPVSSYSA-N 1 2 323.447 2.029 20 10 DECDLO CC[C@@H]([NH2+]C[C@H]1CCCCO1)c1cccc(-c2nn[nH]n2)c1O ZINC001590468129 1076634068 /nfs/dbraw/zinc/63/40/68/1076634068.db2.gz SRLHMXFFQGYTOY-BXUZGUMPSA-N 1 2 317.393 2.182 20 10 DECDLO CSC1(C[NH2+][C@H](C)c2cccc(-c3nn[nH]n3)c2O)CC1 ZINC001591688176 1076770624 /nfs/dbraw/zinc/77/06/24/1076770624.db2.gz IRMUEVURVSMUSO-SECBINFHSA-N 1 2 305.407 2.119 20 10 DECDLO CS(=O)(=O)C[C@H]1CCC[N@@H+](Cc2ccc(Cl)cc2O)C1 ZINC001652551537 1079882953 /nfs/dbraw/zinc/88/29/53/1079882953.db2.gz GBHQWABTXQGEQG-NSHDSACASA-N 1 2 317.838 2.302 20 10 DECDLO C[C@@H](CO[C@H]1CCOC1)[NH2+]Cc1cc(Cl)cc(F)c1O ZINC001657545904 1080177717 /nfs/dbraw/zinc/17/77/17/1080177717.db2.gz YQEJKTFPYPZMEF-CABZTGNLSA-N 1 2 303.761 2.468 20 10 DECDLO C[C@H](C(=O)NC(C)(C)C)[N@H+](C)Cc1cc(F)c(F)cc1O ZINC001659497559 1080243607 /nfs/dbraw/zinc/24/36/07/1080243607.db2.gz KFNVUEHNLMOZLL-SECBINFHSA-N 1 2 300.349 2.405 20 10 DECDLO C[C@H](C(=O)NC(C)(C)C)[N@@H+](C)Cc1cc(F)c(F)cc1O ZINC001659497559 1080243615 /nfs/dbraw/zinc/24/36/15/1080243615.db2.gz KFNVUEHNLMOZLL-SECBINFHSA-N 1 2 300.349 2.405 20 10 DECDLO Cc1c2ccccc2n(C)c1C[NH2+][C@@H](C(N)=O)c1ccccn1 ZINC001662512382 1080613805 /nfs/dbraw/zinc/61/38/05/1080613805.db2.gz RYBZHFLKKNAKCD-QGZVFWFLSA-N 1 2 308.385 2.198 20 10 DECDLO Oc1c(F)cccc1C[N@@H+]1C[C@@H]2OCCN(C3CCCC3)[C@H]2C1 ZINC001276537939 1083484446 /nfs/dbraw/zinc/48/44/46/1083484446.db2.gz QZZIPVOJRSTISV-IRXDYDNUSA-N 1 2 320.408 2.359 20 10 DECDLO Oc1c(F)cccc1C[N@H+]1C[C@@H]2OCCN(C3CCCC3)[C@H]2C1 ZINC001276537939 1083484460 /nfs/dbraw/zinc/48/44/60/1083484460.db2.gz QZZIPVOJRSTISV-IRXDYDNUSA-N 1 2 320.408 2.359 20 10 DECDLO Oc1c(F)cccc1CN1C[C@@H]2OCC[N@H+](C3CCCC3)[C@H]2C1 ZINC001276537939 1083484466 /nfs/dbraw/zinc/48/44/66/1083484466.db2.gz QZZIPVOJRSTISV-IRXDYDNUSA-N 1 2 320.408 2.359 20 10 DECDLO Oc1c(F)cccc1CN1C[C@@H]2OCC[N@@H+](C3CCCC3)[C@H]2C1 ZINC001276537939 1083484473 /nfs/dbraw/zinc/48/44/73/1083484473.db2.gz QZZIPVOJRSTISV-IRXDYDNUSA-N 1 2 320.408 2.359 20 10 DECDLO CC(C)(C)c1ccc(O)c(C[N@@H+]2CCn3cnc(CO)c3C2)c1 ZINC001235508735 1084452420 /nfs/dbraw/zinc/45/24/20/1084452420.db2.gz YPSUZAZDXVZLGA-UHFFFAOYSA-N 1 2 315.417 2.394 20 10 DECDLO CC(C)(C)c1ccc(O)c(C[N@H+]2CCn3cnc(CO)c3C2)c1 ZINC001235508735 1084452423 /nfs/dbraw/zinc/45/24/23/1084452423.db2.gz YPSUZAZDXVZLGA-UHFFFAOYSA-N 1 2 315.417 2.394 20 10 DECDLO CNC(=O)[C@H]1CC12CC[NH+](Cc1cccc(Cl)c1O)CC2 ZINC001274234143 1091144848 /nfs/dbraw/zinc/14/48/48/1091144848.db2.gz ITLBVAYAJPPQGD-GFCCVEGCSA-N 1 2 308.809 2.394 20 10 DECDLO CC(C)NC(=O)N1C[C@H]2C[C@@H](C1)[N@H+]2Cc1c(O)cccc1Cl ZINC001275217369 1091620258 /nfs/dbraw/zinc/62/02/58/1091620258.db2.gz KHIZORYZCLLRKE-TXEJJXNPSA-N 1 2 323.824 2.422 20 10 DECDLO CC(C)NC(=O)N1C[C@H]2C[C@@H](C1)[N@@H+]2Cc1c(O)cccc1Cl ZINC001275217369 1091620262 /nfs/dbraw/zinc/62/02/62/1091620262.db2.gz KHIZORYZCLLRKE-TXEJJXNPSA-N 1 2 323.824 2.422 20 10 DECDLO COC(=O)[C@@]1(F)CC[N@H+](Cc2c(O)cc(OC)cc2Cl)C1 ZINC001236798025 1138430988 /nfs/dbraw/zinc/43/09/88/1138430988.db2.gz KKUDGMTXIVRAPP-CQSZACIVSA-N 1 2 317.744 2.141 20 10 DECDLO COC(=O)[C@@]1(F)CC[N@@H+](Cc2c(O)cc(OC)cc2Cl)C1 ZINC001236798025 1138430991 /nfs/dbraw/zinc/43/09/91/1138430991.db2.gz KKUDGMTXIVRAPP-CQSZACIVSA-N 1 2 317.744 2.141 20 10 DECDLO COc1cc(C)c(C[N@@H+]2CCO[C@H](C(F)(F)F)C2)c(O)c1 ZINC001236811211 1138437189 /nfs/dbraw/zinc/43/71/89/1138437189.db2.gz MXTKMQKWWBZBOH-ZDUSSCGKSA-N 1 2 305.296 2.472 20 10 DECDLO COc1cc(C)c(C[N@H+]2CCO[C@H](C(F)(F)F)C2)c(O)c1 ZINC001236811211 1138437196 /nfs/dbraw/zinc/43/71/96/1138437196.db2.gz MXTKMQKWWBZBOH-ZDUSSCGKSA-N 1 2 305.296 2.472 20 10 DECDLO C[N@H+](Cc1cc(F)c(Cl)cc1O)C1CCS(=O)(=O)CC1 ZINC001237949282 1138812102 /nfs/dbraw/zinc/81/21/02/1138812102.db2.gz JJPFEXWXWXIECH-UHFFFAOYSA-N 1 2 321.801 2.194 20 10 DECDLO C[N@@H+](Cc1cc(F)c(Cl)cc1O)C1CCS(=O)(=O)CC1 ZINC001237949282 1138812103 /nfs/dbraw/zinc/81/21/03/1138812103.db2.gz JJPFEXWXWXIECH-UHFFFAOYSA-N 1 2 321.801 2.194 20 10 DECDLO CN(Cc1ccccc1O)c1nnc([C@@H]2CCCC[N@@H+]2C)n1C ZINC001262904289 1144341226 /nfs/dbraw/zinc/34/12/26/1144341226.db2.gz LYOPGMDFGLYQGW-AWEZNQCLSA-N 1 2 315.421 2.314 20 10 DECDLO CN(Cc1ccccc1O)c1nnc([C@@H]2CCCC[N@H+]2C)n1C ZINC001262904289 1144341228 /nfs/dbraw/zinc/34/12/28/1144341228.db2.gz LYOPGMDFGLYQGW-AWEZNQCLSA-N 1 2 315.421 2.314 20 10 DECDLO C[C@H]([NH2+]CC1(CO)CCOCC1)c1ccc(F)c(F)c1O ZINC000187801749 299279757 /nfs/dbraw/zinc/27/97/57/299279757.db2.gz BTOUVDTUVFKKKT-JTQLQIEISA-N 1 2 301.333 2.110 20 10 DECDLO C[C@@H]([NH2+]CC1(S(C)(=O)=O)CCC1)c1ccc(F)c(F)c1O ZINC000281212380 296119679 /nfs/dbraw/zinc/11/96/79/296119679.db2.gz SSBFDGYPRWQISD-SECBINFHSA-N 1 2 319.373 2.288 20 10 DECDLO O=[N+]([O-])c1ccc(O)c(C[NH2+]C[C@H]2COC3(CCCC3)O2)c1 ZINC000271467072 129919298 /nfs/dbraw/zinc/91/92/98/129919298.db2.gz VCTYIQDLAXHZTP-ZDUSSCGKSA-N 1 2 308.334 2.076 20 10 DECDLO O=[N+]([O-])c1ccc(O)c(C[NH2+]Cc2noc3c2CCCC3)c1 ZINC000288440331 131324872 /nfs/dbraw/zinc/32/48/72/131324872.db2.gz LWAOPLYPFVIURK-UHFFFAOYSA-N 1 2 303.318 2.457 20 10 DECDLO CN(C)c1ccc(CN(C)C(=O)[C@@H]2CCn3c[nH+]cc3C2)cc1 ZINC000151262700 402026333 /nfs/dbraw/zinc/02/63/33/402026333.db2.gz QCAFQAKZOMSMLS-OAHLLOKOSA-N 1 2 312.417 2.170 20 10 DECDLO Cc1nc2n(n1)C[C@H]([NH2+][C@@H](C)c1ccc(F)c(F)c1O)CC2 ZINC000187692490 402508837 /nfs/dbraw/zinc/50/88/37/402508837.db2.gz ITVJQUDRPPGRFA-WCBMZHEXSA-N 1 2 308.332 2.236 20 10 DECDLO O=C(NCc1ccc(N2CCCC2)cc1)[C@@H]1CCn2cc[nH+]c2C1 ZINC000178765849 402536569 /nfs/dbraw/zinc/53/65/69/402536569.db2.gz OULAHVLKAQKISD-MRXNPFEDSA-N 1 2 324.428 2.362 20 10 DECDLO Oc1c(Cl)cccc1C[NH+]1CCN(c2cnccn2)CC1 ZINC000179714522 402598944 /nfs/dbraw/zinc/59/89/44/402598944.db2.gz LNROMEWRLMITNZ-UHFFFAOYSA-N 1 2 304.781 2.158 20 10 DECDLO CC[C@H]1C[N@H+](Cc2ccc([N+](=O)[O-])c(OC)c2O)C[C@H](C)O1 ZINC000278163987 402861418 /nfs/dbraw/zinc/86/14/18/402861418.db2.gz DVZNREHSCGEPMS-JQWIXIFHSA-N 1 2 310.350 2.308 20 10 DECDLO CC[C@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])c(OC)c2O)C[C@H](C)O1 ZINC000278163987 402861419 /nfs/dbraw/zinc/86/14/19/402861419.db2.gz DVZNREHSCGEPMS-JQWIXIFHSA-N 1 2 310.350 2.308 20 10 DECDLO CC[C@@H]1C[N@H+](Cc2ccc([N+](=O)[O-])c(OC)c2O)C[C@H](C)O1 ZINC000278163981 402861539 /nfs/dbraw/zinc/86/15/39/402861539.db2.gz DVZNREHSCGEPMS-CMPLNLGQSA-N 1 2 310.350 2.308 20 10 DECDLO CC[C@@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])c(OC)c2O)C[C@H](C)O1 ZINC000278163981 402861541 /nfs/dbraw/zinc/86/15/41/402861541.db2.gz DVZNREHSCGEPMS-CMPLNLGQSA-N 1 2 310.350 2.308 20 10 DECDLO COc1c(O)c(C[N@H+](C)Cc2cc(C)on2)ccc1[N+](=O)[O-] ZINC000278236235 402862100 /nfs/dbraw/zinc/86/21/00/402862100.db2.gz NIIZNXCODUPXME-UHFFFAOYSA-N 1 2 307.306 2.237 20 10 DECDLO COc1c(O)c(C[N@@H+](C)Cc2cc(C)on2)ccc1[N+](=O)[O-] ZINC000278236235 402862103 /nfs/dbraw/zinc/86/21/03/402862103.db2.gz NIIZNXCODUPXME-UHFFFAOYSA-N 1 2 307.306 2.237 20 10 DECDLO COc1c(O)c(C[NH2+][C@H](CCO)c2ccco2)ccc1[N+](=O)[O-] ZINC000278292590 402862566 /nfs/dbraw/zinc/86/25/66/402862566.db2.gz BVDZDIMAHLSCMP-LLVKDONJSA-N 1 2 322.317 2.115 20 10 DECDLO CCCN(Cc1ccccc1O)C(=O)NCc1[nH+]ccn1C ZINC000264488462 402883526 /nfs/dbraw/zinc/88/35/26/402883526.db2.gz BYRRRXZJVIZCSA-UHFFFAOYSA-N 1 2 302.378 2.248 20 10 DECDLO CCC[C@@](C)([NH2+]Cc1cc(OC)c(OC)cc1O)C(=O)OC ZINC000272441626 402937402 /nfs/dbraw/zinc/93/74/02/402937402.db2.gz TZWLGBFFEWGRGE-MRXNPFEDSA-N 1 2 311.378 2.231 20 10 DECDLO COc1cc(O)c(C[NH2+]C(C)(C)c2noc(C)n2)cc1OC ZINC000271076486 403261304 /nfs/dbraw/zinc/26/13/04/403261304.db2.gz HGKGUUALEKXGEG-UHFFFAOYSA-N 1 2 307.350 2.126 20 10 DECDLO Cc1cc(C(=O)N2CCn3c[nH+]cc3C2)c(C)n1-c1ccccn1 ZINC000290970733 404367871 /nfs/dbraw/zinc/36/78/71/404367871.db2.gz TUSPKAWFVWZQKP-UHFFFAOYSA-N 1 2 321.384 2.342 20 10 DECDLO COCC[C@H]1COCC[N@@H+]1Cc1c(O)ccc(Cl)c1F ZINC000365795374 404722242 /nfs/dbraw/zinc/72/22/42/404722242.db2.gz AQUUWBKBVXQXCC-JTQLQIEISA-N 1 2 303.761 2.422 20 10 DECDLO COCC[C@H]1COCC[N@H+]1Cc1c(O)ccc(Cl)c1F ZINC000365795374 404722244 /nfs/dbraw/zinc/72/22/44/404722244.db2.gz AQUUWBKBVXQXCC-JTQLQIEISA-N 1 2 303.761 2.422 20 10 DECDLO COc1cc(O)c(C[N@@H+]2CCC[C@H]2c2ncc[nH]2)cc1OC ZINC000375353356 227149455 /nfs/dbraw/zinc/14/94/55/227149455.db2.gz PKBOAXJMEIFDAZ-LBPRGKRZSA-N 1 2 303.362 2.470 20 10 DECDLO COc1cc(O)c(C[N@H+]2CCC[C@H]2c2ncc[nH]2)cc1OC ZINC000375353356 227149462 /nfs/dbraw/zinc/14/94/62/227149462.db2.gz PKBOAXJMEIFDAZ-LBPRGKRZSA-N 1 2 303.362 2.470 20 10 DECDLO C[C@@H]1OCC[C@]1(O)C[NH2+]Cc1cc(Cl)cc(Cl)c1O ZINC000227970915 534209151 /nfs/dbraw/zinc/20/91/51/534209151.db2.gz ZJTRACSXQLOACR-SDBXPKJASA-N 1 2 306.189 2.329 20 10 DECDLO CCOC(=O)[C@H]([NH2+]Cc1cc2c(cc1O)OCO2)[C@H](C)CC ZINC000276527450 528040742 /nfs/dbraw/zinc/04/07/42/528040742.db2.gz VYILCWXUHXWYCT-MEBBXXQBSA-N 1 2 309.362 2.188 20 10 DECDLO O=C(NCc1cccc(Cl)c1O)[C@H]1CCn2c[nH+]cc2C1 ZINC000890760602 623198508 /nfs/dbraw/zinc/19/85/08/623198508.db2.gz VCFYXSGWHHWWPV-JTQLQIEISA-N 1 2 305.765 2.121 20 10 DECDLO Cc1cc(N(C)C)ccc1CNC(=O)CCCn1cc[nH+]c1 ZINC000734402393 633366845 /nfs/dbraw/zinc/36/68/45/633366845.db2.gz HMDARRFIAQTULM-UHFFFAOYSA-N 1 2 300.406 2.354 20 10 DECDLO C[NH+]1CCN(C(=O)CSc2ncc(C(C)(C)C)s2)CC1 ZINC000771562941 633646649 /nfs/dbraw/zinc/64/66/49/633646649.db2.gz GSZWKVNFLBBZJO-UHFFFAOYSA-N 1 2 313.492 2.307 20 10 DECDLO CCc1nnc(C[N@H+](C)Cc2ccc(N3CCOCC3)cc2)o1 ZINC000073405869 633781325 /nfs/dbraw/zinc/78/13/25/633781325.db2.gz DJRGHSQJJINDJX-UHFFFAOYSA-N 1 2 316.405 2.101 20 10 DECDLO CCc1nnc(C[N@@H+](C)Cc2ccc(N3CCOCC3)cc2)o1 ZINC000073405869 633781332 /nfs/dbraw/zinc/78/13/32/633781332.db2.gz DJRGHSQJJINDJX-UHFFFAOYSA-N 1 2 316.405 2.101 20 10 DECDLO CS(=O)(=O)[C@H]1CCC[N@H+](Cc2cc(F)cc(F)c2O)CC1 ZINC000894666023 637153990 /nfs/dbraw/zinc/15/39/90/637153990.db2.gz GTADTEPNGYPMCC-LBPRGKRZSA-N 1 2 319.373 2.070 20 10 DECDLO CS(=O)(=O)[C@H]1CCC[N@@H+](Cc2cc(F)cc(F)c2O)CC1 ZINC000894666023 637153993 /nfs/dbraw/zinc/15/39/93/637153993.db2.gz GTADTEPNGYPMCC-LBPRGKRZSA-N 1 2 319.373 2.070 20 10 DECDLO Cc1nccnc1N1CC[NH+](Cc2cc(F)cc(F)c2O)CC1 ZINC000894658764 637156648 /nfs/dbraw/zinc/15/66/48/637156648.db2.gz XIHLOEGKRRYTNR-UHFFFAOYSA-N 1 2 320.343 2.091 20 10 DECDLO COC(=O)[C@]1(F)CC[N@H+](Cc2c(O)cc(C)cc2Cl)C1 ZINC000840923060 650383648 /nfs/dbraw/zinc/38/36/48/650383648.db2.gz RJJUCFQMCKONRT-AWEZNQCLSA-N 1 2 301.745 2.441 20 10 DECDLO COC(=O)[C@]1(F)CC[N@@H+](Cc2c(O)cc(C)cc2Cl)C1 ZINC000840923060 650383650 /nfs/dbraw/zinc/38/36/50/650383650.db2.gz RJJUCFQMCKONRT-AWEZNQCLSA-N 1 2 301.745 2.441 20 10 DECDLO COC(=O)[C@@H](CC1CCOCC1)[NH2+]Cc1cccc(C)c1O ZINC000895591624 638106090 /nfs/dbraw/zinc/10/60/90/638106090.db2.gz QMYBJGPXCJIXNO-OAHLLOKOSA-N 1 2 307.390 2.149 20 10 DECDLO C[C@H]([NH2+]CCNC(=O)c1ccco1)c1cc(F)cc(F)c1O ZINC000756368214 639655002 /nfs/dbraw/zinc/65/50/02/639655002.db2.gz QOZDOYNTJNANRC-VIFPVBQESA-N 1 2 310.300 2.344 20 10 DECDLO C[C@H]([NH2+]CCN1CCO[C@@H](C)C1)c1cc(F)cc(F)c1O ZINC000756544442 639671014 /nfs/dbraw/zinc/67/10/14/639671014.db2.gz IKAXNEBHWCNSSW-QWRGUYRKSA-N 1 2 300.349 2.042 20 10 DECDLO CCc1cnc(C[N@H+](C)Cc2cc3c(cc2O)OC[C@@H]3O)s1 ZINC000768464889 641085111 /nfs/dbraw/zinc/08/51/11/641085111.db2.gz XBURAIKQAWXCDC-AWEZNQCLSA-N 1 2 320.414 2.469 20 10 DECDLO CCc1cnc(C[N@@H+](C)Cc2cc3c(cc2O)OC[C@@H]3O)s1 ZINC000768464889 641085115 /nfs/dbraw/zinc/08/51/15/641085115.db2.gz XBURAIKQAWXCDC-AWEZNQCLSA-N 1 2 320.414 2.469 20 10 DECDLO O=C1C[C@]2([NH2+]Cc3cc(Cl)cc(F)c3O)CCCC[C@@H]2N1 ZINC000898462036 641668414 /nfs/dbraw/zinc/66/84/14/641668414.db2.gz DTFRERIYROUXAQ-SWLSCSKDSA-N 1 2 312.772 2.476 20 10 DECDLO CS(=O)(=O)[C@@H]1CCC[C@H]([NH2+]Cc2cccc(Cl)c2O)C1 ZINC000776208844 642143626 /nfs/dbraw/zinc/14/36/26/642143626.db2.gz LVQCLORHKMRENG-NWDGAFQWSA-N 1 2 317.838 2.491 20 10 DECDLO COC(=O)C[N@H+](C)Cc1cc(C)cc(Br)c1O ZINC000781896761 642795758 /nfs/dbraw/zinc/79/57/58/642795758.db2.gz NICOHCDXNZIVJH-UHFFFAOYSA-N 1 2 302.168 2.068 20 10 DECDLO COC(=O)C[N@@H+](C)Cc1cc(C)cc(Br)c1O ZINC000781896761 642795762 /nfs/dbraw/zinc/79/57/62/642795762.db2.gz NICOHCDXNZIVJH-UHFFFAOYSA-N 1 2 302.168 2.068 20 10 DECDLO C[C@H]([NH2+]CCCON)c1cc(Br)cc(F)c1O ZINC000902425860 643034214 /nfs/dbraw/zinc/03/42/14/643034214.db2.gz OHKQQTPHACHICJ-ZETCQYMHSA-N 1 2 307.163 2.225 20 10 DECDLO COc1ccc(C[NH2+]Cc2ncccc2S(C)(=O)=O)cc1C ZINC000785573635 643248975 /nfs/dbraw/zinc/24/89/75/643248975.db2.gz ZXGCKOUCWMNSIL-UHFFFAOYSA-N 1 2 320.414 2.092 20 10 DECDLO C[C@@H]([NH2+]CCC1(O)CCOCC1)c1cc(F)cc(F)c1O ZINC000797029802 644828216 /nfs/dbraw/zinc/82/82/16/644828216.db2.gz AESROKITIDIPRE-SNVBAGLBSA-N 1 2 301.333 2.253 20 10 DECDLO CNC(=O)[C@]1(C)CC[N@H+](Cc2cc(Cl)cc(F)c2O)C1 ZINC000797606039 644901319 /nfs/dbraw/zinc/90/13/19/644901319.db2.gz XXPMRQMQGHJWSQ-CQSZACIVSA-N 1 2 300.761 2.143 20 10 DECDLO CNC(=O)[C@]1(C)CC[N@@H+](Cc2cc(Cl)cc(F)c2O)C1 ZINC000797606039 644901323 /nfs/dbraw/zinc/90/13/23/644901323.db2.gz XXPMRQMQGHJWSQ-CQSZACIVSA-N 1 2 300.761 2.143 20 10 DECDLO COc1ccc(CNC(=O)Nc2cc(C)[nH+]cc2C)c(O)c1 ZINC000797639446 644904413 /nfs/dbraw/zinc/90/44/13/644904413.db2.gz ZESLNVNWNCULEW-UHFFFAOYSA-N 1 2 301.346 2.156 20 10 DECDLO C[C@@H](O)[C@@H]1CCN(c2cc(NCc3ccccc3O)[nH+]cn2)C1 ZINC000840253580 646653066 /nfs/dbraw/zinc/65/30/66/646653066.db2.gz LZLAKQCJTCODAY-TZMCWYRMSA-N 1 2 314.389 2.001 20 10 DECDLO C[C@@H](O)[C@@H]1CCN(c2cc(NCc3ccccc3O)nc[nH+]2)C1 ZINC000840253580 646653067 /nfs/dbraw/zinc/65/30/67/646653067.db2.gz LZLAKQCJTCODAY-TZMCWYRMSA-N 1 2 314.389 2.001 20 10 DECDLO CC(C)(CS(C)(=O)=O)[NH2+]Cc1cc(Cl)cc(F)c1O ZINC000762787153 647397282 /nfs/dbraw/zinc/39/72/82/647397282.db2.gz NPVMCKDWPOECBW-UHFFFAOYSA-N 1 2 309.790 2.098 20 10 DECDLO COC[C@@]1(CO)CC[N@H+](Cc2cc(Cl)cc(F)c2O)C1 ZINC000825158733 648714448 /nfs/dbraw/zinc/71/44/48/648714448.db2.gz XTAUADIFZOISLA-AWEZNQCLSA-N 1 2 303.761 2.016 20 10 DECDLO COC[C@@]1(CO)CC[N@@H+](Cc2cc(Cl)cc(F)c2O)C1 ZINC000825158733 648714453 /nfs/dbraw/zinc/71/44/53/648714453.db2.gz XTAUADIFZOISLA-AWEZNQCLSA-N 1 2 303.761 2.016 20 10 DECDLO Cc1cc(O)c(C[NH+]2CC(n3cc([C@H](C)O)nn3)C2)cc1Cl ZINC000825461746 648765871 /nfs/dbraw/zinc/76/58/71/648765871.db2.gz NSBVJDPTVOPYJF-JTQLQIEISA-N 1 2 322.796 2.056 20 10 DECDLO Cc1ccc(C(=O)NC[C@@H]2c3ccccc3C[N@H+]2C)c(O)c1O ZINC000826708532 648911906 /nfs/dbraw/zinc/91/19/06/648911906.db2.gz CWQYMIHYTWLKAQ-OAHLLOKOSA-N 1 2 312.369 2.323 20 10 DECDLO Cc1ccc(C(=O)NC[C@@H]2c3ccccc3C[N@@H+]2C)c(O)c1O ZINC000826708532 648911910 /nfs/dbraw/zinc/91/19/10/648911910.db2.gz CWQYMIHYTWLKAQ-OAHLLOKOSA-N 1 2 312.369 2.323 20 10 DECDLO Cc1cc(Cl)cc(C[NH+]2CCN([C@H]3CCOC3)CC2)c1O ZINC000827119272 648974395 /nfs/dbraw/zinc/97/43/95/648974395.db2.gz JJWJWLXGCNQSKD-HNNXBMFYSA-N 1 2 310.825 2.261 20 10 DECDLO COC(=O)N(C)CC[N@H+](C)Cc1c(O)ccc(Cl)c1F ZINC000827340439 649018846 /nfs/dbraw/zinc/01/88/46/649018846.db2.gz JJZGWSUMRNWNIF-UHFFFAOYSA-N 1 2 304.749 2.315 20 10 DECDLO COC(=O)N(C)CC[N@@H+](C)Cc1c(O)ccc(Cl)c1F ZINC000827340439 649018848 /nfs/dbraw/zinc/01/88/48/649018848.db2.gz JJZGWSUMRNWNIF-UHFFFAOYSA-N 1 2 304.749 2.315 20 10 DECDLO C[C@@H](NC(=O)[C@@H]1CCc2c[nH+]cn2C1)c1ccc(N(C)C)cc1 ZINC000844138568 651082553 /nfs/dbraw/zinc/08/25/53/651082553.db2.gz HYOXVXDRFMUHIB-UKRRQHHQSA-N 1 2 312.417 2.389 20 10 DECDLO CCc1cccc(C[N@H+](C)Cc2ncnn2CC(F)F)c1O ZINC000848907823 651555317 /nfs/dbraw/zinc/55/53/17/651555317.db2.gz UGJAREKCQIPOKV-UHFFFAOYSA-N 1 2 310.348 2.443 20 10 DECDLO CCc1cccc(C[N@@H+](C)Cc2ncnn2CC(F)F)c1O ZINC000848907823 651555323 /nfs/dbraw/zinc/55/53/23/651555323.db2.gz UGJAREKCQIPOKV-UHFFFAOYSA-N 1 2 310.348 2.443 20 10 DECDLO CC(=O)c1cc(Cl)cc(C[N@H+](C)C[C@H]2COCCO2)c1O ZINC000852495298 652409911 /nfs/dbraw/zinc/40/99/11/652409911.db2.gz IVVZVRQLKIKZFC-ZDUSSCGKSA-N 1 2 313.781 2.095 20 10 DECDLO CC[C@@H](C)NC(=O)[C@H](C)[NH+]1CCN(c2ccc(OC)cc2)CC1 ZINC000042290048 683895937 /nfs/dbraw/zinc/89/59/37/683895937.db2.gz VNHCGDXVRVIDCJ-CABCVRRESA-N 1 2 319.449 2.120 20 10 DECDLO CCOC(=O)C[N@H+](Cc1ccc(N2CCOCC2)cc1)C1CC1 ZINC000091773067 684038744 /nfs/dbraw/zinc/03/87/44/684038744.db2.gz GMUMEHJEQCTZPE-UHFFFAOYSA-N 1 2 318.417 2.051 20 10 DECDLO CCOC(=O)C[N@@H+](Cc1ccc(N2CCOCC2)cc1)C1CC1 ZINC000091773067 684038749 /nfs/dbraw/zinc/03/87/49/684038749.db2.gz GMUMEHJEQCTZPE-UHFFFAOYSA-N 1 2 318.417 2.051 20 10 DECDLO C[C@@H]1C[N@H+](Cc2ccc(N3CCOCC3)c(F)c2)[C@H](C)CO1 ZINC000092017733 684040585 /nfs/dbraw/zinc/04/05/85/684040585.db2.gz NJQFATQLCSGNDR-ZIAGYGMSSA-N 1 2 308.397 2.272 20 10 DECDLO C[C@@H]1C[N@@H+](Cc2ccc(N3CCOCC3)c(F)c2)[C@H](C)CO1 ZINC000092017733 684040588 /nfs/dbraw/zinc/04/05/88/684040588.db2.gz NJQFATQLCSGNDR-ZIAGYGMSSA-N 1 2 308.397 2.272 20 10 DECDLO Cc1nc(CN2CC[NH+](Cc3cc(Cl)ccc3O)CC2)no1 ZINC000093274059 684048472 /nfs/dbraw/zinc/04/84/72/684048472.db2.gz HLFPVEBCWMTHCX-UHFFFAOYSA-N 1 2 322.796 2.055 20 10 DECDLO Cn1c[nH+]cc1CCC(=O)NCCCSc1nccs1 ZINC000193248040 685036227 /nfs/dbraw/zinc/03/62/27/685036227.db2.gz RMPLHMCZTOUGCN-UHFFFAOYSA-N 1 2 310.448 2.108 20 10 DECDLO CC[C@@H](C(=O)NCc1cc(C)ccc1O)[N@@H+]1CCO[C@H](CC)C1 ZINC000862756212 686367789 /nfs/dbraw/zinc/36/77/89/686367789.db2.gz UAERMAATTIZKFO-CVEARBPZSA-N 1 2 320.433 2.206 20 10 DECDLO CC[C@@H](C(=O)NCc1cc(C)ccc1O)[N@H+]1CCO[C@H](CC)C1 ZINC000862756212 686367795 /nfs/dbraw/zinc/36/77/95/686367795.db2.gz UAERMAATTIZKFO-CVEARBPZSA-N 1 2 320.433 2.206 20 10 DECDLO C[C@H]([NH2+]Cc1nncs1)c1ccc(N2CCOCC2)cc1 ZINC000930210975 694113557 /nfs/dbraw/zinc/11/35/57/694113557.db2.gz RCIWXCSPOGTQBJ-LBPRGKRZSA-N 1 2 304.419 2.226 20 10 DECDLO CC[C@H]([NH2+]CCCS(=O)(=O)NC)c1cccc(Cl)c1O ZINC000866458354 687580123 /nfs/dbraw/zinc/58/01/23/687580123.db2.gz HUKDEYGPHJFSEQ-LBPRGKRZSA-N 1 2 320.842 2.026 20 10 DECDLO O=C(NC1CC[NH+](Cc2ccc(F)c(F)c2O)CC1)C1CC1 ZINC000876560645 689856783 /nfs/dbraw/zinc/85/67/83/689856783.db2.gz JMJMVZQXXZNSGK-UHFFFAOYSA-N 1 2 310.344 2.161 20 10 DECDLO C[C@@H]1OCC[C@]12C[N@H+](Cc1ccc(F)c(F)c1O)C[C@@H](C)O2 ZINC000877485719 690127768 /nfs/dbraw/zinc/12/77/68/690127768.db2.gz DVZYWNPMBTVJCE-GDLVEWKHSA-N 1 2 313.344 2.439 20 10 DECDLO C[C@@H]1OCC[C@]12C[N@@H+](Cc1ccc(F)c(F)c1O)C[C@@H](C)O2 ZINC000877485719 690127769 /nfs/dbraw/zinc/12/77/69/690127769.db2.gz DVZYWNPMBTVJCE-GDLVEWKHSA-N 1 2 313.344 2.439 20 10 DECDLO C[C@H]1OCC[C@@]12C[N@H+](Cc1ccc(F)c(F)c1O)C[C@@H](C)O2 ZINC000877485720 690127942 /nfs/dbraw/zinc/12/79/42/690127942.db2.gz DVZYWNPMBTVJCE-GLKRBJQHSA-N 1 2 313.344 2.439 20 10 DECDLO C[C@H]1OCC[C@@]12C[N@@H+](Cc1ccc(F)c(F)c1O)C[C@@H](C)O2 ZINC000877485720 690127944 /nfs/dbraw/zinc/12/79/44/690127944.db2.gz DVZYWNPMBTVJCE-GLKRBJQHSA-N 1 2 313.344 2.439 20 10 DECDLO CCOc1ccc(O)c(C[NH2+]Cc2nc(CSC)n[nH]2)c1 ZINC000886327265 692056911 /nfs/dbraw/zinc/05/69/11/692056911.db2.gz DXVGTNDZDRTEPV-UHFFFAOYSA-N 1 2 308.407 2.062 20 10 DECDLO C[C@@H]([NH2+]Cc1nnc(C2CCOCC2)[nH]1)c1c(O)cccc1F ZINC000886645193 692145888 /nfs/dbraw/zinc/14/58/88/692145888.db2.gz SPDYCXYBSLHDBW-SNVBAGLBSA-N 1 2 320.368 2.394 20 10 DECDLO CCCNC(=O)C[N@H+](CCC)Cc1cc(F)cc(F)c1O ZINC000893969544 692971743 /nfs/dbraw/zinc/97/17/43/692971743.db2.gz VEHSQKMVDSDFMN-UHFFFAOYSA-N 1 2 300.349 2.409 20 10 DECDLO CCCNC(=O)C[N@@H+](CCC)Cc1cc(F)cc(F)c1O ZINC000893969544 692971747 /nfs/dbraw/zinc/97/17/47/692971747.db2.gz VEHSQKMVDSDFMN-UHFFFAOYSA-N 1 2 300.349 2.409 20 10 DECDLO C[C@H](C(=O)NC(C)(C)C)[N@H+](C)Cc1cc(F)cc(F)c1O ZINC001350316138 1151343264 /nfs/dbraw/zinc/34/32/64/1151343264.db2.gz KFNNFNKKBHNHDE-SECBINFHSA-N 1 2 300.349 2.405 20 10 DECDLO C[C@H](C(=O)NC(C)(C)C)[N@@H+](C)Cc1cc(F)cc(F)c1O ZINC001350316138 1151343268 /nfs/dbraw/zinc/34/32/68/1151343268.db2.gz KFNNFNKKBHNHDE-SECBINFHSA-N 1 2 300.349 2.405 20 10 DECDLO C[C@@H]1C[N@@H+](Cc2cc(F)cc(F)c2O)C[C@]2(CCCOC2)O1 ZINC001350320539 1151344060 /nfs/dbraw/zinc/34/40/60/1151344060.db2.gz ZXVBVXNEGDCUMR-BZNIZROVSA-N 1 2 313.344 2.440 20 10 DECDLO COC(=O)[C@@H]1C[C@@H](Nc2ccc(-n3c(C)ccc3C)cc2)C[NH2+]1 ZINC001169131345 785049034 /nfs/dbraw/zinc/04/90/34/785049034.db2.gz ZSIGQXHVUNBEJT-WBVHZDCISA-N 1 2 313.401 2.410 20 10 DECDLO Cc1nc2n(n1)C[C@H]([NH2+]Cc1cc(Cl)cc(F)c1O)CC2 ZINC001177631587 794716322 /nfs/dbraw/zinc/71/63/22/794716322.db2.gz QIAPWBCWIPXKQM-LLVKDONJSA-N 1 2 310.760 2.189 20 10 DECDLO O=C(C1CC1)N1CCC[N@H+](Cc2cc(F)cc(F)c2O)CC1 ZINC001119449019 795303414 /nfs/dbraw/zinc/30/34/14/795303414.db2.gz OUWRNWNIYNFGIX-UHFFFAOYSA-N 1 2 310.344 2.115 20 10 DECDLO OCCC[NH+]1CCN(Cc2cc(Cl)cc(Cl)c2O)CC1 ZINC001203574052 795908720 /nfs/dbraw/zinc/90/87/20/795908720.db2.gz MIFBKRGEZSQPCC-UHFFFAOYSA-N 1 2 319.232 2.199 20 10 DECDLO OC[C@@H]1C[C@H](F)C[N@H+](Cc2c(O)cccc2Br)C1 ZINC001140098860 796477342 /nfs/dbraw/zinc/47/73/42/796477342.db2.gz PLUUDCYGIRJIJG-ZJUUUORDSA-N 1 2 318.186 2.307 20 10 DECDLO OC[C@@H]1C[C@H](F)C[N@@H+](Cc2c(O)cccc2Br)C1 ZINC001140098860 796477345 /nfs/dbraw/zinc/47/73/45/796477345.db2.gz PLUUDCYGIRJIJG-ZJUUUORDSA-N 1 2 318.186 2.307 20 10 DECDLO C[C@H]1CN(C2C[NH+](Cc3c(O)cccc3Cl)C2)C[C@H](C)O1 ZINC001140342602 796511168 /nfs/dbraw/zinc/51/11/68/796511168.db2.gz QOAUWLNZXBUUGD-RYUDHWBXSA-N 1 2 310.825 2.339 20 10 DECDLO CN(C)c1ccc(C[N@@H+]2CCN3C(=O)CC[C@@H]3C2)c(Cl)c1 ZINC001140925835 796598158 /nfs/dbraw/zinc/59/81/58/796598158.db2.gz WNKNVKPNUPCBIC-CQSZACIVSA-N 1 2 307.825 2.213 20 10 DECDLO CN(C)c1ccc(C[N@H+]2CCN3C(=O)CC[C@@H]3C2)c(Cl)c1 ZINC001140925835 796598162 /nfs/dbraw/zinc/59/81/62/796598162.db2.gz WNKNVKPNUPCBIC-CQSZACIVSA-N 1 2 307.825 2.213 20 10 DECDLO CC(C)(C)OC(=O)N1CC[NH+](Cc2cc(O)ccc2O)CC1 ZINC001141156144 796641114 /nfs/dbraw/zinc/64/11/14/796641114.db2.gz RBQUUCOLSOIVEC-UHFFFAOYSA-N 1 2 308.378 2.151 20 10 DECDLO O=C(c1ccc(O)c(O)c1Cl)N1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC001193233130 797527903 /nfs/dbraw/zinc/52/79/03/797527903.db2.gz VDOPGMODCZQWNI-VIFPVBQESA-N 1 2 321.764 2.494 20 10 DECDLO COc1ccc(N2CC[NH+](Cc3cncn3C)CC2)c(C)c1 ZINC001204385978 798460805 /nfs/dbraw/zinc/46/08/05/798460805.db2.gz NBIVNMURISGMME-UHFFFAOYSA-N 1 2 300.406 2.059 20 10 DECDLO COc1ccc2c(c1)c1c(n2C)CCN(Cc2c[nH+]cn2C)C1 ZINC001204388204 798535590 /nfs/dbraw/zinc/53/55/90/798535590.db2.gz XXUKFOMJHFSGAL-UHFFFAOYSA-N 1 2 310.401 2.479 20 10 DECDLO COc1cccc(C[NH+]2CC(NC(=O)OC(C)(C)C)C2)c1O ZINC001203586052 800085785 /nfs/dbraw/zinc/08/57/85/800085785.db2.gz WSBHBPIZVDHWMJ-UHFFFAOYSA-N 1 2 308.378 2.110 20 10 DECDLO COc1ccc(O)c(C[NH+]2CC(NC(=O)OC(C)(C)C)C2)c1 ZINC001203670351 800103550 /nfs/dbraw/zinc/10/35/50/800103550.db2.gz OMRZLOUMLHINSA-UHFFFAOYSA-N 1 2 308.378 2.110 20 10 DECDLO COc1ccc(O)c(C[N@@H+]2C[C@@H]3C[C@H]2[C@@H](C(F)(F)F)O3)c1 ZINC001203680064 800105503 /nfs/dbraw/zinc/10/55/03/800105503.db2.gz BNGQBSMERGTETN-GVXVVHGQSA-N 1 2 303.280 2.305 20 10 DECDLO COc1ccc(O)c(C[N@H+]2C[C@@H]3C[C@H]2[C@@H](C(F)(F)F)O3)c1 ZINC001203680064 800105506 /nfs/dbraw/zinc/10/55/06/800105506.db2.gz BNGQBSMERGTETN-GVXVVHGQSA-N 1 2 303.280 2.305 20 10 DECDLO C[N@H+](CC(=O)OCc1ccccc1)Cc1ccc(O)cc1O ZINC001204277644 800199347 /nfs/dbraw/zinc/19/93/47/800199347.db2.gz HVNLISJBOKIFNH-UHFFFAOYSA-N 1 2 301.342 2.273 20 10 DECDLO C[N@@H+](CC(=O)OCc1ccccc1)Cc1ccc(O)cc1O ZINC001204277644 800199349 /nfs/dbraw/zinc/19/93/49/800199349.db2.gz HVNLISJBOKIFNH-UHFFFAOYSA-N 1 2 301.342 2.273 20 10 DECDLO COc1cc(O)c(C[NH+]2CCN(CCF)CC2)cc1Cl ZINC001232270148 801835441 /nfs/dbraw/zinc/83/54/41/801835441.db2.gz VKUMZQBWSRXPQE-UHFFFAOYSA-N 1 2 302.777 2.141 20 10 DECDLO COC(=O)c1c(C[N@H+](C)Cc2cncnc2)c2ccccc2n1C ZINC001232408329 801872252 /nfs/dbraw/zinc/87/22/52/801872252.db2.gz BLUMIZFLUWASFP-UHFFFAOYSA-N 1 2 324.384 2.387 20 10 DECDLO COC(=O)c1c(C[N@@H+](C)Cc2cncnc2)c2ccccc2n1C ZINC001232408329 801872258 /nfs/dbraw/zinc/87/22/58/801872258.db2.gz BLUMIZFLUWASFP-UHFFFAOYSA-N 1 2 324.384 2.387 20 10 DECDLO CN(C)c1ccc(C[N@@H+]2CCO[C@@H](C(F)(F)F)C2)c(O)c1 ZINC001232840294 801969255 /nfs/dbraw/zinc/96/92/55/801969255.db2.gz RTUXSONVOLMXQZ-CYBMUJFWSA-N 1 2 304.312 2.221 20 10 DECDLO CN(C)c1ccc(C[N@H+]2CCO[C@@H](C(F)(F)F)C2)c(O)c1 ZINC001232840294 801969258 /nfs/dbraw/zinc/96/92/58/801969258.db2.gz RTUXSONVOLMXQZ-CYBMUJFWSA-N 1 2 304.312 2.221 20 10 DECDLO COc1ccc2c(c1)CC[N@@H+](Cc1cc(O)c(O)c(O)c1)C2 ZINC001233009771 802002005 /nfs/dbraw/zinc/00/20/05/802002005.db2.gz ANYTYKHREYGOPH-UHFFFAOYSA-N 1 2 301.342 2.370 20 10 DECDLO COc1ccc2c(c1)CC[N@H+](Cc1cc(O)c(O)c(O)c1)C2 ZINC001233009771 802002015 /nfs/dbraw/zinc/00/20/15/802002015.db2.gz ANYTYKHREYGOPH-UHFFFAOYSA-N 1 2 301.342 2.370 20 10 DECDLO C[C@H]1C[N@H+](Cc2c(O)cc(Br)cc2F)CC[C@@H]1O ZINC001233028320 802006481 /nfs/dbraw/zinc/00/64/81/802006481.db2.gz NFYFIOKQUPMYKQ-UFBFGSQYSA-N 1 2 318.186 2.497 20 10 DECDLO C[C@H]1C[N@@H+](Cc2c(O)cc(Br)cc2F)CC[C@@H]1O ZINC001233028320 802006489 /nfs/dbraw/zinc/00/64/89/802006489.db2.gz NFYFIOKQUPMYKQ-UFBFGSQYSA-N 1 2 318.186 2.497 20 10 DECDLO OC[C@@H]1CC[N@H+](Cc2c(O)cc(Br)cc2F)C1 ZINC001233029365 802009323 /nfs/dbraw/zinc/00/93/23/802009323.db2.gz BMXHWXOJSHINII-MRVPVSSYSA-N 1 2 304.159 2.108 20 10 DECDLO OC[C@@H]1CC[N@@H+](Cc2c(O)cc(Br)cc2F)C1 ZINC001233029365 802009331 /nfs/dbraw/zinc/00/93/31/802009331.db2.gz BMXHWXOJSHINII-MRVPVSSYSA-N 1 2 304.159 2.108 20 10 DECDLO COC[C@H]1C[N@H+](Cc2c(O)ccc(F)c2F)Cc2cn(C)nc21 ZINC001233333226 802080128 /nfs/dbraw/zinc/08/01/28/802080128.db2.gz OJWSGOZMJZOFBG-LLVKDONJSA-N 1 2 323.343 2.150 20 10 DECDLO COC[C@H]1C[N@@H+](Cc2c(O)ccc(F)c2F)Cc2cn(C)nc21 ZINC001233333226 802080134 /nfs/dbraw/zinc/08/01/34/802080134.db2.gz OJWSGOZMJZOFBG-LLVKDONJSA-N 1 2 323.343 2.150 20 10 DECDLO Cc1cc(N(C)C)ccc1CNC(=O)NCc1ccc[nH+]c1N ZINC001227355486 803233972 /nfs/dbraw/zinc/23/39/72/803233972.db2.gz KUOKAAVOQZZALG-UHFFFAOYSA-N 1 2 313.405 2.038 20 10 DECDLO Cn1ccnc1[C@H]([NH2+]Cc1cccc(F)c1O)C(C)(C)CO ZINC001474538845 1060890705 /nfs/dbraw/zinc/89/07/05/1060890705.db2.gz XKBDYSVWOZFNGO-AWEZNQCLSA-N 1 2 307.369 2.114 20 10 DECDLO Cc1ccc(CC[NH2+][C@H](C)c2cccc(-c3nn[nH]n3)c2O)o1 ZINC001592152221 1076860548 /nfs/dbraw/zinc/86/05/48/1076860548.db2.gz RRXBXMGOPIYTBD-LLVKDONJSA-N 1 2 313.361 2.367 20 10 DECDLO COc1cc(N(C)CCCn2cc[nH+]c2)c([N+](=O)[O-])cc1OC ZINC001651636523 1079822485 /nfs/dbraw/zinc/82/24/85/1079822485.db2.gz QGOJIIADPJTIMY-UHFFFAOYSA-N 1 2 320.349 2.335 20 10 DECDLO COc1c(O)c(C[N@H+](C)Cc2cccc(=O)[nH]2)ccc1[N+](=O)[O-] ZINC001658963881 1080222941 /nfs/dbraw/zinc/22/29/41/1080222941.db2.gz ONBXEVFNMHQZQX-UHFFFAOYSA-N 1 2 319.317 2.042 20 10 DECDLO COc1c(O)c(C[N@@H+](C)Cc2cccc(=O)[nH]2)ccc1[N+](=O)[O-] ZINC001658963881 1080222947 /nfs/dbraw/zinc/22/29/47/1080222947.db2.gz ONBXEVFNMHQZQX-UHFFFAOYSA-N 1 2 319.317 2.042 20 10 DECDLO CN1c2ccccc2C[C@H]([NH2+]Cc2ccc(F)c(F)c2O)C1=O ZINC001660268088 1080299189 /nfs/dbraw/zinc/29/91/89/1080299189.db2.gz NWPYKIPBPMEHEY-ZDUSSCGKSA-N 1 2 318.323 2.348 20 10 DECDLO OC[C@]1(F)CC[N@H+](Cc2c(O)cccc2OC(F)(F)F)C1 ZINC001237120718 1080443868 /nfs/dbraw/zinc/44/38/68/1080443868.db2.gz RNGFTQZMIZDWBI-LBPRGKRZSA-N 1 2 309.259 2.197 20 10 DECDLO OC[C@]1(F)CC[N@@H+](Cc2c(O)cccc2OC(F)(F)F)C1 ZINC001237120718 1080443872 /nfs/dbraw/zinc/44/38/72/1080443872.db2.gz RNGFTQZMIZDWBI-LBPRGKRZSA-N 1 2 309.259 2.197 20 10 DECDLO C[C@@]1(CO)CC[N@H+](Cc2cc(Br)cc(F)c2O)C1 ZINC001235058241 1084293691 /nfs/dbraw/zinc/29/36/91/1084293691.db2.gz ZVLRFYRQZBCJMM-CYBMUJFWSA-N 1 2 318.186 2.498 20 10 DECDLO C[C@@]1(CO)CC[N@@H+](Cc2cc(Br)cc(F)c2O)C1 ZINC001235058241 1084293700 /nfs/dbraw/zinc/29/37/00/1084293700.db2.gz ZVLRFYRQZBCJMM-CYBMUJFWSA-N 1 2 318.186 2.498 20 10 DECDLO CC(C)NC(=O)N1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1c(O)cccc1F ZINC001276360955 1089583736 /nfs/dbraw/zinc/58/37/36/1089583736.db2.gz YTSKERONOOSCAA-BETUJISGSA-N 1 2 321.396 2.298 20 10 DECDLO CC(C)NC(=O)N1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1c(O)cccc1F ZINC001276360955 1089583746 /nfs/dbraw/zinc/58/37/46/1089583746.db2.gz YTSKERONOOSCAA-BETUJISGSA-N 1 2 321.396 2.298 20 10 DECDLO CN1CC[C@@]2(CCC[N@@H+]2Cc2cc(F)c(Cl)cc2O)C1=O ZINC001274063030 1093787104 /nfs/dbraw/zinc/78/71/04/1093787104.db2.gz FXLVSJQICYIHFU-HNNXBMFYSA-N 1 2 312.772 2.381 20 10 DECDLO CN1CC[C@@]2(CCC[N@H+]2Cc2cc(F)c(Cl)cc2O)C1=O ZINC001274063030 1093787109 /nfs/dbraw/zinc/78/71/09/1093787109.db2.gz FXLVSJQICYIHFU-HNNXBMFYSA-N 1 2 312.772 2.381 20 10 DECDLO NC(=O)NC1CC[NH+](Cc2cc(Cl)c(Cl)cc2O)CC1 ZINC001236793682 1138429352 /nfs/dbraw/zinc/42/93/52/1138429352.db2.gz NISBRNSXKLHIRC-UHFFFAOYSA-N 1 2 318.204 2.332 20 10 DECDLO COc1ccc(C[NH+]2CCC3(CCC(=O)N3)CC2)c(O)c1Cl ZINC001236810338 1138434544 /nfs/dbraw/zinc/43/45/44/1138434544.db2.gz UDBZYWCQNMDYMD-UHFFFAOYSA-N 1 2 324.808 2.299 20 10 DECDLO CCNC(=O)[C@@H]1CCC[N@@H+]1Cc1ccc(OC)c(Cl)c1O ZINC001236819683 1138438850 /nfs/dbraw/zinc/43/88/50/1138438850.db2.gz ZFIAMWRAUVDVNP-NSHDSACASA-N 1 2 312.797 2.155 20 10 DECDLO CCNC(=O)[C@@H]1CCC[N@H+]1Cc1ccc(OC)c(Cl)c1O ZINC001236819683 1138438852 /nfs/dbraw/zinc/43/88/52/1138438852.db2.gz ZFIAMWRAUVDVNP-NSHDSACASA-N 1 2 312.797 2.155 20 10 DECDLO COc1cc(N(C)C)ccc1C[N@H+]1CCN[C@@H](C(F)(F)F)C1 ZINC001236997244 1138478205 /nfs/dbraw/zinc/47/82/05/1138478205.db2.gz ROYITJGRLJDHFN-CQSZACIVSA-N 1 2 317.355 2.097 20 10 DECDLO COc1cc(N(C)C)ccc1C[N@@H+]1CCN[C@@H](C(F)(F)F)C1 ZINC001236997244 1138478199 /nfs/dbraw/zinc/47/81/99/1138478199.db2.gz ROYITJGRLJDHFN-CQSZACIVSA-N 1 2 317.355 2.097 20 10 DECDLO COC(=O)N1CCC[N@H+](Cc2c(O)ccc(F)c2Cl)CC1 ZINC001237123665 1138508031 /nfs/dbraw/zinc/50/80/31/1138508031.db2.gz KFGNKFQQSBJDDL-UHFFFAOYSA-N 1 2 316.760 2.459 20 10 DECDLO COC(=O)N1CCC[N@@H+](Cc2c(O)ccc(F)c2Cl)CC1 ZINC001237123665 1138508035 /nfs/dbraw/zinc/50/80/35/1138508035.db2.gz KFGNKFQQSBJDDL-UHFFFAOYSA-N 1 2 316.760 2.459 20 10 DECDLO COC(=O)[C@H](Cc1ccc(O)c(O)c1)[NH2+][C@@H]1CCC(C)(C)C1 ZINC001258592006 1144023532 /nfs/dbraw/zinc/02/35/32/1144023532.db2.gz JQHKXZGLUFELMS-OLZOCXBDSA-N 1 2 307.390 2.350 20 10 DECDLO C[C@@H]1CN(C(=O)c2cc3cc(O)c(O)cc3s2)CC[N@@H+]1C ZINC001262154693 1144296452 /nfs/dbraw/zinc/29/64/52/1144296452.db2.gz OINYCPXEZWDASN-SECBINFHSA-N 1 2 306.387 2.089 20 10 DECDLO C[C@@H]1CN(C(=O)c2cc3cc(O)c(O)cc3s2)CC[N@H+]1C ZINC001262154693 1144296453 /nfs/dbraw/zinc/29/64/53/1144296453.db2.gz OINYCPXEZWDASN-SECBINFHSA-N 1 2 306.387 2.089 20 10 DECDLO C[C@H](CS(C)(=O)=O)[NH2+]Cc1cc(Cl)cc(Cl)c1O ZINC000078639894 224517915 /nfs/dbraw/zinc/51/79/15/224517915.db2.gz DLOGZPSUXCGBLI-SSDOTTSWSA-N 1 2 312.218 2.222 20 10 DECDLO COc1c(O)c(CN[C@H](C)C[N@H+](C)C(C)C)ccc1[N+](=O)[O-] ZINC000291526152 286187105 /nfs/dbraw/zinc/18/71/05/286187105.db2.gz JQWRWHVDZOYWBI-LLVKDONJSA-N 1 2 311.382 2.127 20 10 DECDLO COc1c(O)c(CN[C@H](C)C[N@@H+](C)C(C)C)ccc1[N+](=O)[O-] ZINC000291526152 286187106 /nfs/dbraw/zinc/18/71/06/286187106.db2.gz JQWRWHVDZOYWBI-LLVKDONJSA-N 1 2 311.382 2.127 20 10 DECDLO CN1CC[N@H+](C)C[C@H]1C[NH2+]Cc1cc(Cl)cc(Cl)c1[O-] ZINC000068801499 402206102 /nfs/dbraw/zinc/20/61/02/402206102.db2.gz KBRLJZUHLRFRRW-GFCCVEGCSA-N 1 2 318.248 2.034 20 10 DECDLO CN1CC[N@@H+](C)C[C@H]1C[NH2+]Cc1cc(Cl)cc(Cl)c1[O-] ZINC000068801499 402206103 /nfs/dbraw/zinc/20/61/03/402206103.db2.gz KBRLJZUHLRFRRW-GFCCVEGCSA-N 1 2 318.248 2.034 20 10 DECDLO CC[C@H]1CO[C@H](C)C[N@@H+]1Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000278284110 402862360 /nfs/dbraw/zinc/86/23/60/402862360.db2.gz UAMUJYULMQEHTJ-PWSUYJOCSA-N 1 2 310.350 2.308 20 10 DECDLO CC[C@H]1CO[C@H](C)C[N@H+]1Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000278284110 402862361 /nfs/dbraw/zinc/86/23/61/402862361.db2.gz UAMUJYULMQEHTJ-PWSUYJOCSA-N 1 2 310.350 2.308 20 10 DECDLO COC(=O)C[N@H+](C)Cc1ccc(N(C)C)cc1C(F)(F)F ZINC000279741313 402961491 /nfs/dbraw/zinc/96/14/91/402961491.db2.gz WYWDPHOIUSXKBL-UHFFFAOYSA-N 1 2 304.312 2.376 20 10 DECDLO COC(=O)C[N@@H+](C)Cc1ccc(N(C)C)cc1C(F)(F)F ZINC000279741313 402961493 /nfs/dbraw/zinc/96/14/93/402961493.db2.gz WYWDPHOIUSXKBL-UHFFFAOYSA-N 1 2 304.312 2.376 20 10 DECDLO OC[C@@H](C[NH2+]Cc1cc(Cl)cc(Cl)c1O)[C@H]1CCOC1 ZINC000280337508 402989986 /nfs/dbraw/zinc/98/99/86/402989986.db2.gz QZZFCQZHJYWRPK-GXSJLCMTSA-N 1 2 320.216 2.434 20 10 DECDLO COC(=O)[C@H]([NH2+]Cc1cc(Br)ccc1O)C1CC1 ZINC000276467553 403177976 /nfs/dbraw/zinc/17/79/76/403177976.db2.gz MGTDLWMLLDPKSZ-GFCCVEGCSA-N 1 2 314.179 2.196 20 10 DECDLO Cn1ccnc1[C@@H]1[N@H+](Cc2cc3c(cc2O)OCO3)CC1(C)C ZINC000294736313 403725979 /nfs/dbraw/zinc/72/59/79/403725979.db2.gz GSIYBLKHKULAOY-HNNXBMFYSA-N 1 2 315.373 2.438 20 10 DECDLO Cn1ccnc1[C@@H]1[N@@H+](Cc2cc3c(cc2O)OCO3)CC1(C)C ZINC000294736313 403725984 /nfs/dbraw/zinc/72/59/84/403725984.db2.gz GSIYBLKHKULAOY-HNNXBMFYSA-N 1 2 315.373 2.438 20 10 DECDLO Cn1cc[nH+]c1[C@@H]1N(Cc2cc3c(cc2O)OCO3)CC1(C)C ZINC000294736313 403725986 /nfs/dbraw/zinc/72/59/86/403725986.db2.gz GSIYBLKHKULAOY-HNNXBMFYSA-N 1 2 315.373 2.438 20 10 DECDLO COc1cccc(C[N@@H+]2CCOC[C@@H]2c2c(C)n[nH]c2C)c1O ZINC000360828209 404839913 /nfs/dbraw/zinc/83/99/13/404839913.db2.gz HXTYSGXFCQZYHF-CQSZACIVSA-N 1 2 317.389 2.314 20 10 DECDLO COc1cccc(C[N@H+]2CCOC[C@@H]2c2c(C)n[nH]c2C)c1O ZINC000360828209 404839917 /nfs/dbraw/zinc/83/99/17/404839917.db2.gz HXTYSGXFCQZYHF-CQSZACIVSA-N 1 2 317.389 2.314 20 10 DECDLO OC[C@@H]1C[C@H](F)C[N@@H+]1Cc1cc(Br)ccc1O ZINC000372635729 227094479 /nfs/dbraw/zinc/09/44/79/227094479.db2.gz CQMKCMNORHZPMG-QWRGUYRKSA-N 1 2 304.159 2.059 20 10 DECDLO OC[C@@H]1C[C@H](F)C[N@H+]1Cc1cc(Br)ccc1O ZINC000372635729 227094485 /nfs/dbraw/zinc/09/44/85/227094485.db2.gz CQMKCMNORHZPMG-QWRGUYRKSA-N 1 2 304.159 2.059 20 10 DECDLO CC[N@H+](Cc1cccc(Cl)c1O)[C@H](C)CS(C)(=O)=O ZINC000180244436 279237711 /nfs/dbraw/zinc/23/77/11/279237711.db2.gz CGIKLENJXKYCGL-SNVBAGLBSA-N 1 2 305.827 2.301 20 10 DECDLO CC[N@@H+](Cc1cccc(Cl)c1O)[C@H](C)CS(C)(=O)=O ZINC000180244436 279237713 /nfs/dbraw/zinc/23/77/13/279237713.db2.gz CGIKLENJXKYCGL-SNVBAGLBSA-N 1 2 305.827 2.301 20 10 DECDLO COC(=O)C[C@H]1COCC[N@@H+]1C/C=C/c1ccc(N(C)C)cc1 ZINC000835053624 649872261 /nfs/dbraw/zinc/87/22/61/649872261.db2.gz ONGGLPGNOZCIHG-BDUNBXCCSA-N 1 2 318.417 2.030 20 10 DECDLO COC(=O)C[C@H]1COCC[N@H+]1C/C=C/c1ccc(N(C)C)cc1 ZINC000835053624 649872263 /nfs/dbraw/zinc/87/22/63/649872263.db2.gz ONGGLPGNOZCIHG-BDUNBXCCSA-N 1 2 318.417 2.030 20 10 DECDLO O=S1(=O)CC[C@H]([N@H+](Cc2cc(Cl)ccc2O)C2CC2)C1 ZINC000157036845 624105183 /nfs/dbraw/zinc/10/51/83/624105183.db2.gz IGYVUIDGBQFQRF-ZDUSSCGKSA-N 1 2 315.822 2.197 20 10 DECDLO O=S1(=O)CC[C@H]([N@@H+](Cc2cc(Cl)ccc2O)C2CC2)C1 ZINC000157036845 624105184 /nfs/dbraw/zinc/10/51/84/624105184.db2.gz IGYVUIDGBQFQRF-ZDUSSCGKSA-N 1 2 315.822 2.197 20 10 DECDLO CNc1cc(NC[C@@H]2CCN(c3ccc(OC)cc3)C2)[nH+]cn1 ZINC000894269905 636634426 /nfs/dbraw/zinc/63/44/26/636634426.db2.gz XCNPNQCVLOYUOS-ZDUSSCGKSA-N 1 2 313.405 2.465 20 10 DECDLO Oc1c(F)cc(Br)cc1C[N@@H+]1CC[C@@]2(O)C[C@H]2C1 ZINC000895276446 637876666 /nfs/dbraw/zinc/87/66/66/637876666.db2.gz RUWLNPGJUPXENO-TVQRCGJNSA-N 1 2 316.170 2.251 20 10 DECDLO Oc1c(F)cc(Br)cc1C[N@H+]1CC[C@@]2(O)C[C@H]2C1 ZINC000895276446 637876671 /nfs/dbraw/zinc/87/66/71/637876671.db2.gz RUWLNPGJUPXENO-TVQRCGJNSA-N 1 2 316.170 2.251 20 10 DECDLO COc1ccc(N2CCC[N@H+](Cn3ccsc3=O)CC2)cc1 ZINC000746603523 638360421 /nfs/dbraw/zinc/36/04/21/638360421.db2.gz PTLXLSPLFINIDC-UHFFFAOYSA-N 1 2 319.430 2.088 20 10 DECDLO COc1ccc(N2CCC[N@@H+](Cn3ccsc3=O)CC2)cc1 ZINC000746603523 638360431 /nfs/dbraw/zinc/36/04/31/638360431.db2.gz PTLXLSPLFINIDC-UHFFFAOYSA-N 1 2 319.430 2.088 20 10 DECDLO Cc1cc(C(=O)NCCc2c[nH+]cn2C)c(C)n1-c1ccccn1 ZINC000753680112 639329521 /nfs/dbraw/zinc/32/95/21/639329521.db2.gz VIBKASUNLQWOGO-UHFFFAOYSA-N 1 2 323.400 2.195 20 10 DECDLO CCOc1ccc(C[NH+]2CCN(CC(F)(F)F)CC2)c(O)c1 ZINC000768220492 641060028 /nfs/dbraw/zinc/06/00/28/641060028.db2.gz QETPBQUJGZLXRT-UHFFFAOYSA-N 1 2 318.339 2.471 20 10 DECDLO C[C@H]([NH2+]CC1(N2CCOCC2)CC1)c1cc(F)cc(F)c1O ZINC000774382052 641897325 /nfs/dbraw/zinc/89/73/25/641897325.db2.gz FBDAKISZBPOURE-NSHDSACASA-N 1 2 312.360 2.186 20 10 DECDLO C[C@@H](NC(=O)c1cc([C@@H]2CCC[N@@H+]2C)n[nH]1)c1ccccc1O ZINC000899182330 641974549 /nfs/dbraw/zinc/97/45/49/641974549.db2.gz XUEQZJZDFQDCQJ-ABAIWWIYSA-N 1 2 314.389 2.373 20 10 DECDLO C[C@@H](NC(=O)c1cc([C@@H]2CCC[N@H+]2C)n[nH]1)c1ccccc1O ZINC000899182330 641974551 /nfs/dbraw/zinc/97/45/51/641974551.db2.gz XUEQZJZDFQDCQJ-ABAIWWIYSA-N 1 2 314.389 2.373 20 10 DECDLO CN(C)c1ccc(CNC(=O)CNc2cccc[nH+]2)cc1F ZINC000900434547 642370468 /nfs/dbraw/zinc/37/04/68/642370468.db2.gz MJITXBQZWJMFLI-UHFFFAOYSA-N 1 2 302.353 2.015 20 10 DECDLO C[C@H]([NH2+][C@@H]1CCn2cc[nH+]c2C1)c1cc([N+](=O)[O-])ccc1[O-] ZINC000779062342 642459645 /nfs/dbraw/zinc/45/96/45/642459645.db2.gz SMJZDXMHWBQXHR-WDEREUQCSA-N 1 2 302.334 2.163 20 10 DECDLO C[N@H+](Cc1cc(Cl)cc(F)c1O)CC1(O)CCOCC1 ZINC000783714831 643041395 /nfs/dbraw/zinc/04/13/95/643041395.db2.gz FXVOPKRJGXOODL-UHFFFAOYSA-N 1 2 303.761 2.158 20 10 DECDLO C[N@@H+](Cc1cc(Cl)cc(F)c1O)CC1(O)CCOCC1 ZINC000783714831 643041396 /nfs/dbraw/zinc/04/13/96/643041396.db2.gz FXVOPKRJGXOODL-UHFFFAOYSA-N 1 2 303.761 2.158 20 10 DECDLO CN(C)c1nccc(C[NH2+]Cc2c(O)ccc(Cl)c2F)n1 ZINC000790991411 643917813 /nfs/dbraw/zinc/91/78/13/643917813.db2.gz WUAFIENUQAUZQY-UHFFFAOYSA-N 1 2 310.760 2.331 20 10 DECDLO COc1ccc(O)c(C[N@H+](CCO)Cc2cccnc2Cl)c1 ZINC000793365141 644240895 /nfs/dbraw/zinc/24/08/95/644240895.db2.gz DQGYLLXVDNSRNJ-UHFFFAOYSA-N 1 2 322.792 2.444 20 10 DECDLO COc1ccc(O)c(C[N@@H+](CCO)Cc2cccnc2Cl)c1 ZINC000793365141 644240897 /nfs/dbraw/zinc/24/08/97/644240897.db2.gz DQGYLLXVDNSRNJ-UHFFFAOYSA-N 1 2 322.792 2.444 20 10 DECDLO COC(=O)c1cnoc1C[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000796009420 644672541 /nfs/dbraw/zinc/67/25/41/644672541.db2.gz CQXDPUSWSURJKW-LLVKDONJSA-N 1 2 303.362 2.378 20 10 DECDLO Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)CCn1cc[nH+]c1 ZINC000839918198 645296583 /nfs/dbraw/zinc/29/65/83/645296583.db2.gz KVXFOZMIKZOQJI-HNNXBMFYSA-N 1 2 314.433 2.395 20 10 DECDLO OC[C@]1(F)CC[N@H+](Cc2cc(Br)ccc2O)C1 ZINC000802660384 645542449 /nfs/dbraw/zinc/54/24/49/645542449.db2.gz KBNFICXKAVPXBE-LBPRGKRZSA-N 1 2 304.159 2.061 20 10 DECDLO OC[C@]1(F)CC[N@@H+](Cc2cc(Br)ccc2O)C1 ZINC000802660384 645542453 /nfs/dbraw/zinc/54/24/53/645542453.db2.gz KBNFICXKAVPXBE-LBPRGKRZSA-N 1 2 304.159 2.061 20 10 DECDLO CCc1nnc(C[NH2+][C@H](C)c2cc(C(=O)OC)ccc2O)s1 ZINC000810260548 646345657 /nfs/dbraw/zinc/34/56/57/646345657.db2.gz LSBQJHIEIVPLMR-SECBINFHSA-N 1 2 321.402 2.444 20 10 DECDLO COCCN1CCC[C@H]1C[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000816546517 647149496 /nfs/dbraw/zinc/14/94/96/647149496.db2.gz MNDOOMWOOUKNPS-LBPRGKRZSA-N 1 2 316.804 2.385 20 10 DECDLO CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)Cc1[nH]cc[nH+]1 ZINC000822898708 648313914 /nfs/dbraw/zinc/31/39/14/648313914.db2.gz RRFGZWSVMJUCDJ-UHFFFAOYSA-N 1 2 300.406 2.455 20 10 DECDLO Cc1cc(O)c(C[N@H+]2CCC[C@H](S(C)(=O)=O)C2)cc1Cl ZINC000825520188 648775071 /nfs/dbraw/zinc/77/50/71/648775071.db2.gz VSBFEQGAQUUDPS-LBPRGKRZSA-N 1 2 317.838 2.363 20 10 DECDLO COc1ccc(O)c([C@@H](C)NC(=O)[C@@H]2C[C@H]2c2c[nH+]cn2C)c1 ZINC000830541440 649458964 /nfs/dbraw/zinc/45/89/64/649458964.db2.gz XZFQAISDUAYOAR-LERXQTSPSA-N 1 2 315.373 2.115 20 10 DECDLO CCn1ccnc1C[N@H+](C)CCN(C)c1ccc(OC)cc1 ZINC000844400239 651122669 /nfs/dbraw/zinc/12/26/69/651122669.db2.gz XUGVDDWNMSMGQA-UHFFFAOYSA-N 1 2 302.422 2.480 20 10 DECDLO CCn1ccnc1C[N@@H+](C)CCN(C)c1ccc(OC)cc1 ZINC000844400239 651122672 /nfs/dbraw/zinc/12/26/72/651122672.db2.gz XUGVDDWNMSMGQA-UHFFFAOYSA-N 1 2 302.422 2.480 20 10 DECDLO C[C@@H]([NH2+]Cc1nc([C@@H]2CCCO2)n[nH]1)c1cc(F)ccc1O ZINC000848558174 651470675 /nfs/dbraw/zinc/47/06/75/651470675.db2.gz OSBJQFGGHMIWAY-RNCFNFMXSA-N 1 2 306.341 2.352 20 10 DECDLO Cc1nc(C[N@@H+](C)Cc2ccc(N3CCOCC3)cc2)co1 ZINC000851716443 652212988 /nfs/dbraw/zinc/21/29/88/652212988.db2.gz MMVIETIUNFMEOC-UHFFFAOYSA-N 1 2 301.390 2.452 20 10 DECDLO Cc1nc(C[N@H+](C)Cc2ccc(N3CCOCC3)cc2)co1 ZINC000851716443 652212991 /nfs/dbraw/zinc/21/29/91/652212991.db2.gz MMVIETIUNFMEOC-UHFFFAOYSA-N 1 2 301.390 2.452 20 10 DECDLO CC(=O)c1cc(Cl)cc(CN2CCn3c[nH+]cc3C2)c1O ZINC000852061208 652328204 /nfs/dbraw/zinc/32/82/04/652328204.db2.gz PPCGDYMXUZTDLU-UHFFFAOYSA-N 1 2 305.765 2.461 20 10 DECDLO O=C(NCCCSc1nccs1)[C@H]1CCn2c[nH+]cc2C1 ZINC000132417398 684208887 /nfs/dbraw/zinc/20/88/87/684208887.db2.gz NGOXETFSPUUHFQ-NSHDSACASA-N 1 2 322.459 2.201 20 10 DECDLO CN(C)c1cc(F)c(C[N@@H+]2CCSC[C@H]2CCO)cc1F ZINC000862251772 686266230 /nfs/dbraw/zinc/26/62/30/686266230.db2.gz MTZACGWRMPYBPV-GFCCVEGCSA-N 1 2 316.417 2.331 20 10 DECDLO CN(C)c1cc(F)c(C[N@H+]2CCSC[C@H]2CCO)cc1F ZINC000862251772 686266231 /nfs/dbraw/zinc/26/62/31/686266231.db2.gz MTZACGWRMPYBPV-GFCCVEGCSA-N 1 2 316.417 2.331 20 10 DECDLO O=C1[C@H]([NH2+]Cc2cc(Cl)cc(F)c2O)CCN1C1CCC1 ZINC000862550183 686320747 /nfs/dbraw/zinc/32/07/47/686320747.db2.gz CBPVCXVQQBNEDW-CYBMUJFWSA-N 1 2 312.772 2.428 20 10 DECDLO C[C@H](C(=O)NC(C)(C)C)[N@H+](C)Cc1ccc(F)c(F)c1O ZINC000877424762 690108338 /nfs/dbraw/zinc/10/83/38/690108338.db2.gz OXKIVWSQQRNBSD-SECBINFHSA-N 1 2 300.349 2.405 20 10 DECDLO C[C@H](C(=O)NC(C)(C)C)[N@@H+](C)Cc1ccc(F)c(F)c1O ZINC000877424762 690108340 /nfs/dbraw/zinc/10/83/40/690108340.db2.gz OXKIVWSQQRNBSD-SECBINFHSA-N 1 2 300.349 2.405 20 10 DECDLO Oc1c(Br)cc(Cl)cc1C[NH2+][C@@H]1CC[C@H]1O ZINC000883150458 691442001 /nfs/dbraw/zinc/44/20/01/691442001.db2.gz IOVWHITWQNMXFY-NXEZZACHSA-N 1 2 306.587 2.421 20 10 DECDLO CCn1cc(C[N@@H+](Cc2ccccc2O)C[C@@H]2CCCO2)nn1 ZINC000886151981 692012757 /nfs/dbraw/zinc/01/27/57/692012757.db2.gz ZCLPUWFKUVZYEM-INIZCTEOSA-N 1 2 316.405 2.185 20 10 DECDLO CCn1cc(C[N@H+](Cc2ccccc2O)C[C@@H]2CCCO2)nn1 ZINC000886151981 692012759 /nfs/dbraw/zinc/01/27/59/692012759.db2.gz ZCLPUWFKUVZYEM-INIZCTEOSA-N 1 2 316.405 2.185 20 10 DECDLO C[Si](C)(C)c1ccc[nH+]c1NCCc1cc(O)c(O)cc1O ZINC001168006384 779274857 /nfs/dbraw/zinc/27/48/57/779274857.db2.gz MOORBZBKSYTGRJ-UHFFFAOYSA-N 1 2 318.449 2.398 20 10 DECDLO C[NH+]1CCN(Cc2cc(Br)cc(F)c2O)CC1 ZINC000715701054 792506926 /nfs/dbraw/zinc/50/69/26/792506926.db2.gz BPPJPNJHDQITFH-UHFFFAOYSA-N 1 2 303.175 2.041 20 10 DECDLO Oc1c(F)ccc(F)c1CN1CC([NH+]2CCC(F)CC2)C1 ZINC001139684071 794888365 /nfs/dbraw/zinc/88/83/65/794888365.db2.gz QCXASMMCVSCPBW-UHFFFAOYSA-N 1 2 300.324 2.289 20 10 DECDLO Oc1cccc(F)c1C[NH+]1CCN(Cc2ccccn2)CC1 ZINC001137834551 796144406 /nfs/dbraw/zinc/14/44/06/796144406.db2.gz KOZHAWVDFQLTIX-UHFFFAOYSA-N 1 2 301.365 2.244 20 10 DECDLO Oc1c(F)cccc1C[NH+]1CCN(c2nccnc2Cl)CC1 ZINC001138123874 796165964 /nfs/dbraw/zinc/16/59/64/796165964.db2.gz PJHILZHWBXTETO-UHFFFAOYSA-N 1 2 322.771 2.297 20 10 DECDLO CCOC[C@@H]1C[N@H+](Cc2cccc(F)c2O)Cc2c1cnn2C ZINC001138123920 796166142 /nfs/dbraw/zinc/16/61/42/796166142.db2.gz ROURIWJOQKMGCB-ZDUSSCGKSA-N 1 2 319.380 2.401 20 10 DECDLO CCOC[C@@H]1C[N@@H+](Cc2cccc(F)c2O)Cc2c1cnn2C ZINC001138123920 796166146 /nfs/dbraw/zinc/16/61/46/796166146.db2.gz ROURIWJOQKMGCB-ZDUSSCGKSA-N 1 2 319.380 2.401 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[NH+]1CCC(C)(O)CC1 ZINC001139127372 796328638 /nfs/dbraw/zinc/32/86/38/796328638.db2.gz ULSVQCUZCGNYOJ-UHFFFAOYSA-N 1 2 303.358 2.154 20 10 DECDLO CCO[C@@H]1CC[N@H+](Cc2c(O)ccc3c(C)cc(=O)oc32)C1 ZINC001139133707 796332521 /nfs/dbraw/zinc/33/25/21/796332521.db2.gz MLLZFZYPTCEFJQ-GFCCVEGCSA-N 1 2 303.358 2.418 20 10 DECDLO CCO[C@@H]1CC[N@@H+](Cc2c(O)ccc3c(C)cc(=O)oc32)C1 ZINC001139133707 796332524 /nfs/dbraw/zinc/33/25/24/796332524.db2.gz MLLZFZYPTCEFJQ-GFCCVEGCSA-N 1 2 303.358 2.418 20 10 DECDLO CCN1CC[C@@]2(C[N@H+](Cc3c(O)cc(F)cc3F)C[C@@H]2C)C1=O ZINC001140581486 796540955 /nfs/dbraw/zinc/54/09/55/796540955.db2.gz XHZGWZDLRVAMRI-GTNSWQLSSA-N 1 2 324.371 2.361 20 10 DECDLO CCN1CC[C@@]2(C[N@@H+](Cc3c(O)cc(F)cc3F)C[C@@H]2C)C1=O ZINC001140581486 796540958 /nfs/dbraw/zinc/54/09/58/796540958.db2.gz XHZGWZDLRVAMRI-GTNSWQLSSA-N 1 2 324.371 2.361 20 10 DECDLO CN(C)c1ccc(C[N@@H+]2CCO[C@@H]3C[C@@H](CO)C[C@@H]32)c(Cl)c1 ZINC001140922267 796597672 /nfs/dbraw/zinc/59/76/72/796597672.db2.gz MKSQWWAUVXYTNE-AFAVFJNCSA-N 1 2 324.852 2.378 20 10 DECDLO CN(C)c1ccc(C[N@H+]2CCO[C@@H]3C[C@@H](CO)C[C@@H]32)c(Cl)c1 ZINC001140922267 796597675 /nfs/dbraw/zinc/59/76/75/796597675.db2.gz MKSQWWAUVXYTNE-AFAVFJNCSA-N 1 2 324.852 2.378 20 10 DECDLO CCOCc1ncn2c1C[N@@H+](Cc1ccc(C)cc1O)CC2 ZINC001140949367 796605692 /nfs/dbraw/zinc/60/56/92/796605692.db2.gz AABITDBXBDWSEJ-UHFFFAOYSA-N 1 2 301.390 2.449 20 10 DECDLO CCOCc1ncn2c1C[N@H+](Cc1ccc(C)cc1O)CC2 ZINC001140949367 796605691 /nfs/dbraw/zinc/60/56/91/796605691.db2.gz AABITDBXBDWSEJ-UHFFFAOYSA-N 1 2 301.390 2.449 20 10 DECDLO CC(C)(C)OC(=O)N1CC2(CC[N@@H+]2Cc2cc(O)ccc2O)C1 ZINC001141156275 796640672 /nfs/dbraw/zinc/64/06/72/796640672.db2.gz ITXHQKOSEOQUCR-UHFFFAOYSA-N 1 2 320.389 2.293 20 10 DECDLO CC(C)(C)OC(=O)N1CC2(CC[N@H+]2Cc2cc(O)ccc2O)C1 ZINC001141156275 796640677 /nfs/dbraw/zinc/64/06/77/796640677.db2.gz ITXHQKOSEOQUCR-UHFFFAOYSA-N 1 2 320.389 2.293 20 10 DECDLO COc1cc(C[N@@H+]2CCC[C@H]2c2cnccn2)cc(O)c1O ZINC001204344304 800207315 /nfs/dbraw/zinc/20/73/15/800207315.db2.gz FZARSTPWNAAMAY-ZDUSSCGKSA-N 1 2 301.346 2.234 20 10 DECDLO COc1cc(C[N@H+]2CCC[C@H]2c2cnccn2)cc(O)c1O ZINC001204344304 800207316 /nfs/dbraw/zinc/20/73/16/800207316.db2.gz FZARSTPWNAAMAY-ZDUSSCGKSA-N 1 2 301.346 2.234 20 10 DECDLO CN(C)c1ccc(C[N@@H+]2CC(F)(F)C[C@@]2(C)CO)c(O)c1 ZINC001232836311 801969388 /nfs/dbraw/zinc/96/93/88/801969388.db2.gz NDASZXDAMNJEAI-AWEZNQCLSA-N 1 2 300.349 2.050 20 10 DECDLO CN(C)c1ccc(C[N@H+]2CC(F)(F)C[C@@]2(C)CO)c(O)c1 ZINC001232836311 801969393 /nfs/dbraw/zinc/96/93/93/801969393.db2.gz NDASZXDAMNJEAI-AWEZNQCLSA-N 1 2 300.349 2.050 20 10 DECDLO Oc1c(C[N@@H+]2CC[C@@H](Oc3ncccn3)C2)ccc(F)c1F ZINC001233079643 802023699 /nfs/dbraw/zinc/02/36/99/802023699.db2.gz IOPIURJILKUHTO-LLVKDONJSA-N 1 2 307.300 2.114 20 10 DECDLO C[C@@H]1C(=O)N(C)CC[N@H+]1Cc1ccc(C(F)(F)F)cc1O ZINC001233454764 802120837 /nfs/dbraw/zinc/12/08/37/802120837.db2.gz JNEUIWKPYGERTJ-SECBINFHSA-N 1 2 302.296 2.074 20 10 DECDLO COC(=O)c1ccc2c(c1)C[N@@H+](Cc1cc(O)c(O)cc1O)C2 ZINC001233486794 802126783 /nfs/dbraw/zinc/12/67/83/802126783.db2.gz CIMAQHMGNPEYPX-UHFFFAOYSA-N 1 2 315.325 2.106 20 10 DECDLO COC(=O)c1ccc2c(c1)C[N@H+](Cc1cc(O)c(O)cc1O)C2 ZINC001233486794 802126792 /nfs/dbraw/zinc/12/67/92/802126792.db2.gz CIMAQHMGNPEYPX-UHFFFAOYSA-N 1 2 315.325 2.106 20 10 DECDLO C[N@@H+]1CC[C@H](Oc2c(O)ccc3c2C(=O)c2ccccc2C3=O)C1 ZINC001227580001 803255192 /nfs/dbraw/zinc/25/51/92/803255192.db2.gz DJMHXCBCHVDLDW-NSHDSACASA-N 1 2 323.348 2.251 20 10 DECDLO C[N@H+]1CC[C@H](Oc2c(O)ccc3c2C(=O)c2ccccc2C3=O)C1 ZINC001227580001 803255196 /nfs/dbraw/zinc/25/51/96/803255196.db2.gz DJMHXCBCHVDLDW-NSHDSACASA-N 1 2 323.348 2.251 20 10 DECDLO C[C@@H]([NH2+][C@@H](C)c1ccns1)c1cccc(-c2nn[nH]n2)c1O ZINC001603650559 1070020096 /nfs/dbraw/zinc/02/00/96/1070020096.db2.gz LBJSYMJSIRJRMX-BDAKNGLRSA-N 1 2 316.390 2.441 20 10 DECDLO C[C@@H](O)CC(C)(C)C[NH2+][C@H](C)c1cccc(-c2nn[nH]n2)c1O ZINC001603697348 1070049704 /nfs/dbraw/zinc/04/97/04/1070049704.db2.gz YJACPSJDHCWSJZ-GHMZBOCLSA-N 1 2 319.409 2.020 20 10 DECDLO CCc1cccc(C[N@H+](C)[C@@H](COC2CCC2)C(=O)OC)c1O ZINC001461860269 1058727517 /nfs/dbraw/zinc/72/75/17/1058727517.db2.gz FOZIRLPPYPSPBL-INIZCTEOSA-N 1 2 321.417 2.497 20 10 DECDLO CCc1cccc(C[N@@H+](C)[C@@H](COC2CCC2)C(=O)OC)c1O ZINC001461860269 1058727528 /nfs/dbraw/zinc/72/75/28/1058727528.db2.gz FOZIRLPPYPSPBL-INIZCTEOSA-N 1 2 321.417 2.497 20 10 DECDLO CCOC(=O)N1CCC[N@H+](Cc2cc(F)c(F)cc2O)CC1 ZINC001560686138 1075144514 /nfs/dbraw/zinc/14/45/14/1075144514.db2.gz RQMZBDPUQISSIE-UHFFFAOYSA-N 1 2 314.332 2.335 20 10 DECDLO CCOC(=O)N1CCC[N@@H+](Cc2cc(F)c(F)cc2O)CC1 ZINC001560686138 1075144515 /nfs/dbraw/zinc/14/45/15/1075144515.db2.gz RQMZBDPUQISSIE-UHFFFAOYSA-N 1 2 314.332 2.335 20 10 DECDLO CC(C)(C)[C@H](Cn1cc[nH+]c1)NC(=O)c1cccc(O)c1O ZINC001583317942 1076254887 /nfs/dbraw/zinc/25/48/87/1076254887.db2.gz ZGCLOCXANOKZNY-ZDUSSCGKSA-N 1 2 303.362 2.139 20 10 DECDLO C[C@@H]([NH2+][C@@H](C)c1cncs1)c1cccc(-c2nn[nH]n2)c1O ZINC001589952112 1076532959 /nfs/dbraw/zinc/53/29/59/1076532959.db2.gz LIEIOYPEWAWEMY-BDAKNGLRSA-N 1 2 316.390 2.441 20 10 DECDLO CC[C@@H]([NH2+]C[C@@]1(C)CCCO1)c1cccc(-c2nn[nH]n2)c1O ZINC001590465128 1076633286 /nfs/dbraw/zinc/63/32/86/1076633286.db2.gz SPEMQAWVEZLJSQ-CZUORRHYSA-N 1 2 317.393 2.182 20 10 DECDLO Cc1cccc(C[NH2+][C@@H](C)c2cccc(-c3nn[nH]n3)c2O)n1 ZINC001592230710 1076878571 /nfs/dbraw/zinc/87/85/71/1076878571.db2.gz FUIFDWQSVZAFPU-NSHDSACASA-N 1 2 310.361 2.127 20 10 DECDLO CNC(=O)C[N@H+](Cc1ccccc1)Cc1cc(F)c(F)cc1O ZINC001652996612 1079908254 /nfs/dbraw/zinc/90/82/54/1079908254.db2.gz QKEWAPQINVFYIC-UHFFFAOYSA-N 1 2 320.339 2.419 20 10 DECDLO CNC(=O)C[N@@H+](Cc1ccccc1)Cc1cc(F)c(F)cc1O ZINC001652996612 1079908261 /nfs/dbraw/zinc/90/82/61/1079908261.db2.gz QKEWAPQINVFYIC-UHFFFAOYSA-N 1 2 320.339 2.419 20 10 DECDLO COc1cc(O)c(C[N@@H+]2C[C@@H](F)C[C@H](CO)C2)c(Cl)c1 ZINC001236797274 1079951140 /nfs/dbraw/zinc/95/11/40/1079951140.db2.gz DMRJIVLDWFZWNV-UWVGGRQHSA-N 1 2 303.761 2.207 20 10 DECDLO COc1cc(O)c(C[N@H+]2C[C@@H](F)C[C@H](CO)C2)c(Cl)c1 ZINC001236797274 1079951145 /nfs/dbraw/zinc/95/11/45/1079951145.db2.gz DMRJIVLDWFZWNV-UWVGGRQHSA-N 1 2 303.761 2.207 20 10 DECDLO CN(C)C1(C[NH2+]Cc2cc(Cl)cc(F)c2O)CCOCC1 ZINC001655653874 1080009977 /nfs/dbraw/zinc/00/99/77/1080009977.db2.gz JKNCKMRSQRVYCM-UHFFFAOYSA-N 1 2 316.804 2.385 20 10 DECDLO CC(C)N1C[C@H]([NH2+]Cc2cc(Cl)cc(F)c2O)CC1=O ZINC001657264209 1080167164 /nfs/dbraw/zinc/16/71/64/1080167164.db2.gz PGEQZOKAHBSYQP-LLVKDONJSA-N 1 2 300.761 2.284 20 10 DECDLO CNC(=O)C[N@H+](Cc1ccccc1)Cc1cccc(F)c1O ZINC001660540175 1080353332 /nfs/dbraw/zinc/35/33/32/1080353332.db2.gz QTZWUQMTJRWLJK-UHFFFAOYSA-N 1 2 302.349 2.280 20 10 DECDLO CNC(=O)C[N@@H+](Cc1ccccc1)Cc1cccc(F)c1O ZINC001660540175 1080353334 /nfs/dbraw/zinc/35/33/34/1080353334.db2.gz QTZWUQMTJRWLJK-UHFFFAOYSA-N 1 2 302.349 2.280 20 10 DECDLO C[N@H+](Cc1cccc(C(N)=O)c1)Cc1cc(F)cc(F)c1O ZINC001663864862 1080828123 /nfs/dbraw/zinc/82/81/23/1080828123.db2.gz JHJACMHEWAKNGQ-UHFFFAOYSA-N 1 2 306.312 2.401 20 10 DECDLO C[N@@H+](Cc1cccc(C(N)=O)c1)Cc1cc(F)cc(F)c1O ZINC001663864862 1080828128 /nfs/dbraw/zinc/82/81/28/1080828128.db2.gz JHJACMHEWAKNGQ-UHFFFAOYSA-N 1 2 306.312 2.401 20 10 DECDLO C[C@H]1C[C@@H](CO)[N@H+](Cc2cc(Br)cc(F)c2O)C1 ZINC001235058217 1084294315 /nfs/dbraw/zinc/29/43/15/1084294315.db2.gz ZFIHLIUQVIVCOE-KWQFWETISA-N 1 2 318.186 2.497 20 10 DECDLO C[C@H]1C[C@@H](CO)[N@@H+](Cc2cc(Br)cc(F)c2O)C1 ZINC001235058217 1084294325 /nfs/dbraw/zinc/29/43/25/1084294325.db2.gz ZFIHLIUQVIVCOE-KWQFWETISA-N 1 2 318.186 2.497 20 10 DECDLO O=C1N(c2ccccc2)CC12C[NH+](Cc1c(O)cccc1F)C2 ZINC001137837707 1086618072 /nfs/dbraw/zinc/61/80/72/1086618072.db2.gz RIHBDETXFFXOMW-UHFFFAOYSA-N 1 2 312.344 2.380 20 10 DECDLO CN1C(=O)C[C@@]2(CCC[N@H+](Cc3cccc(Cl)c3O)C2)C1=O ZINC001274234686 1091142666 /nfs/dbraw/zinc/14/26/66/1091142666.db2.gz OGLAOMGATLFSPY-MRXNPFEDSA-N 1 2 322.792 2.017 20 10 DECDLO CN1C(=O)C[C@@]2(CCC[N@@H+](Cc3cccc(Cl)c3O)C2)C1=O ZINC001274234686 1091142671 /nfs/dbraw/zinc/14/26/71/1091142671.db2.gz OGLAOMGATLFSPY-MRXNPFEDSA-N 1 2 322.792 2.017 20 10 DECDLO COc1cc(N(C)C)ccc1C[N@@H+]1CCN[C@H](C(F)(F)F)C1 ZINC001236997243 1138478479 /nfs/dbraw/zinc/47/84/79/1138478479.db2.gz ROYITJGRLJDHFN-AWEZNQCLSA-N 1 2 317.355 2.097 20 10 DECDLO COc1cc(N(C)C)ccc1C[N@H+]1CCN[C@H](C(F)(F)F)C1 ZINC001236997243 1138478480 /nfs/dbraw/zinc/47/84/80/1138478480.db2.gz ROYITJGRLJDHFN-AWEZNQCLSA-N 1 2 317.355 2.097 20 10 DECDLO Cc1cc(O)c(C[N@H+]2C[C@H](F)C[C@H]2CO)cc1Br ZINC001237678171 1138753433 /nfs/dbraw/zinc/75/34/33/1138753433.db2.gz VPZRUPQYJIWRKF-MNOVXSKESA-N 1 2 318.186 2.368 20 10 DECDLO Cc1cc(O)c(C[N@@H+]2C[C@H](F)C[C@H]2CO)cc1Br ZINC001237678171 1138753413 /nfs/dbraw/zinc/75/34/13/1138753413.db2.gz VPZRUPQYJIWRKF-MNOVXSKESA-N 1 2 318.186 2.368 20 10 DECDLO COC[C@]12COC[C@H]1C[N@H+](Cc1cc(F)cc(Cl)c1O)C2 ZINC001237811786 1138799671 /nfs/dbraw/zinc/79/96/71/1138799671.db2.gz CJEVFIKNRWISTG-IAQYHMDHSA-N 1 2 315.772 2.280 20 10 DECDLO COC[C@]12COC[C@H]1C[N@@H+](Cc1cc(F)cc(Cl)c1O)C2 ZINC001237811786 1138799680 /nfs/dbraw/zinc/79/96/80/1138799680.db2.gz CJEVFIKNRWISTG-IAQYHMDHSA-N 1 2 315.772 2.280 20 10 DECDLO C[C@@H]([NH2+]CCN1CCC(CO)CC1)c1cc(F)cc(F)c1O ZINC001323830135 1141890315 /nfs/dbraw/zinc/89/03/15/1141890315.db2.gz PAEZCRRGKJLVNI-LLVKDONJSA-N 1 2 314.376 2.025 20 10 DECDLO CCOc1ccc(N2CC[NH+](C[C@H](O)C(F)(F)F)CC2)cc1 ZINC001250972880 1142358132 /nfs/dbraw/zinc/35/81/32/1142358132.db2.gz AKEOSXXREAPEIF-AWEZNQCLSA-N 1 2 318.339 2.131 20 10 DECDLO COC(=O)[C@H](Cc1ccc(O)c(O)c1)[NH2+][C@H]1CCC(C)(C)C1 ZINC001258592007 1144023301 /nfs/dbraw/zinc/02/33/01/1144023301.db2.gz JQHKXZGLUFELMS-STQMWFEESA-N 1 2 307.390 2.350 20 10 DECDLO COC(=O)c1ccc(O)c([C@@H](C)[NH2+][C@H]2CCn3ccnc32)c1 ZINC000834829924 649852616 /nfs/dbraw/zinc/85/26/16/649852616.db2.gz ABNFCFJAWIGHCV-MFKMUULPSA-N 1 2 301.346 2.171 20 10 DECDLO C[C@@H]1C[N@H+](Cc2cc(Cl)c(F)cc2O)CC[S@@](=O)C1 ZINC000294799614 224229746 /nfs/dbraw/zinc/22/97/46/224229746.db2.gz VVSINTNZVWENJS-AYLIAGHASA-N 1 2 305.802 2.385 20 10 DECDLO C[C@@H]1C[N@@H+](Cc2cc(Cl)c(F)cc2O)CC[S@@](=O)C1 ZINC000294799614 224229747 /nfs/dbraw/zinc/22/97/47/224229747.db2.gz VVSINTNZVWENJS-AYLIAGHASA-N 1 2 305.802 2.385 20 10 DECDLO COC(=O)[C@]1(F)CC[N@H+](Cc2cc(Cl)cc(OC)c2O)C1 ZINC000273703524 130155340 /nfs/dbraw/zinc/15/53/40/130155340.db2.gz DRLGYZBYYYONQH-AWEZNQCLSA-N 1 2 317.744 2.141 20 10 DECDLO COC(=O)[C@]1(F)CC[N@@H+](Cc2cc(Cl)cc(OC)c2O)C1 ZINC000273703524 130155341 /nfs/dbraw/zinc/15/53/41/130155341.db2.gz DRLGYZBYYYONQH-AWEZNQCLSA-N 1 2 317.744 2.141 20 10 DECDLO Cn1ccnc1[C@H]1OCC[C@@H]1[NH2+]Cc1cccc(Cl)c1O ZINC000275481858 130327498 /nfs/dbraw/zinc/32/74/98/130327498.db2.gz ILJPSTLUPTUXBT-JSGCOSHPSA-N 1 2 307.781 2.399 20 10 DECDLO CC(=O)c1cc(Cl)cc(C[N@@H+](C)[C@@H](C)C[S@](C)=O)c1O ZINC000126220197 402270382 /nfs/dbraw/zinc/27/03/82/402270382.db2.gz MBRGQBUNEYFKDP-GWNMQOMSSA-N 1 2 317.838 2.447 20 10 DECDLO CC(=O)c1cc(Cl)cc(C[N@H+](C)[C@@H](C)C[S@](C)=O)c1O ZINC000126220197 402270384 /nfs/dbraw/zinc/27/03/84/402270384.db2.gz MBRGQBUNEYFKDP-GWNMQOMSSA-N 1 2 317.838 2.447 20 10 DECDLO Cc1nc2n(n1)C[C@H]([NH2+][C@H](C)c1ccc(F)c(F)c1O)CC2 ZINC000187692531 402508457 /nfs/dbraw/zinc/50/84/57/402508457.db2.gz ITVJQUDRPPGRFA-PSASIEDQSA-N 1 2 308.332 2.236 20 10 DECDLO CC[C@@H](CNCc1ccc([N+](=O)[O-])c(OC)c1O)[NH+]1CCCC1 ZINC000278951758 402889972 /nfs/dbraw/zinc/88/99/72/402889972.db2.gz ZNEVWWXIFDMUHL-ZDUSSCGKSA-N 1 2 323.393 2.273 20 10 DECDLO COCCn1cc(C[NH2+][C@H](C)c2ccc(F)c(F)c2O)cn1 ZINC000282446406 403155126 /nfs/dbraw/zinc/15/51/26/403155126.db2.gz FCSUNDUQSUDJEM-SNVBAGLBSA-N 1 2 311.332 2.364 20 10 DECDLO C[C@](O)(C[NH2+]Cc1cc([N+](=O)[O-])ccc1O)c1ccc(F)cc1 ZINC000270294124 403180328 /nfs/dbraw/zinc/18/03/28/403180328.db2.gz PTBYCKSYOSOAFX-INIZCTEOSA-N 1 2 320.320 2.437 20 10 DECDLO CCOC(=O)[C@H]1CCCC[N@@H+]1Cc1cc2c(cc1O)OCO2 ZINC000298783131 403462319 /nfs/dbraw/zinc/46/23/19/403462319.db2.gz GURRPKPCBNEVPK-GFCCVEGCSA-N 1 2 307.346 2.039 20 10 DECDLO CCOC(=O)[C@H]1CCCC[N@H+]1Cc1cc2c(cc1O)OCO2 ZINC000298783131 403462321 /nfs/dbraw/zinc/46/23/21/403462321.db2.gz GURRPKPCBNEVPK-GFCCVEGCSA-N 1 2 307.346 2.039 20 10 DECDLO O=C(C=Cc1c[nH]c[nH+]1)N1CCC[C@H](O)c2cc(F)ccc21 ZINC000493438834 405540088 /nfs/dbraw/zinc/54/00/88/405540088.db2.gz ZCORZBCIGTUAOE-VOKGJARPSA-N 1 2 301.321 2.422 20 10 DECDLO Cc1c2ccccc2n(C)c1CNC(=O)N1CCn2c[nH+]cc2C1 ZINC000566947924 406092065 /nfs/dbraw/zinc/09/20/65/406092065.db2.gz FQSVZMQXMGDSED-UHFFFAOYSA-N 1 2 323.400 2.409 20 10 DECDLO C[C@@H]([NH2+]C[C@H]1CCCN1CCCO)c1cc(F)cc(F)c1O ZINC000834850825 649854233 /nfs/dbraw/zinc/85/42/33/649854233.db2.gz PZGWYBMFNJDXRW-DGCLKSJQSA-N 1 2 314.376 2.168 20 10 DECDLO COC(=O)c1ccc(O)c([C@H](C)N[C@@H]2CC[N@@H+]3CCCC[C@@H]23)c1 ZINC000273420883 277161011 /nfs/dbraw/zinc/16/10/11/277161011.db2.gz RZQADRJJSFZPRI-MAZHCROVSA-N 1 2 318.417 2.456 20 10 DECDLO COC(=O)c1ccc(O)c([C@H](C)N[C@@H]2CC[N@H+]3CCCC[C@@H]23)c1 ZINC000273420883 277161012 /nfs/dbraw/zinc/16/10/12/277161012.db2.gz RZQADRJJSFZPRI-MAZHCROVSA-N 1 2 318.417 2.456 20 10 DECDLO Cc1nccnc1N1CC[NH+](Cc2cccc(Cl)c2O)CC1 ZINC000374216992 534785738 /nfs/dbraw/zinc/78/57/38/534785738.db2.gz MLJXKFLQFYKFQD-UHFFFAOYSA-N 1 2 318.808 2.466 20 10 DECDLO Cc1nonc1C[N@@H+](Cc1ccccc1O)C[C@@H]1CCCO1 ZINC000265139531 526703814 /nfs/dbraw/zinc/70/38/14/526703814.db2.gz PTHXMDMUEVTPNP-AWEZNQCLSA-N 1 2 303.362 2.265 20 10 DECDLO Cc1nonc1C[N@H+](Cc1ccccc1O)C[C@@H]1CCCO1 ZINC000265139531 526703823 /nfs/dbraw/zinc/70/38/23/526703823.db2.gz PTHXMDMUEVTPNP-AWEZNQCLSA-N 1 2 303.362 2.265 20 10 DECDLO CC[C@@H]([NH2+]CCNC(=O)c1ccn[nH]1)c1cccc(Cl)c1O ZINC000287743119 535803869 /nfs/dbraw/zinc/80/38/69/535803869.db2.gz PUSKWEXEFHVJBV-GFCCVEGCSA-N 1 2 322.796 2.239 20 10 DECDLO Cc1[nH+]cc2n1CC[C@@H](C(=O)NCc1cccc(Cl)c1O)C2 ZINC000890759099 623197919 /nfs/dbraw/zinc/19/79/19/623197919.db2.gz CCQZGZWGDUUPOT-LLVKDONJSA-N 1 2 319.792 2.429 20 10 DECDLO CC[N@H+](CC(=O)N(C)C)Cc1cc(Cl)cc(C(C)=O)c1O ZINC000050149386 623788572 /nfs/dbraw/zinc/78/85/72/623788572.db2.gz ZAZJRYXQKYFILR-UHFFFAOYSA-N 1 2 312.797 2.158 20 10 DECDLO CC[N@@H+](CC(=O)N(C)C)Cc1cc(Cl)cc(C(C)=O)c1O ZINC000050149386 623788576 /nfs/dbraw/zinc/78/85/76/623788576.db2.gz ZAZJRYXQKYFILR-UHFFFAOYSA-N 1 2 312.797 2.158 20 10 DECDLO COc1ccc(N2CCN(c3nccn4c[nH+]cc34)CC2)cc1 ZINC000891446208 624187239 /nfs/dbraw/zinc/18/72/39/624187239.db2.gz HKZKPMUVWOQQIU-UHFFFAOYSA-N 1 2 309.373 2.065 20 10 DECDLO c1cc2c(cc1C[NH2+]Cc1ncc3c(n1)CCOC3)CCCO2 ZINC000922216649 636008626 /nfs/dbraw/zinc/00/86/26/636008626.db2.gz VSJMTJOYLCPQGE-UHFFFAOYSA-N 1 2 311.385 2.164 20 10 DECDLO COc1ccc(N2CC[C@@H](Nc3cc(N(C)C)nc[nH+]3)C2)cc1 ZINC000894484397 637065762 /nfs/dbraw/zinc/06/57/62/637065762.db2.gz GNRYRCKSQAXRIG-CYBMUJFWSA-N 1 2 313.405 2.242 20 10 DECDLO COc1ccc(N2CC[C@@H](Nc3cc(N(C)C)[nH+]cn3)C2)cc1 ZINC000894484397 637065765 /nfs/dbraw/zinc/06/57/65/637065765.db2.gz GNRYRCKSQAXRIG-CYBMUJFWSA-N 1 2 313.405 2.242 20 10 DECDLO COc1c(O)c(C[NH+]2CC(C(F)(F)F)C2)ccc1[N+](=O)[O-] ZINC000894891860 637298417 /nfs/dbraw/zinc/29/84/17/637298417.db2.gz QJZPLRYCGTXMAM-UHFFFAOYSA-N 1 2 306.240 2.303 20 10 DECDLO COc1cccc(O)c1C[NH2+]Cc1n[nH]cc1Br ZINC000738431707 637444116 /nfs/dbraw/zinc/44/41/16/637444116.db2.gz VODNMCKFZSUTHZ-UHFFFAOYSA-N 1 2 312.167 2.176 20 10 DECDLO CCN1C(=O)C(C)(C)[NH2+]C12CCN(c1ccc(OC)cc1)CC2 ZINC000840833479 650364648 /nfs/dbraw/zinc/36/46/48/650364648.db2.gz MIPWYQREMMBRJT-UHFFFAOYSA-N 1 2 317.433 2.222 20 10 DECDLO O=C1CC2(CCC2)[N@H+](Cc2c(O)ccc(Cl)c2F)CCN1 ZINC000895926652 638270312 /nfs/dbraw/zinc/27/03/12/638270312.db2.gz BFWSISVJKCORBK-UHFFFAOYSA-N 1 2 312.772 2.429 20 10 DECDLO O=C1CC2(CCC2)[N@@H+](Cc2c(O)ccc(Cl)c2F)CCN1 ZINC000895926652 638270314 /nfs/dbraw/zinc/27/03/14/638270314.db2.gz BFWSISVJKCORBK-UHFFFAOYSA-N 1 2 312.772 2.429 20 10 DECDLO CN1C[C@@H](CC[NH2+]Cc2cc(Cl)cc(F)c2O)CC1=O ZINC000896308412 638460445 /nfs/dbraw/zinc/46/04/45/638460445.db2.gz JECBNEQJIGUGNW-VIFPVBQESA-N 1 2 300.761 2.143 20 10 DECDLO CN(C)c1ccc(CNC(=O)CCCn2cc[nH+]c2)cc1F ZINC000748638676 638581916 /nfs/dbraw/zinc/58/19/16/638581916.db2.gz NHPPIGMDZQSAES-UHFFFAOYSA-N 1 2 304.369 2.185 20 10 DECDLO C[C@@H]([NH2+]CCN1CCOCC1(C)C)c1cc(F)cc(F)c1O ZINC000756538645 639670533 /nfs/dbraw/zinc/67/05/33/639670533.db2.gz DNPBTYYBNQGFCL-LLVKDONJSA-N 1 2 314.376 2.432 20 10 DECDLO CCS(=O)(=O)C[C@H](C)[NH2+][C@H](C)c1cc(F)cc(F)c1O ZINC000756707119 639688542 /nfs/dbraw/zinc/68/85/42/639688542.db2.gz URNFOWJUCQQVNB-DTWKUNHWSA-N 1 2 307.362 2.144 20 10 DECDLO C[C@@H]([NH2+]CCS(=O)(=O)CC1CC1)c1cc(F)cc(F)c1O ZINC000756762860 639692928 /nfs/dbraw/zinc/69/29/28/639692928.db2.gz SDDJDWHYPHDBIR-SECBINFHSA-N 1 2 319.373 2.146 20 10 DECDLO C[C@@H]([NH2+][C@@H](CCO)C1CCOCC1)c1cc(F)cc(F)c1O ZINC000763557840 640552812 /nfs/dbraw/zinc/55/28/12/640552812.db2.gz FTDHLBGCFOZCIB-BMIGLBTASA-N 1 2 315.360 2.499 20 10 DECDLO Cc1cc(Br)c(O)c(C[NH2+]CC(F)(F)CO)c1 ZINC000767194241 640953235 /nfs/dbraw/zinc/95/32/35/640953235.db2.gz HNEDLSQLQSBRSV-UHFFFAOYSA-N 1 2 310.138 2.180 20 10 DECDLO COc1cccc(O)c1C[NH+]1CCN(CC(F)(F)F)CC1 ZINC000768219663 641060216 /nfs/dbraw/zinc/06/02/16/641060216.db2.gz MPRVMNHGEIRMIR-UHFFFAOYSA-N 1 2 304.312 2.081 20 10 DECDLO CCN(CC)c1ccc(C[N@@H+]2CCN3C(=O)CC[C@H]3C2)cc1F ZINC000769205843 641195242 /nfs/dbraw/zinc/19/52/42/641195242.db2.gz IZKVBAIBJLTGEA-HNNXBMFYSA-N 1 2 319.424 2.479 20 10 DECDLO CCN(CC)c1ccc(C[N@H+]2CCN3C(=O)CC[C@H]3C2)cc1F ZINC000769205843 641195244 /nfs/dbraw/zinc/19/52/44/641195244.db2.gz IZKVBAIBJLTGEA-HNNXBMFYSA-N 1 2 319.424 2.479 20 10 DECDLO CCc1nnc(C[NH2+][C@H](C)c2ccc(N3CCOCC3)cc2)o1 ZINC000775254080 642022230 /nfs/dbraw/zinc/02/22/30/642022230.db2.gz GFBXZKDFAFQOSP-CYBMUJFWSA-N 1 2 316.405 2.319 20 10 DECDLO CS(=O)(=O)[C@@H]1CCC[C@@H]([NH2+]Cc2cccc(Cl)c2O)C1 ZINC000776208847 642143725 /nfs/dbraw/zinc/14/37/25/642143725.db2.gz LVQCLORHKMRENG-VXGBXAGGSA-N 1 2 317.838 2.491 20 10 DECDLO CCOc1ccc(C[N@@H+]2CCN(CC(C)(C)O)[C@H](C)C2)c(O)c1 ZINC000783722560 643042211 /nfs/dbraw/zinc/04/22/11/643042211.db2.gz FSXORHKPLLQWHK-CQSZACIVSA-N 1 2 322.449 2.068 20 10 DECDLO CCOc1ccc(C[N@H+]2CCN(CC(C)(C)O)[C@H](C)C2)c(O)c1 ZINC000783722560 643042216 /nfs/dbraw/zinc/04/22/16/643042216.db2.gz FSXORHKPLLQWHK-CQSZACIVSA-N 1 2 322.449 2.068 20 10 DECDLO CN(C)c1ccc(CN(C)C(=O)C[N@@H+]2CCC[C@@H](F)C2)cc1 ZINC000903001161 643219747 /nfs/dbraw/zinc/21/97/47/643219747.db2.gz LRVYIWNMFNCTOW-OAHLLOKOSA-N 1 2 307.413 2.145 20 10 DECDLO CN(C)c1ccc(CN(C)C(=O)C[N@H+]2CCC[C@@H](F)C2)cc1 ZINC000903001161 643219751 /nfs/dbraw/zinc/21/97/51/643219751.db2.gz LRVYIWNMFNCTOW-OAHLLOKOSA-N 1 2 307.413 2.145 20 10 DECDLO C[C@H]([NH2+]Cc1nncn1C)c1cccc(C(F)(F)F)c1O ZINC000788526976 643620617 /nfs/dbraw/zinc/62/06/17/643620617.db2.gz QNWCZYNTMOCHBO-QMMMGPOBSA-N 1 2 300.284 2.390 20 10 DECDLO CC(C)(C)[C@@H](O)C[C@H](CO)[NH2+]Cc1cc(Cl)cc(F)c1O ZINC000793608509 644278855 /nfs/dbraw/zinc/27/88/55/644278855.db2.gz JRRFKWVXEKTKTG-YPMHNXCESA-N 1 2 319.804 2.432 20 10 DECDLO C[C@@H]1C[N@H+](Cc2cc(C(C)(C)C)cc(O)c2O)CC(=O)N1C ZINC000799955556 645236175 /nfs/dbraw/zinc/23/61/75/645236175.db2.gz ILZHVKBWISODTD-LLVKDONJSA-N 1 2 306.406 2.058 20 10 DECDLO C[C@@H]1C[N@@H+](Cc2cc(C(C)(C)C)cc(O)c2O)CC(=O)N1C ZINC000799955556 645236179 /nfs/dbraw/zinc/23/61/79/645236179.db2.gz ILZHVKBWISODTD-LLVKDONJSA-N 1 2 306.406 2.058 20 10 DECDLO Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)CCc1c[nH]c[nH+]1 ZINC000839922480 645309346 /nfs/dbraw/zinc/30/93/46/645309346.db2.gz VVUPNYJPQZOOGU-AWEZNQCLSA-N 1 2 314.433 2.464 20 10 DECDLO Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)CCc1c[nH+]c[nH]1 ZINC000839922480 645309348 /nfs/dbraw/zinc/30/93/48/645309348.db2.gz VVUPNYJPQZOOGU-AWEZNQCLSA-N 1 2 314.433 2.464 20 10 DECDLO CC(C)C[C@@H](C(=O)NCc1ccc(O)cc1O)n1cc[nH+]c1 ZINC000910942546 645598299 /nfs/dbraw/zinc/59/82/99/645598299.db2.gz FEPRMBORZMMZGP-AWEZNQCLSA-N 1 2 303.362 2.198 20 10 DECDLO C[C@@H]([NH2+]Cc1cccc(Cl)c1O)C1(S(C)(=O)=O)CC1 ZINC000809704333 646265423 /nfs/dbraw/zinc/26/54/23/646265423.db2.gz ZPYHFPWJOKEVJX-SECBINFHSA-N 1 2 303.811 2.101 20 10 DECDLO O=S1(=O)CC[C@@H]([N@H+](Cc2cc(Cl)ccc2O)C2CC2)C1 ZINC000157036690 646496458 /nfs/dbraw/zinc/49/64/58/646496458.db2.gz IGYVUIDGBQFQRF-CYBMUJFWSA-N 1 2 315.822 2.197 20 10 DECDLO O=S1(=O)CC[C@@H]([N@@H+](Cc2cc(Cl)ccc2O)C2CC2)C1 ZINC000157036690 646496461 /nfs/dbraw/zinc/49/64/61/646496461.db2.gz IGYVUIDGBQFQRF-CYBMUJFWSA-N 1 2 315.822 2.197 20 10 DECDLO C[C@H]([NH2+]Cc1cn(C)nn1)c1cccc(C(F)(F)F)c1O ZINC000815615076 647035966 /nfs/dbraw/zinc/03/59/66/647035966.db2.gz HPYDSJMZCQBUHI-QMMMGPOBSA-N 1 2 300.284 2.390 20 10 DECDLO C[N@H+](CC(=O)N1CCCC1)Cc1cc(Cl)c(F)cc1O ZINC000816482721 647140153 /nfs/dbraw/zinc/14/01/53/647140153.db2.gz QCBMXVNUOCAQNT-UHFFFAOYSA-N 1 2 300.761 2.239 20 10 DECDLO C[N@@H+](CC(=O)N1CCCC1)Cc1cc(Cl)c(F)cc1O ZINC000816482721 647140157 /nfs/dbraw/zinc/14/01/57/647140157.db2.gz QCBMXVNUOCAQNT-UHFFFAOYSA-N 1 2 300.761 2.239 20 10 DECDLO NC(=O)[C@@H]1[C@H]2CCC[C@@H]2C[N@@H+]1Cc1cc(Cl)c(F)cc1O ZINC000816588981 647156243 /nfs/dbraw/zinc/15/62/43/647156243.db2.gz HRLGFOYBSCXSPM-YACGNSKGSA-N 1 2 312.772 2.271 20 10 DECDLO NC(=O)[C@@H]1[C@H]2CCC[C@@H]2C[N@H+]1Cc1cc(Cl)c(F)cc1O ZINC000816588981 647156245 /nfs/dbraw/zinc/15/62/45/647156245.db2.gz HRLGFOYBSCXSPM-YACGNSKGSA-N 1 2 312.772 2.271 20 10 DECDLO C[C@@H]1C[NH+](C[C@@H]2CCCN2C(=O)C2=CC(=O)CS2)C[C@@H](C)O1 ZINC000731871442 647516078 /nfs/dbraw/zinc/51/60/78/647516078.db2.gz LBRXOGFEZZABEU-UPJWGTAASA-N 1 2 324.446 2.168 20 10 DECDLO CCOC(=O)C[N@H+](CCc1cncs1)Cc1ccccc1O ZINC000823575780 648445267 /nfs/dbraw/zinc/44/52/67/648445267.db2.gz BPPDULXVQVXJBC-UHFFFAOYSA-N 1 2 320.414 2.457 20 10 DECDLO CCOC(=O)C[N@@H+](CCc1cncs1)Cc1ccccc1O ZINC000823575780 648445272 /nfs/dbraw/zinc/44/52/72/648445272.db2.gz BPPDULXVQVXJBC-UHFFFAOYSA-N 1 2 320.414 2.457 20 10 DECDLO Cc1[nH+]cc(CN(C)Cc2ccc(N3CCOCC3)cc2)n1C ZINC000824535747 648605180 /nfs/dbraw/zinc/60/51/80/648605180.db2.gz WPXGZNIUUCYNEG-UHFFFAOYSA-N 1 2 314.433 2.197 20 10 DECDLO C[C@@H]1CN(Cc2cc(Cl)cc(F)c2O)C[C@H](C)[N@H+]1CCO ZINC000824925615 648673698 /nfs/dbraw/zinc/67/36/98/648673698.db2.gz AHDDHSZCGHVREM-PHIMTYICSA-N 1 2 316.804 2.072 20 10 DECDLO C[C@@H]1CN(Cc2cc(Cl)cc(F)c2O)C[C@H](C)[N@@H+]1CCO ZINC000824925615 648673700 /nfs/dbraw/zinc/67/37/00/648673700.db2.gz AHDDHSZCGHVREM-PHIMTYICSA-N 1 2 316.804 2.072 20 10 DECDLO O=C1OCCN1[C@@H]1CC[N@@H+](Cc2cc(Cl)cc(F)c2O)C1 ZINC000826999961 648959291 /nfs/dbraw/zinc/95/92/91/648959291.db2.gz FLYYTYSYOSZBPU-LLVKDONJSA-N 1 2 314.744 2.211 20 10 DECDLO O=C1OCCN1[C@@H]1CC[N@H+](Cc2cc(Cl)cc(F)c2O)C1 ZINC000826999961 648959294 /nfs/dbraw/zinc/95/92/94/648959294.db2.gz FLYYTYSYOSZBPU-LLVKDONJSA-N 1 2 314.744 2.211 20 10 DECDLO C[C@@H]1CC[C@H]([NH2+]Cc2cc(Cl)cc(F)c2O)CS1(=O)=O ZINC000827169974 648985750 /nfs/dbraw/zinc/98/57/50/648985750.db2.gz GZNUZIJDHUQHPM-KCJUWKMLSA-N 1 2 321.801 2.240 20 10 DECDLO COC[C@@]1(C(=O)OC)CCC[N@@H+]1Cc1cc(Cl)ccc1O ZINC000827489902 649041956 /nfs/dbraw/zinc/04/19/56/649041956.db2.gz XUMAEXWBGHIXPW-OAHLLOKOSA-N 1 2 313.781 2.200 20 10 DECDLO COC[C@@]1(C(=O)OC)CCC[N@H+]1Cc1cc(Cl)ccc1O ZINC000827489902 649041957 /nfs/dbraw/zinc/04/19/57/649041957.db2.gz XUMAEXWBGHIXPW-OAHLLOKOSA-N 1 2 313.781 2.200 20 10 DECDLO COc1ccc(O)c([C@H](C)NC(=O)[C@H]2CCc3c[nH+]cn3C2)c1 ZINC000844133156 651081123 /nfs/dbraw/zinc/08/11/23/651081123.db2.gz SIYBMKQWURVNNO-RYUDHWBXSA-N 1 2 315.373 2.037 20 10 DECDLO C[C@@H]([NH2+]C[C@@H]1CC(=O)N(C2CC2)C1)c1cc(F)cc(F)c1O ZINC000846205709 651315042 /nfs/dbraw/zinc/31/50/42/651315042.db2.gz KGQRQIZTKHHCDK-ZJUUUORDSA-N 1 2 310.344 2.332 20 10 DECDLO CC[C@H]1C(=O)NCC[N@H+]1Cc1cc(C(C)(C)C)cc(O)c1O ZINC000106854978 651395578 /nfs/dbraw/zinc/39/55/78/651395578.db2.gz LGYRHGWHHKNSDP-ZDUSSCGKSA-N 1 2 306.406 2.106 20 10 DECDLO CC[C@H]1C(=O)NCC[N@@H+]1Cc1cc(C(C)(C)C)cc(O)c1O ZINC000106854978 651395579 /nfs/dbraw/zinc/39/55/79/651395579.db2.gz LGYRHGWHHKNSDP-ZDUSSCGKSA-N 1 2 306.406 2.106 20 10 DECDLO COc1ccc(O)c([C@@H](C)[NH2+]Cc2nc([C@@H]3CCCO3)n[nH]2)c1 ZINC000848557357 651470453 /nfs/dbraw/zinc/47/04/53/651470453.db2.gz IMVWOMJRTMEZRN-YGRLFVJLSA-N 1 2 318.377 2.221 20 10 DECDLO Cc1cc(N(C)C)ccc1C[NH2+]Cc1nc([C@H]2CCCO2)n[nH]1 ZINC000848923628 651563228 /nfs/dbraw/zinc/56/32/28/651563228.db2.gz HMLHIIUMODNGHT-OAHLLOKOSA-N 1 2 315.421 2.320 20 10 DECDLO Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)Cc1[nH]cc[nH+]1 ZINC000854949878 651597200 /nfs/dbraw/zinc/59/72/00/651597200.db2.gz YWBDWFMZCKFDLU-CYBMUJFWSA-N 1 2 300.406 2.074 20 10 DECDLO COc1ccc(N2CC[NH+](Cc3nccnc3C)CC2)cc1F ZINC000857026228 652032574 /nfs/dbraw/zinc/03/25/74/652032574.db2.gz PPZBESGXUBEHSU-UHFFFAOYSA-N 1 2 316.380 2.255 20 10 DECDLO Oc1ccc(Br)cc1C[N@@H+]1CCc2n[nH]cc2C1 ZINC000857877930 652193763 /nfs/dbraw/zinc/19/37/63/652193763.db2.gz RPESPJHOQGSHTD-UHFFFAOYSA-N 1 2 308.179 2.436 20 10 DECDLO Oc1ccc(Br)cc1C[N@H+]1CCc2n[nH]cc2C1 ZINC000857877930 652193766 /nfs/dbraw/zinc/19/37/66/652193766.db2.gz RPESPJHOQGSHTD-UHFFFAOYSA-N 1 2 308.179 2.436 20 10 DECDLO COc1cccc(C[N@@H+]2Cc3ccccc3N(C)C(=O)C2)c1O ZINC000857880279 652194894 /nfs/dbraw/zinc/19/48/94/652194894.db2.gz FLULBSQPMLFXOW-UHFFFAOYSA-N 1 2 312.369 2.379 20 10 DECDLO COc1cccc(C[N@H+]2Cc3ccccc3N(C)C(=O)C2)c1O ZINC000857880279 652194896 /nfs/dbraw/zinc/19/48/96/652194896.db2.gz FLULBSQPMLFXOW-UHFFFAOYSA-N 1 2 312.369 2.379 20 10 DECDLO Cn1cc(Cl)c(C[NH2+]Cc2ccc(N3CCOCC3)cc2)n1 ZINC000393402170 685451561 /nfs/dbraw/zinc/45/15/61/685451561.db2.gz GPLVFTMRNUEMDV-UHFFFAOYSA-N 1 2 320.824 2.200 20 10 DECDLO CC[C@@H](C)NC(=O)[C@@H](C)[NH+]1CCN(c2ccc(OC)cc2)CC1 ZINC000042290042 683895923 /nfs/dbraw/zinc/89/59/23/683895923.db2.gz VNHCGDXVRVIDCJ-HUUCEWRRSA-N 1 2 319.449 2.120 20 10 DECDLO CC[C@H](C)NC(=O)[C@@H](C)[NH+]1CCN(c2ccc(OC)cc2)CC1 ZINC000042290045 683895972 /nfs/dbraw/zinc/89/59/72/683895972.db2.gz VNHCGDXVRVIDCJ-LSDHHAIUSA-N 1 2 319.449 2.120 20 10 DECDLO CCS(=O)(=O)C[C@@H](C)[N@H+](C)Cc1cc(Cl)ccc1O ZINC000093417016 684049240 /nfs/dbraw/zinc/04/92/40/684049240.db2.gz MMCIIBNIZUMFPQ-SNVBAGLBSA-N 1 2 305.827 2.301 20 10 DECDLO CCS(=O)(=O)C[C@@H](C)[N@@H+](C)Cc1cc(Cl)ccc1O ZINC000093417016 684049241 /nfs/dbraw/zinc/04/92/41/684049241.db2.gz MMCIIBNIZUMFPQ-SNVBAGLBSA-N 1 2 305.827 2.301 20 10 DECDLO C[C@@H](CC[S@@](C)=O)[NH2+]Cc1cccc(Br)c1O ZINC000125428420 684145562 /nfs/dbraw/zinc/14/55/62/684145562.db2.gz PEONSSTWERNOFO-XYZCENFISA-N 1 2 320.252 2.401 20 10 DECDLO CC1(C)[C@H]([NH2+]Cc2cccc(Br)c2O)C[C@@H]1O ZINC000128201131 684169428 /nfs/dbraw/zinc/16/94/28/684169428.db2.gz IRTOGYAZYGITKP-MNOVXSKESA-N 1 2 300.196 2.404 20 10 DECDLO CCOC(=O)C[N@H+](C/C=C(\C)COC)Cc1ccccc1O ZINC000930763785 694236365 /nfs/dbraw/zinc/23/63/65/694236365.db2.gz ODEXBVIFVKKSFD-NTEUORMPSA-N 1 2 307.390 2.350 20 10 DECDLO CCOC(=O)C[N@@H+](C/C=C(\C)COC)Cc1ccccc1O ZINC000930763785 694236367 /nfs/dbraw/zinc/23/63/67/694236367.db2.gz ODEXBVIFVKKSFD-NTEUORMPSA-N 1 2 307.390 2.350 20 10 DECDLO Cc1nonc1C[NH2+][C@H](C)c1ccc(N2CCOCC2)c(F)c1 ZINC000872135725 688933643 /nfs/dbraw/zinc/93/36/43/688933643.db2.gz IJRYSUJAWPMQLC-LLVKDONJSA-N 1 2 320.368 2.205 20 10 DECDLO CC(C)OCC[NH+]1CCN(Cc2ccc(F)c(F)c2O)CC1 ZINC000876759094 689928395 /nfs/dbraw/zinc/92/83/95/689928395.db2.gz LGBRWIGTTRRLTE-UHFFFAOYSA-N 1 2 314.376 2.213 20 10 DECDLO OC[C@]1([NH2+]Cc2ccc(F)c(F)c2O)CCOc2ccccc21 ZINC000877499252 690132733 /nfs/dbraw/zinc/13/27/33/690132733.db2.gz NFXBKRMKSRXHHS-QGZVFWFLSA-N 1 2 321.323 2.430 20 10 DECDLO C[C@@H]([NH2+][C@@H]1CNOC1)c1cc(Br)cc(Cl)c1O ZINC000925862898 693356212 /nfs/dbraw/zinc/35/62/12/693356212.db2.gz ZYEKMJPYTVQORI-HTRCEHHLSA-N 1 2 321.602 2.362 20 10 DECDLO CN(C)c1ccc(CN(C)C(=O)CCc2[nH+]ccn2C)cc1 ZINC001348452367 1151157874 /nfs/dbraw/zinc/15/78/74/1151157874.db2.gz HCHXPCJWVDHCSB-UHFFFAOYSA-N 1 2 300.406 2.077 20 10 DECDLO COC(=O)[C@H](Cc1ccc(O)c(O)c1)[NH2+][C@H]1C[C@@H]2[C@H](C1)C2(C)C ZINC001170709019 788627166 /nfs/dbraw/zinc/62/71/66/788627166.db2.gz APDNWNDCHSLNIP-CRWXNKLISA-N 1 2 319.401 2.206 20 10 DECDLO CC(C)[C@@H](CO)[NH2+]Cc1cc(Br)cc(F)c1O ZINC000715789369 792511480 /nfs/dbraw/zinc/51/14/80/792511480.db2.gz PUIXNPVYHIRIQY-LLVKDONJSA-N 1 2 306.175 2.400 20 10 DECDLO CCOCc1nnn2c1C[N@H+](Cc1cccc(F)c1O)CCC2 ZINC001138127211 796167816 /nfs/dbraw/zinc/16/78/16/796167816.db2.gz SOVKZEDGWYFPTO-UHFFFAOYSA-N 1 2 320.368 2.065 20 10 DECDLO CCOCc1nnn2c1C[N@@H+](Cc1cccc(F)c1O)CCC2 ZINC001138127211 796167817 /nfs/dbraw/zinc/16/78/17/796167817.db2.gz SOVKZEDGWYFPTO-UHFFFAOYSA-N 1 2 320.368 2.065 20 10 DECDLO CCN(CC)c1ccc(C[NH+]2CC(N3CC(F)C3)C2)c(OC)c1 ZINC001138388199 796211279 /nfs/dbraw/zinc/21/12/79/796211279.db2.gz SDHLBBHWBOMZFW-UHFFFAOYSA-N 1 2 321.440 2.379 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+](CCCO)C(C)C ZINC001139128839 796328659 /nfs/dbraw/zinc/32/86/59/796328659.db2.gz GHXQMIGOVZBPRG-UHFFFAOYSA-N 1 2 305.374 2.400 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+](CCCO)C(C)C ZINC001139128839 796328663 /nfs/dbraw/zinc/32/86/63/796328663.db2.gz GHXQMIGOVZBPRG-UHFFFAOYSA-N 1 2 305.374 2.400 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CCCO[C@H](C)C1 ZINC001139127582 796329192 /nfs/dbraw/zinc/32/91/92/796329192.db2.gz YEUXHQHKWDSDKL-GFCCVEGCSA-N 1 2 303.358 2.418 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CCCO[C@H](C)C1 ZINC001139127582 796329195 /nfs/dbraw/zinc/32/91/95/796329195.db2.gz YEUXHQHKWDSDKL-GFCCVEGCSA-N 1 2 303.358 2.418 20 10 DECDLO CC[N@H+](Cc1c(O)ccc2c(C)cc(=O)oc21)CC(C)(C)O ZINC001139131627 796330856 /nfs/dbraw/zinc/33/08/56/796330856.db2.gz QGBBHFIJJVVDIK-UHFFFAOYSA-N 1 2 305.374 2.400 20 10 DECDLO CC[N@@H+](Cc1c(O)ccc2c(C)cc(=O)oc21)CC(C)(C)O ZINC001139131627 796330861 /nfs/dbraw/zinc/33/08/61/796330861.db2.gz QGBBHFIJJVVDIK-UHFFFAOYSA-N 1 2 305.374 2.400 20 10 DECDLO CN(C)c1ccc(C[N@@H+]2CCO[C@@H]3C[C@@H](CO)C[C@H]32)c(Cl)c1 ZINC001140922269 796597706 /nfs/dbraw/zinc/59/77/06/796597706.db2.gz MKSQWWAUVXYTNE-JCURWCKSSA-N 1 2 324.852 2.378 20 10 DECDLO CN(C)c1ccc(C[N@H+]2CCO[C@@H]3C[C@@H](CO)C[C@H]32)c(Cl)c1 ZINC001140922269 796597709 /nfs/dbraw/zinc/59/77/09/796597709.db2.gz MKSQWWAUVXYTNE-JCURWCKSSA-N 1 2 324.852 2.378 20 10 DECDLO CCOC(=O)[C@@H]1CCCC[N@@H+]1Cc1c(O)cc(OC)cc1OC ZINC001141028426 796619958 /nfs/dbraw/zinc/61/99/58/796619958.db2.gz NZCAHLVGKZRWEB-AWEZNQCLSA-N 1 2 323.389 2.327 20 10 DECDLO CCOC(=O)[C@@H]1CCCC[N@H+]1Cc1c(O)cc(OC)cc1OC ZINC001141028426 796619959 /nfs/dbraw/zinc/61/99/59/796619959.db2.gz NZCAHLVGKZRWEB-AWEZNQCLSA-N 1 2 323.389 2.327 20 10 DECDLO CCOC(=O)C[N@H+](C)Cc1cc2c3c(c1)CCCN3CCC2 ZINC001141075371 796631672 /nfs/dbraw/zinc/63/16/72/796631672.db2.gz OCJWLWJDVYZORX-UHFFFAOYSA-N 1 2 302.418 2.380 20 10 DECDLO CCOC(=O)C[N@@H+](C)Cc1cc2c3c(c1)CCCN3CCC2 ZINC001141075371 796631674 /nfs/dbraw/zinc/63/16/74/796631674.db2.gz OCJWLWJDVYZORX-UHFFFAOYSA-N 1 2 302.418 2.380 20 10 DECDLO C[C@H]([NH2+]Cc1ccc(Br)cc1O)c1ncn(C)n1 ZINC000691395272 799508795 /nfs/dbraw/zinc/50/87/95/799508795.db2.gz LQKXKDUUQJVXFP-QMMMGPOBSA-N 1 2 311.183 2.134 20 10 DECDLO COc1cc(C[N@H+](C)Cc2cnc3ccccn23)cc(O)c1O ZINC001204344643 800207371 /nfs/dbraw/zinc/20/73/71/800207371.db2.gz WMEFIVXYJMONBR-UHFFFAOYSA-N 1 2 313.357 2.386 20 10 DECDLO COc1cc(C[N@@H+](C)Cc2cnc3ccccn23)cc(O)c1O ZINC001204344643 800207373 /nfs/dbraw/zinc/20/73/73/800207373.db2.gz WMEFIVXYJMONBR-UHFFFAOYSA-N 1 2 313.357 2.386 20 10 DECDLO Oc1c(Cl)cccc1C[NH2+]C[C@H]1COC2(CCOCC2)O1 ZINC001204975681 800280155 /nfs/dbraw/zinc/28/01/55/800280155.db2.gz LONFNGNQYHDVQP-LBPRGKRZSA-N 1 2 313.781 2.057 20 10 DECDLO COc1cc(N(C)C)ccc1C[NH+]1CCN(CC(F)F)CC1 ZINC001231855470 801738313 /nfs/dbraw/zinc/73/83/13/801738313.db2.gz WDWCYSUWDOLARX-UHFFFAOYSA-N 1 2 313.392 2.144 20 10 DECDLO Oc1c(Cl)cccc1C[NH+]1CCC(N2CCOCC2)CC1 ZINC001231909874 801749024 /nfs/dbraw/zinc/74/90/24/801749024.db2.gz RXCJTPRZZGXBQP-UHFFFAOYSA-N 1 2 310.825 2.342 20 10 DECDLO COC(=O)C[C@H]1C[N@H+](Cc2cc(C(C)(C)C)ccc2O)CCO1 ZINC001233286378 802064061 /nfs/dbraw/zinc/06/40/61/802064061.db2.gz RFEWMMMWILKLEW-HNNXBMFYSA-N 1 2 321.417 2.454 20 10 DECDLO COC(=O)C[C@H]1C[N@@H+](Cc2cc(C(C)(C)C)ccc2O)CCO1 ZINC001233286378 802064065 /nfs/dbraw/zinc/06/40/65/802064065.db2.gz RFEWMMMWILKLEW-HNNXBMFYSA-N 1 2 321.417 2.454 20 10 DECDLO Cc1cnc(O[C@H]2CC[N@@H+](Cc3c(O)ccc(F)c3F)C2)nc1 ZINC001233336161 802079105 /nfs/dbraw/zinc/07/91/05/802079105.db2.gz ARXXKWGZRMBMEX-NSHDSACASA-N 1 2 321.327 2.422 20 10 DECDLO CCOC(=O)C1C[NH+](Cc2cccc(C(F)(F)F)c2O)C1 ZINC001233418644 802111891 /nfs/dbraw/zinc/11/18/91/802111891.db2.gz PJRGWYPWUNAPJJ-UHFFFAOYSA-N 1 2 303.280 2.406 20 10 DECDLO C[C@]1(C[NH2+]Cc2cc(Cl)cc(Cl)c2[O-])C[NH2+]CCO1 ZINC001576526699 1066627975 /nfs/dbraw/zinc/62/79/75/1066627975.db2.gz XWXHVKNDGPNQKN-CYBMUJFWSA-N 1 2 305.205 2.167 20 10 DECDLO C[C@@H]([NH2+]C[C@H](C)c1ccccn1)c1cccc(-c2nn[nH]n2)c1O ZINC001603552235 1069986255 /nfs/dbraw/zinc/98/62/55/1069986255.db2.gz UUIGQCYOKRQVPL-NWDGAFQWSA-N 1 2 324.388 2.422 20 10 DECDLO C[C@@H]([NH2+][C@H](C)c1cccc(-c2nn[nH]n2)c1O)c1ccns1 ZINC001603650565 1070020219 /nfs/dbraw/zinc/02/02/19/1070020219.db2.gz LBJSYMJSIRJRMX-RKDXNWHRSA-N 1 2 316.390 2.441 20 10 DECDLO CC[C@H](C[C@H](C)O)[NH2+][C@@H](CC)c1cccc(-c2nn[nH]n2)c1O ZINC001604014495 1070176618 /nfs/dbraw/zinc/17/66/18/1070176618.db2.gz ABAGMXUMMGIBCT-WDMOLILDSA-N 1 2 319.409 2.163 20 10 DECDLO CC[C@@H]([NH2+]CC[C@@H](C)CCO)c1cccc(-c2nn[nH]n2)c1O ZINC001604053411 1070186783 /nfs/dbraw/zinc/18/67/83/1070186783.db2.gz CBPOHHFDMOHHFA-BXUZGUMPSA-N 1 2 319.409 2.022 20 10 DECDLO CC[C@H]([NH2+][C@@H](C)c1cccc(-c2nn[nH]n2)c1O)[C@H]1CCCO1 ZINC001604055492 1070189178 /nfs/dbraw/zinc/18/91/78/1070189178.db2.gz PRDJHRHGFNRPBZ-LEWSCRJBSA-N 1 2 317.393 2.181 20 10 DECDLO CC[C@@H]([NH2+]CC1(OC)CCC1)c1cccc(-c2nn[nH]n2)c1O ZINC001604055350 1070189481 /nfs/dbraw/zinc/18/94/81/1070189481.db2.gz MNSRYLABRGMEEI-CYBMUJFWSA-N 1 2 317.393 2.182 20 10 DECDLO CCCCOCC[NH2+][C@H](C)c1cccc(-c2nn[nH]n2)c1O ZINC001604187970 1070271044 /nfs/dbraw/zinc/27/10/44/1070271044.db2.gz DMMQHXFSSZDOGA-LLVKDONJSA-N 1 2 305.382 2.040 20 10 DECDLO COc1c(O)c(C[NH2+][C@@H]2C[C@H](C)n3ccnc32)ccc1[N+](=O)[O-] ZINC001462241390 1058788731 /nfs/dbraw/zinc/78/87/31/1058788731.db2.gz WQFSYEOJWQRYRQ-GXSJLCMTSA-N 1 2 318.333 2.301 20 10 DECDLO O=C(NCc1c(O)cccc1O)c1ccc(-n2cc[nH+]c2)cc1 ZINC001639289825 1078606005 /nfs/dbraw/zinc/60/60/05/1078606005.db2.gz XWSNNSJRGVMMSN-UHFFFAOYSA-N 1 2 309.325 2.214 20 10 DECDLO CC(C)C[C@@H](C(=O)NCc1cccc(O)c1O)n1cc[nH+]c1 ZINC001521852381 1069276837 /nfs/dbraw/zinc/27/68/37/1069276837.db2.gz VDWJDZVWRJRQMP-ZDUSSCGKSA-N 1 2 303.362 2.198 20 10 DECDLO O=C(NCc1c(O)cccc1O)c1ccc(Cn2cc[nH+]c2)cc1 ZINC001645360696 1078897519 /nfs/dbraw/zinc/89/75/19/1078897519.db2.gz FRRCTAKNNRRPSY-UHFFFAOYSA-N 1 2 323.352 2.273 20 10 DECDLO Cc1ccc(O)c(CNC(=O)NCc2ccn3cc[nH+]c3c2)c1 ZINC001564324061 1075002827 /nfs/dbraw/zinc/00/28/27/1075002827.db2.gz PUWCSVDXCNKXKC-UHFFFAOYSA-N 1 2 310.357 2.348 20 10 DECDLO CC[C@H]([NH2+]C[C@@H]1CCCCO1)c1cccc(-c2nn[nH]n2)c1O ZINC001590468132 1076634461 /nfs/dbraw/zinc/63/44/61/1076634461.db2.gz SRLHMXFFQGYTOY-FZMZJTMJSA-N 1 2 317.393 2.182 20 10 DECDLO CC[C@@H]([NH2+]CCOC(C)(C)C)c1cccc(-c2nn[nH]n2)c1O ZINC001590470246 1076635458 /nfs/dbraw/zinc/63/54/58/1076635458.db2.gz PMGHRPVLMFSWPK-CYBMUJFWSA-N 1 2 319.409 2.428 20 10 DECDLO CCOC[C@@H]([NH2+][C@@H](C)c1cccc(-c2nn[nH]n2)c1O)C(C)C ZINC001590800448 1076679134 /nfs/dbraw/zinc/67/91/34/1076679134.db2.gz POGYWMYQTIWTSU-SMDDNHRTSA-N 1 2 319.409 2.284 20 10 DECDLO CO[C@@H]([C@@H](C)[NH2+][C@H](C)c1cccc(-c2nn[nH]n2)c1O)C1CC1 ZINC001591326442 1076722765 /nfs/dbraw/zinc/72/27/65/1076722765.db2.gz LDRNMYAHHDIMKV-FCHSOHFDSA-N 1 2 317.393 2.036 20 10 DECDLO COCC1(CC[NH2+][C@H](C)c2cccc(-c3nn[nH]n3)c2O)CC1 ZINC001591387834 1076738590 /nfs/dbraw/zinc/73/85/90/1076738590.db2.gz GDALWKVXIXGZMZ-LLVKDONJSA-N 1 2 317.393 2.040 20 10 DECDLO CC(C)C(=O)N1CCC[N@H+](Cc2cc(F)c(F)cc2O)CC1 ZINC001657416963 1080172690 /nfs/dbraw/zinc/17/26/90/1080172690.db2.gz RODYQQSZJTXHFH-UHFFFAOYSA-N 1 2 312.360 2.361 20 10 DECDLO CC(C)C(=O)N1CCC[N@@H+](Cc2cc(F)c(F)cc2O)CC1 ZINC001657416963 1080172695 /nfs/dbraw/zinc/17/26/95/1080172695.db2.gz RODYQQSZJTXHFH-UHFFFAOYSA-N 1 2 312.360 2.361 20 10 DECDLO O=C(C1CC1)N1CCC[N@@H+](Cc2cc(F)c(F)cc2O)CC1 ZINC001664323765 1080895942 /nfs/dbraw/zinc/89/59/42/1080895942.db2.gz AUUCPLBPUAHXJS-UHFFFAOYSA-N 1 2 310.344 2.115 20 10 DECDLO O=C(C1CC1)N1CCC[N@H+](Cc2cc(F)c(F)cc2O)CC1 ZINC001664323765 1080895950 /nfs/dbraw/zinc/89/59/50/1080895950.db2.gz AUUCPLBPUAHXJS-UHFFFAOYSA-N 1 2 310.344 2.115 20 10 DECDLO COc1ccc(N2C[C@@H]3C[N@@H+](Cc4ccc[nH]4)C[C@H](C2)O3)cc1 ZINC001276924758 1083683110 /nfs/dbraw/zinc/68/31/10/1083683110.db2.gz OYXOILAVHKVGES-HDICACEKSA-N 1 2 313.401 2.113 20 10 DECDLO COc1ccc(N2C[C@@H]3C[N@H+](Cc4ccc[nH]4)C[C@H](C2)O3)cc1 ZINC001276924758 1083683115 /nfs/dbraw/zinc/68/31/15/1083683115.db2.gz OYXOILAVHKVGES-HDICACEKSA-N 1 2 313.401 2.113 20 10 DECDLO CC(C)(C)NC(=O)[C@@]12C[C@@H]1CC[N@@H+]2Cc1c(O)cccc1F ZINC001277484041 1083996371 /nfs/dbraw/zinc/99/63/71/1083996371.db2.gz HUFMKZSZJYKYFO-APPDUMDISA-N 1 2 306.381 2.410 20 10 DECDLO CC(C)(C)NC(=O)[C@@]12C[C@@H]1CC[N@H+]2Cc1c(O)cccc1F ZINC001277484041 1083996376 /nfs/dbraw/zinc/99/63/76/1083996376.db2.gz HUFMKZSZJYKYFO-APPDUMDISA-N 1 2 306.381 2.410 20 10 DECDLO Oc1cc(C[NH+]2CC3(CSC3)C2)c(O)cc1Br ZINC001236763574 1138417373 /nfs/dbraw/zinc/41/73/73/1138417373.db2.gz BIAIMWSQGAWKMP-UHFFFAOYSA-N 1 2 316.220 2.409 20 10 DECDLO C[C@]1(CO)CC[N@H+](Cc2cc(Cl)c(Cl)cc2O)C[C@@H]1O ZINC001236792096 1138430114 /nfs/dbraw/zinc/43/01/14/1138430114.db2.gz BMUHZYQPYOWYHW-UONOGXRCSA-N 1 2 320.216 2.264 20 10 DECDLO C[C@]1(CO)CC[N@@H+](Cc2cc(Cl)c(Cl)cc2O)C[C@@H]1O ZINC001236792096 1138430115 /nfs/dbraw/zinc/43/01/15/1138430115.db2.gz BMUHZYQPYOWYHW-UONOGXRCSA-N 1 2 320.216 2.264 20 10 DECDLO C[C@@]1(CO)CC[N@H+](Cc2cc(Cl)c(Cl)cc2O)C[C@H]1O ZINC001236792095 1138430499 /nfs/dbraw/zinc/43/04/99/1138430499.db2.gz BMUHZYQPYOWYHW-KGLIPLIRSA-N 1 2 320.216 2.264 20 10 DECDLO C[C@@]1(CO)CC[N@@H+](Cc2cc(Cl)c(Cl)cc2O)C[C@H]1O ZINC001236792095 1138430502 /nfs/dbraw/zinc/43/05/02/1138430502.db2.gz BMUHZYQPYOWYHW-KGLIPLIRSA-N 1 2 320.216 2.264 20 10 DECDLO COc1ccc(C[N@@H+]2CCC[C@H]2C(=O)N(C)C)c(O)c1Cl ZINC001236805524 1138432682 /nfs/dbraw/zinc/43/26/82/1138432682.db2.gz BABCSJCUVDDUTQ-NSHDSACASA-N 1 2 312.797 2.107 20 10 DECDLO COc1ccc(C[N@H+]2CCC[C@H]2C(=O)N(C)C)c(O)c1Cl ZINC001236805524 1138432684 /nfs/dbraw/zinc/43/26/84/1138432684.db2.gz BABCSJCUVDDUTQ-NSHDSACASA-N 1 2 312.797 2.107 20 10 DECDLO NC(=O)[C@@H]1CCCC[N@@H+]1Cc1c(O)cccc1OC(F)(F)F ZINC001237111985 1138506124 /nfs/dbraw/zinc/50/61/24/1138506124.db2.gz XHUCRNRZRRCEID-JTQLQIEISA-N 1 2 318.295 2.131 20 10 DECDLO NC(=O)[C@@H]1CCCC[N@H+]1Cc1c(O)cccc1OC(F)(F)F ZINC001237111985 1138506126 /nfs/dbraw/zinc/50/61/26/1138506126.db2.gz XHUCRNRZRRCEID-JTQLQIEISA-N 1 2 318.295 2.131 20 10 DECDLO CN1C(=O)CC[C@@H]2[C@H]1CC[N@@H+]2Cc1cc(Cl)cc(F)c1O ZINC001237618477 1138718736 /nfs/dbraw/zinc/71/87/36/1138718736.db2.gz HULBYHCWLAWLRB-CHWSQXEVSA-N 1 2 312.772 2.380 20 10 DECDLO CN1C(=O)CC[C@@H]2[C@H]1CC[N@H+]2Cc1cc(Cl)cc(F)c1O ZINC001237618477 1138718740 /nfs/dbraw/zinc/71/87/40/1138718740.db2.gz HULBYHCWLAWLRB-CHWSQXEVSA-N 1 2 312.772 2.380 20 10 DECDLO CC[N@H+](CCN1CCOCC1)Cc1cc(F)cc(Cl)c1O ZINC001237799245 1138790284 /nfs/dbraw/zinc/79/02/84/1138790284.db2.gz QCAXJGLEPZOKCE-UHFFFAOYSA-N 1 2 316.804 2.339 20 10 DECDLO CC[N@@H+](CCN1CCOCC1)Cc1cc(F)cc(Cl)c1O ZINC001237799245 1138790291 /nfs/dbraw/zinc/79/02/91/1138790291.db2.gz QCAXJGLEPZOKCE-UHFFFAOYSA-N 1 2 316.804 2.339 20 10 DECDLO C[C@H]([NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1O)C(=O)NC(C)(C)C ZINC000273361963 299345191 /nfs/dbraw/zinc/34/51/91/299345191.db2.gz APHPNMLZUSAUTA-UWVGGRQHSA-N 1 2 309.366 2.254 20 10 DECDLO C[N@H+](CCN1CCOCC1)Cc1cc(Cl)cc(Cl)c1O ZINC000092974821 193190883 /nfs/dbraw/zinc/19/08/83/193190883.db2.gz WLSUDZCBMYNVFZ-UHFFFAOYSA-N 1 2 319.232 2.463 20 10 DECDLO C[N@@H+](CCN1CCOCC1)Cc1cc(Cl)cc(Cl)c1O ZINC000092974821 193190884 /nfs/dbraw/zinc/19/08/84/193190884.db2.gz WLSUDZCBMYNVFZ-UHFFFAOYSA-N 1 2 319.232 2.463 20 10 DECDLO Cc1ccc(C(=O)N2CCC[C@@H](c3[nH]cc[nH+]3)C2)c(O)c1O ZINC000272723256 130057582 /nfs/dbraw/zinc/05/75/82/130057582.db2.gz FUBJEQQYCMNYDG-LLVKDONJSA-N 1 2 301.346 2.149 20 10 DECDLO CC(=O)c1cc(Cl)cc(C[N@@H+]2CCCC[C@H]2C(N)=O)c1O ZINC000050147488 402026127 /nfs/dbraw/zinc/02/61/27/402026127.db2.gz DOGONNGNJMQEPV-ZDUSSCGKSA-N 1 2 310.781 2.088 20 10 DECDLO CC(=O)c1cc(Cl)cc(C[N@H+]2CCCC[C@H]2C(N)=O)c1O ZINC000050147488 402026129 /nfs/dbraw/zinc/02/61/29/402026129.db2.gz DOGONNGNJMQEPV-ZDUSSCGKSA-N 1 2 310.781 2.088 20 10 DECDLO CC(=O)c1cc(Cl)cc(C[N@@H+](C)[C@@H](C)C[S@@](C)=O)c1O ZINC000126220565 402269990 /nfs/dbraw/zinc/26/99/90/402269990.db2.gz MBRGQBUNEYFKDP-LXGOIASLSA-N 1 2 317.838 2.447 20 10 DECDLO CC(=O)c1cc(Cl)cc(C[N@H+](C)[C@@H](C)C[S@@](C)=O)c1O ZINC000126220565 402269992 /nfs/dbraw/zinc/26/99/92/402269992.db2.gz MBRGQBUNEYFKDP-LXGOIASLSA-N 1 2 317.838 2.447 20 10 DECDLO CC(=O)c1cc(Cl)cc(C[N@@H+](C)[C@H](C)C[S@@](C)=O)c1O ZINC000126220793 402270429 /nfs/dbraw/zinc/27/04/29/402270429.db2.gz MBRGQBUNEYFKDP-YBYGRFCBSA-N 1 2 317.838 2.447 20 10 DECDLO CC(=O)c1cc(Cl)cc(C[N@H+](C)[C@H](C)C[S@@](C)=O)c1O ZINC000126220793 402270430 /nfs/dbraw/zinc/27/04/30/402270430.db2.gz MBRGQBUNEYFKDP-YBYGRFCBSA-N 1 2 317.838 2.447 20 10 DECDLO C[C@H]1CCNC(=O)[C@H]1[NH2+]Cc1cc(Cl)cc(Cl)c1O ZINC000193700574 402775917 /nfs/dbraw/zinc/77/59/17/402775917.db2.gz VJGXZDILKXXHMT-CPCISQLKSA-N 1 2 303.189 2.313 20 10 DECDLO C[C@@H]([NH2+]Cc1cc(Cl)c(F)cc1O)[C@H](C)N1CCOCC1 ZINC000293736518 403551231 /nfs/dbraw/zinc/55/12/31/403551231.db2.gz WVXMEWNPUGTGFS-MNOVXSKESA-N 1 2 316.804 2.384 20 10 DECDLO CS(=O)(=O)C1(C[NH2+]Cc2cccc(Cl)c2O)CCCC1 ZINC000289870045 404004160 /nfs/dbraw/zinc/00/41/60/404004160.db2.gz VSQVLOIEVJPYFY-UHFFFAOYSA-N 1 2 317.838 2.493 20 10 DECDLO Oc1cc2c(cc1C[N@@H+]1CCOC[C@H]1c1ccco1)OCO2 ZINC000378343227 404933672 /nfs/dbraw/zinc/93/36/72/404933672.db2.gz SCOJKELYOHEDEX-LBPRGKRZSA-N 1 2 303.314 2.287 20 10 DECDLO Oc1cc2c(cc1C[N@H+]1CCOC[C@H]1c1ccco1)OCO2 ZINC000378343227 404933673 /nfs/dbraw/zinc/93/36/73/404933673.db2.gz SCOJKELYOHEDEX-LBPRGKRZSA-N 1 2 303.314 2.287 20 10 DECDLO Oc1ccc(Cl)c(F)c1CNC[C@@H]1C[N@@H+]2CCC[C@@H]2CO1 ZINC000377394608 227189509 /nfs/dbraw/zinc/18/95/09/227189509.db2.gz YDGLKRLAEBMTOG-GHMZBOCLSA-N 1 2 314.788 2.138 20 10 DECDLO Oc1ccc(Cl)c(F)c1CNC[C@@H]1C[N@H+]2CCC[C@@H]2CO1 ZINC000377394608 227189516 /nfs/dbraw/zinc/18/95/16/227189516.db2.gz YDGLKRLAEBMTOG-GHMZBOCLSA-N 1 2 314.788 2.138 20 10 DECDLO CCn1ccnc1C[NH2+][C@H](C)c1cc(C(=O)OC)ccc1O ZINC000834878561 649857080 /nfs/dbraw/zinc/85/70/80/649857080.db2.gz FCXPGUQZCDGWDO-LLVKDONJSA-N 1 2 303.362 2.246 20 10 DECDLO CC[C@H]([NH2+]CC(=O)NCC(F)F)c1cccc(Cl)c1O ZINC000286868552 288036202 /nfs/dbraw/zinc/03/62/02/288036202.db2.gz BPNNWOFLYRQPHP-JTQLQIEISA-N 1 2 306.740 2.468 20 10 DECDLO C[C@H](c1nnnn1C)[N@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000188638461 290287196 /nfs/dbraw/zinc/28/71/96/290287196.db2.gz GQNJYCFSRJMBBK-CQSZACIVSA-N 1 2 314.437 2.393 20 10 DECDLO C[C@H](c1nnnn1C)[N@@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000188638461 290287198 /nfs/dbraw/zinc/28/71/98/290287198.db2.gz GQNJYCFSRJMBBK-CQSZACIVSA-N 1 2 314.437 2.393 20 10 DECDLO C[C@@H](c1cccnc1)[NH+]1CCN(C(=O)Cc2ccc(N)cc2)CC1 ZINC000071700477 334878057 /nfs/dbraw/zinc/87/80/57/334878057.db2.gz ICKJIMSJZODSCN-HNNXBMFYSA-N 1 2 324.428 2.112 20 10 DECDLO CCS(=O)(=O)C[C@H](C)[N@H+](C)Cc1cccc(Cl)c1O ZINC000180255821 521651123 /nfs/dbraw/zinc/65/11/23/521651123.db2.gz IPMOLWDRFWKRTE-JTQLQIEISA-N 1 2 305.827 2.301 20 10 DECDLO CCS(=O)(=O)C[C@H](C)[N@@H+](C)Cc1cccc(Cl)c1O ZINC000180255821 521651125 /nfs/dbraw/zinc/65/11/25/521651125.db2.gz IPMOLWDRFWKRTE-JTQLQIEISA-N 1 2 305.827 2.301 20 10 DECDLO Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)Cn1cc[nH+]c1 ZINC000840558093 625185817 /nfs/dbraw/zinc/18/58/17/625185817.db2.gz XMICYUYILKLYRD-AWEZNQCLSA-N 1 2 300.406 2.005 20 10 DECDLO Cc1cc(N(C)C)ccc1C[N@@H+]1CCO[C@@H](C(=O)C2CC2)C1 ZINC000840943462 635126715 /nfs/dbraw/zinc/12/67/15/635126715.db2.gz XKDVZAXANDHMLZ-QGZVFWFLSA-N 1 2 302.418 2.241 20 10 DECDLO Cc1cc(N(C)C)ccc1C[N@H+]1CCO[C@@H](C(=O)C2CC2)C1 ZINC000840943462 635126718 /nfs/dbraw/zinc/12/67/18/635126718.db2.gz XKDVZAXANDHMLZ-QGZVFWFLSA-N 1 2 302.418 2.241 20 10 DECDLO C[C@H](O)CC[N@H+](C)Cc1cc(Br)cc(F)c1O ZINC000894034321 636094524 /nfs/dbraw/zinc/09/45/24/636094524.db2.gz RCIHYILCOWPSGO-QMMMGPOBSA-N 1 2 306.175 2.497 20 10 DECDLO C[C@H](O)CC[N@@H+](C)Cc1cc(Br)cc(F)c1O ZINC000894034321 636094525 /nfs/dbraw/zinc/09/45/25/636094525.db2.gz RCIHYILCOWPSGO-QMMMGPOBSA-N 1 2 306.175 2.497 20 10 DECDLO COc1ccc(N2CC[NH+](Cc3[nH]nc(C)c3C)CC2)cc1F ZINC000894087905 636108842 /nfs/dbraw/zinc/10/88/42/636108842.db2.gz HIUPDHVRFOWIRH-UHFFFAOYSA-N 1 2 318.396 2.496 20 10 DECDLO c1cnc(C2([NH2+]Cc3ccc4c(c3)CCO4)CCOCC2)nc1 ZINC000923009930 636910155 /nfs/dbraw/zinc/91/01/55/636910155.db2.gz RFSDWYLFRYPQSF-UHFFFAOYSA-N 1 2 311.385 2.207 20 10 DECDLO O=C1N(CC[NH2+]Cc2cccc(Cl)c2O)C[C@H]2CCCCN12 ZINC000895343975 637950003 /nfs/dbraw/zinc/95/00/03/637950003.db2.gz TUHMYKVNRGZPCK-CYBMUJFWSA-N 1 2 323.824 2.425 20 10 DECDLO COC(=O)[C@@]1(F)CC[N@H+](Cc2c(O)cc(C)cc2Cl)C1 ZINC000840923062 650383621 /nfs/dbraw/zinc/38/36/21/650383621.db2.gz RJJUCFQMCKONRT-CQSZACIVSA-N 1 2 301.745 2.441 20 10 DECDLO COC(=O)[C@@]1(F)CC[N@@H+](Cc2c(O)cc(C)cc2Cl)C1 ZINC000840923062 650383622 /nfs/dbraw/zinc/38/36/22/650383622.db2.gz RJJUCFQMCKONRT-CQSZACIVSA-N 1 2 301.745 2.441 20 10 DECDLO COc1c([O-])c(C[NH2+]CC2([NH3+])CCCCCC2)ccc1[N+](=O)[O-] ZINC000841042490 650412867 /nfs/dbraw/zinc/41/28/67/650412867.db2.gz IRLGAZHVAUILQZ-UHFFFAOYSA-N 1 2 323.393 2.450 20 10 DECDLO C[C@H](C[NH2+][C@@H](C)c1cc(F)cc(F)c1O)CN1CCOCC1 ZINC000756591042 639678002 /nfs/dbraw/zinc/67/80/02/639678002.db2.gz DYKFNJSWPCSINP-NEPJUHHUSA-N 1 2 314.376 2.289 20 10 DECDLO CC(C)C(=O)NCCC[NH2+][C@@H](C)c1cc(F)cc(F)c1O ZINC000756774284 639693770 /nfs/dbraw/zinc/69/37/70/639693770.db2.gz BOCZQBSJRQIQSS-JTQLQIEISA-N 1 2 300.349 2.483 20 10 DECDLO COc1ccc(O)c([C@@H](C)NC(=O)N[C@H](C)Cn2cc[nH+]c2)c1 ZINC000103512875 639767714 /nfs/dbraw/zinc/76/77/14/639767714.db2.gz BENRHXDEIVLSPI-VXGBXAGGSA-N 1 2 318.377 2.046 20 10 DECDLO CCO[C@@H]1COCC[C@@H]1[NH2+]Cc1cc(Cl)cc(F)c1O ZINC000761223928 640288078 /nfs/dbraw/zinc/28/80/78/640288078.db2.gz VGIWSPWIBQRIFL-QWHCGFSZSA-N 1 2 303.761 2.468 20 10 DECDLO COc1ccc2c(c1)CCC[N@H+]2CC1CCS(=O)(=O)CC1 ZINC000767355092 640969702 /nfs/dbraw/zinc/96/97/02/640969702.db2.gz PQHXGZMJQLASRH-UHFFFAOYSA-N 1 2 309.431 2.273 20 10 DECDLO COc1ccc2c(c1)CCC[N@@H+]2CC1CCS(=O)(=O)CC1 ZINC000767355092 640969706 /nfs/dbraw/zinc/96/97/06/640969706.db2.gz PQHXGZMJQLASRH-UHFFFAOYSA-N 1 2 309.431 2.273 20 10 DECDLO CCN(C)c1ccc(C[N@@H+]2CC[C@@H](OC)C[C@H]2C(=O)OC)cc1 ZINC000773830167 641827514 /nfs/dbraw/zinc/82/75/14/641827514.db2.gz FAHJTSJYYCFGAF-SJORKVTESA-N 1 2 320.433 2.295 20 10 DECDLO CCN(C)c1ccc(C[N@H+]2CC[C@@H](OC)C[C@H]2C(=O)OC)cc1 ZINC000773830167 641827517 /nfs/dbraw/zinc/82/75/17/641827517.db2.gz FAHJTSJYYCFGAF-SJORKVTESA-N 1 2 320.433 2.295 20 10 DECDLO COc1c(O)c(C[NH2+]Cc2ncccc2F)ccc1[N+](=O)[O-] ZINC000775033303 641997823 /nfs/dbraw/zinc/99/78/23/641997823.db2.gz LNASBHVQQOQRKR-UHFFFAOYSA-N 1 2 307.281 2.133 20 10 DECDLO COc1ccc[nH+]c1NCc1ccc([N+](=O)[O-])c(OC)c1O ZINC000775047907 641999601 /nfs/dbraw/zinc/99/96/01/641999601.db2.gz OBVJXGAVITWWIA-UHFFFAOYSA-N 1 2 305.290 2.325 20 10 DECDLO C[C@@H]1CC[N@H+](CC(=O)N(C)Cc2ccc(N(C)C)cc2)C[C@@H]1F ZINC000778235834 642357713 /nfs/dbraw/zinc/35/77/13/642357713.db2.gz JBXNBKZWEPDQAN-PBHICJAKSA-N 1 2 321.440 2.391 20 10 DECDLO C[C@@H]1CC[N@@H+](CC(=O)N(C)Cc2ccc(N(C)C)cc2)C[C@@H]1F ZINC000778235834 642357725 /nfs/dbraw/zinc/35/77/25/642357725.db2.gz JBXNBKZWEPDQAN-PBHICJAKSA-N 1 2 321.440 2.391 20 10 DECDLO COc1ccc(O)c([C@H](C)NC(=O)CNc2cccc[nH+]2)c1 ZINC000901127862 642571702 /nfs/dbraw/zinc/57/17/02/642571702.db2.gz NQLGKQIXBOGURC-NSHDSACASA-N 1 2 301.346 2.085 20 10 DECDLO COc1cn(C[N@H+](C)Cc2ccc(N(C)C)cc2)c(C)cc1=O ZINC000902038677 642884761 /nfs/dbraw/zinc/88/47/61/642884761.db2.gz ZQULUCPNXUVNOM-UHFFFAOYSA-N 1 2 315.417 2.321 20 10 DECDLO COc1cn(C[N@@H+](C)Cc2ccc(N(C)C)cc2)c(C)cc1=O ZINC000902038677 642884762 /nfs/dbraw/zinc/88/47/62/642884762.db2.gz ZQULUCPNXUVNOM-UHFFFAOYSA-N 1 2 315.417 2.321 20 10 DECDLO C[C@H]([NH2+]CCCON)c1cc(Br)c(F)cc1O ZINC000902426853 643035304 /nfs/dbraw/zinc/03/53/04/643035304.db2.gz XZYKZYKRKSCYEK-ZETCQYMHSA-N 1 2 307.163 2.225 20 10 DECDLO CC(C)(C)[C@H](O)C[C@H](CO)[NH2+]Cc1cc(Cl)cc(F)c1O ZINC000793608506 644278657 /nfs/dbraw/zinc/27/86/57/644278657.db2.gz JRRFKWVXEKTKTG-DGCLKSJQSA-N 1 2 319.804 2.432 20 10 DECDLO CN(C)c1ccc(CNC(=O)C[NH+]2CCC(F)(F)CC2)cc1 ZINC000796541651 644751206 /nfs/dbraw/zinc/75/12/06/644751206.db2.gz VXTGUCASMYQDCB-UHFFFAOYSA-N 1 2 311.376 2.100 20 10 DECDLO O=C1N[C@H]2CC[N@@H+](Cc3cc(Cl)cc(F)c3O)C[C@@H]2CO1 ZINC000798957704 645103199 /nfs/dbraw/zinc/10/31/99/645103199.db2.gz LLLJWGHQKHPOFY-SKDRFNHKSA-N 1 2 314.744 2.115 20 10 DECDLO O=C1N[C@H]2CC[N@H+](Cc3cc(Cl)cc(F)c3O)C[C@@H]2CO1 ZINC000798957704 645103203 /nfs/dbraw/zinc/10/32/03/645103203.db2.gz LLLJWGHQKHPOFY-SKDRFNHKSA-N 1 2 314.744 2.115 20 10 DECDLO O=C(c1cccc(O)c1O)N1CC2(CC[N@@H+]2Cc2ccccc2)C1 ZINC000910778942 645553762 /nfs/dbraw/zinc/55/37/62/645553762.db2.gz DSASYOXWMSDFNI-UHFFFAOYSA-N 1 2 324.380 2.198 20 10 DECDLO O=C(c1cccc(O)c1O)N1CC2(CC[N@H+]2Cc2ccccc2)C1 ZINC000910778942 645553764 /nfs/dbraw/zinc/55/37/64/645553764.db2.gz DSASYOXWMSDFNI-UHFFFAOYSA-N 1 2 324.380 2.198 20 10 DECDLO CC(C)S(=O)(=O)CC[NH2+][C@H](C)c1cc(F)cc(F)c1O ZINC000808726777 646132265 /nfs/dbraw/zinc/13/22/65/646132265.db2.gz NKIDVPJFEWXGIR-SECBINFHSA-N 1 2 307.362 2.144 20 10 DECDLO Cn1ncc2c1nc[nH+]c2NCCCSc1nccs1 ZINC000172058675 646719706 /nfs/dbraw/zinc/71/97/06/646719706.db2.gz NPEYAABGOREUHT-UHFFFAOYSA-N 1 2 306.420 2.414 20 10 DECDLO C[C@H](C[NH2+]Cc1cc(Cl)c(F)cc1O)CN1CCOCC1 ZINC000816553560 647151567 /nfs/dbraw/zinc/15/15/67/647151567.db2.gz ZPDJIBLIYRPINU-LLVKDONJSA-N 1 2 316.804 2.243 20 10 DECDLO O=C(C[N@H+](Cc1ccco1)Cc1ccccc1O)N1CCC1 ZINC000731844849 647512994 /nfs/dbraw/zinc/51/29/94/647512994.db2.gz WOCCTDOJSNPYHV-UHFFFAOYSA-N 1 2 300.358 2.220 20 10 DECDLO O=C(C[N@@H+](Cc1ccco1)Cc1ccccc1O)N1CCC1 ZINC000731844849 647512999 /nfs/dbraw/zinc/51/29/99/647512999.db2.gz WOCCTDOJSNPYHV-UHFFFAOYSA-N 1 2 300.358 2.220 20 10 DECDLO CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@H]1CCC[N@@H+]1C1CC1 ZINC000819756547 647720806 /nfs/dbraw/zinc/72/08/06/647720806.db2.gz XYFSTXFYZDOCBH-ZDUSSCGKSA-N 1 2 309.406 2.121 20 10 DECDLO CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@H]1CCC[N@H+]1C1CC1 ZINC000819756547 647720808 /nfs/dbraw/zinc/72/08/08/647720808.db2.gz XYFSTXFYZDOCBH-ZDUSSCGKSA-N 1 2 309.406 2.121 20 10 DECDLO CCc1cccc(C[N@H+](C)[C@H](COC(C)C)C(=O)OC)c1O ZINC000848890869 651547878 /nfs/dbraw/zinc/54/78/78/651547878.db2.gz VCCFAQSFZZGOPW-OAHLLOKOSA-N 1 2 309.406 2.353 20 10 DECDLO CCc1cccc(C[N@@H+](C)[C@H](COC(C)C)C(=O)OC)c1O ZINC000848890869 651547880 /nfs/dbraw/zinc/54/78/80/651547880.db2.gz VCCFAQSFZZGOPW-OAHLLOKOSA-N 1 2 309.406 2.353 20 10 DECDLO C[C@H]([NH2+]Cc1ncccn1)c1ccc(N2CCOCC2)c(F)c1 ZINC000850552327 651951750 /nfs/dbraw/zinc/95/17/50/651951750.db2.gz MGIRVVKSZDDZMS-ZDUSSCGKSA-N 1 2 316.380 2.303 20 10 DECDLO C[C@H]1OCC[N@H+](Cc2ccc(N3CCOCC3)c(F)c2)[C@H]1C ZINC000093418170 684049332 /nfs/dbraw/zinc/04/93/32/684049332.db2.gz YGHBSJHDRHLZFT-UONOGXRCSA-N 1 2 308.397 2.272 20 10 DECDLO C[C@H]1OCC[N@@H+](Cc2ccc(N3CCOCC3)c(F)c2)[C@H]1C ZINC000093418170 684049334 /nfs/dbraw/zinc/04/93/34/684049334.db2.gz YGHBSJHDRHLZFT-UONOGXRCSA-N 1 2 308.397 2.272 20 10 DECDLO CCc1cccc(C[NH2+][C@@H](C[C@@H]2CCCOC2)C(=O)OC)c1O ZINC000862515959 686313841 /nfs/dbraw/zinc/31/38/41/686313841.db2.gz GWJHUPHSVPJRIE-BBRMVZONSA-N 1 2 321.417 2.403 20 10 DECDLO O=C1[C@@H]([NH2+]Cc2cc(Cl)cc(F)c2O)CCN1C1CCC1 ZINC000862550184 686321220 /nfs/dbraw/zinc/32/12/20/686321220.db2.gz CBPVCXVQQBNEDW-ZDUSSCGKSA-N 1 2 312.772 2.428 20 10 DECDLO C[C@H]([NH2+][C@H]1CC(=O)N(CC2CC2)C1)c1cc(F)cc(F)c1O ZINC000883395188 691496093 /nfs/dbraw/zinc/49/60/93/691496093.db2.gz PBQOPFJKXCNJIN-CABZTGNLSA-N 1 2 310.344 2.332 20 10 DECDLO COc1ccc(N(C)CCN(C)C(=O)[C@@H](C)n2cc[nH+]c2)cc1 ZINC001346294578 1150965816 /nfs/dbraw/zinc/96/58/16/1150965816.db2.gz MAVTWFIUEIMKGT-CQSZACIVSA-N 1 2 316.405 2.048 20 10 DECDLO COC[C@H](CC[NH2+]Cc1cccc(Br)c1O)OC ZINC000694299095 777778800 /nfs/dbraw/zinc/77/88/00/777778800.db2.gz MLMIFKNXSKGAEM-NSHDSACASA-N 1 2 318.211 2.296 20 10 DECDLO CN(Cc1cc(Br)c(F)cc1O)[C@@H]1CC[N@H+](C)C1 ZINC001144299689 790849847 /nfs/dbraw/zinc/84/98/47/790849847.db2.gz GEKPYXDFBGZCGU-SNVBAGLBSA-N 1 2 317.202 2.430 20 10 DECDLO CN(Cc1cc(Br)c(F)cc1O)[C@@H]1CC[N@@H+](C)C1 ZINC001144299689 790849860 /nfs/dbraw/zinc/84/98/60/790849860.db2.gz GEKPYXDFBGZCGU-SNVBAGLBSA-N 1 2 317.202 2.430 20 10 DECDLO CC[C@@H]1CC[C@H]([NH2+][C@@H](Cc2ccc(O)c(O)c2)C(=O)OC)C1 ZINC001173259421 793651463 /nfs/dbraw/zinc/65/14/63/793651463.db2.gz DQUWTTOONPQMCR-XBFCOCLRSA-N 1 2 307.390 2.350 20 10 DECDLO C[C@H](C(=O)NCc1cccc(Br)c1O)n1cc[nH+]c1 ZINC001116778451 794986299 /nfs/dbraw/zinc/98/62/99/794986299.db2.gz JFQSKFNZYCPZOR-SECBINFHSA-N 1 2 324.178 2.229 20 10 DECDLO COc1cccc(N2CC[NH+](Cc3c(O)cccc3F)CC2)n1 ZINC001137839218 796145496 /nfs/dbraw/zinc/14/54/96/796145496.db2.gz XHHKBRIHUVKOSC-UHFFFAOYSA-N 1 2 317.364 2.257 20 10 DECDLO CCN(CC)c1ccc(C[N@@H+]2CCOC[C@H]2COC)c(OC)c1 ZINC001138391216 796210792 /nfs/dbraw/zinc/21/07/92/796210792.db2.gz DDXHLKOAHKEBHF-QGZVFWFLSA-N 1 2 322.449 2.389 20 10 DECDLO CCN(CC)c1ccc(C[N@H+]2CCOC[C@H]2COC)c(OC)c1 ZINC001138391216 796210797 /nfs/dbraw/zinc/21/07/97/796210797.db2.gz DDXHLKOAHKEBHF-QGZVFWFLSA-N 1 2 322.449 2.389 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CCC[C@@H](CO)C1 ZINC001139126870 796327259 /nfs/dbraw/zinc/32/72/59/796327259.db2.gz SQURNEBLSSRLLX-GFCCVEGCSA-N 1 2 303.358 2.011 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CCC[C@@H](CO)C1 ZINC001139126870 796327262 /nfs/dbraw/zinc/32/72/62/796327262.db2.gz SQURNEBLSSRLLX-GFCCVEGCSA-N 1 2 303.358 2.011 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CC[C@H]2OCC[C@@H]2C1 ZINC001139130747 796331013 /nfs/dbraw/zinc/33/10/13/796331013.db2.gz IZCOBNWLPYPMCL-MLGOLLRUSA-N 1 2 315.369 2.418 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CC[C@H]2OCC[C@@H]2C1 ZINC001139130747 796331014 /nfs/dbraw/zinc/33/10/14/796331014.db2.gz IZCOBNWLPYPMCL-MLGOLLRUSA-N 1 2 315.369 2.418 20 10 DECDLO CO[C@@H]1C[N@H+](Cc2c(O)cccc2Br)C[C@@H]1F ZINC001140098500 796477632 /nfs/dbraw/zinc/47/76/32/796477632.db2.gz CCVHPHNQQPVIJG-CMPLNLGQSA-N 1 2 304.159 2.323 20 10 DECDLO CO[C@@H]1C[N@@H+](Cc2c(O)cccc2Br)C[C@@H]1F ZINC001140098500 796477636 /nfs/dbraw/zinc/47/76/36/796477636.db2.gz CCVHPHNQQPVIJG-CMPLNLGQSA-N 1 2 304.159 2.323 20 10 DECDLO OC[C@@H]1CCn2nccc2C[N@@H+]1Cc1c(O)cccc1Cl ZINC001140342671 796510386 /nfs/dbraw/zinc/51/03/86/796510386.db2.gz UAJNWIYZNUPYDY-LBPRGKRZSA-N 1 2 307.781 2.009 20 10 DECDLO OC[C@@H]1CCn2nccc2C[N@H+]1Cc1c(O)cccc1Cl ZINC001140342671 796510390 /nfs/dbraw/zinc/51/03/90/796510390.db2.gz UAJNWIYZNUPYDY-LBPRGKRZSA-N 1 2 307.781 2.009 20 10 DECDLO Cn1cc(C[N@H+](C)Cc2ccc(N3CCOCC3)cc2F)cn1 ZINC001140662399 796551906 /nfs/dbraw/zinc/55/19/06/796551906.db2.gz RYZFUPROWQQZDG-UHFFFAOYSA-N 1 2 318.396 2.028 20 10 DECDLO Cn1cc(C[N@@H+](C)Cc2ccc(N3CCOCC3)cc2F)cn1 ZINC001140662399 796551911 /nfs/dbraw/zinc/55/19/11/796551911.db2.gz RYZFUPROWQQZDG-UHFFFAOYSA-N 1 2 318.396 2.028 20 10 DECDLO CCOC(=O)[C@@H]1CCCC[N@@H+]1Cc1ccc2c(c1)OCCN2C ZINC001141144081 796639030 /nfs/dbraw/zinc/63/90/30/796639030.db2.gz WAZFXFPKZCIAPS-INIZCTEOSA-N 1 2 318.417 2.433 20 10 DECDLO CCOC(=O)[C@@H]1CCCC[N@H+]1Cc1ccc2c(c1)OCCN2C ZINC001141144081 796639031 /nfs/dbraw/zinc/63/90/31/796639031.db2.gz WAZFXFPKZCIAPS-INIZCTEOSA-N 1 2 318.417 2.433 20 10 DECDLO CSc1ncc2c(n1)C[N@@H+](Cc1cc(O)ccc1O)CC2 ZINC001141162360 796643235 /nfs/dbraw/zinc/64/32/35/796643235.db2.gz QXYLZSLYNVIIBP-UHFFFAOYSA-N 1 2 303.387 2.168 20 10 DECDLO CSc1ncc2c(n1)C[N@H+](Cc1cc(O)ccc1O)CC2 ZINC001141162360 796643236 /nfs/dbraw/zinc/64/32/36/796643236.db2.gz QXYLZSLYNVIIBP-UHFFFAOYSA-N 1 2 303.387 2.168 20 10 DECDLO O=C(N[C@@H]1CCC[N@@H+](Cc2cc(F)c(F)cc2O)C1)C1CC1 ZINC001142531512 796748070 /nfs/dbraw/zinc/74/80/70/796748070.db2.gz ZWRGHODMQKHXOU-GFCCVEGCSA-N 1 2 310.344 2.161 20 10 DECDLO O=C(N[C@@H]1CCC[N@H+](Cc2cc(F)c(F)cc2O)C1)C1CC1 ZINC001142531512 796748075 /nfs/dbraw/zinc/74/80/75/796748075.db2.gz ZWRGHODMQKHXOU-GFCCVEGCSA-N 1 2 310.344 2.161 20 10 DECDLO O=C(c1cccc2[nH+]ccn21)N1CCCc2cc(O)c(O)cc2C1 ZINC001154521748 797552081 /nfs/dbraw/zinc/55/20/81/797552081.db2.gz KQSLUXITWUGBGJ-UHFFFAOYSA-N 1 2 323.352 2.334 20 10 DECDLO CCOC(=O)[C@@]1(C)C[N@H+](Cc2ccc(N(C)CC)cc2)CCO1 ZINC001197114444 798150401 /nfs/dbraw/zinc/15/04/01/798150401.db2.gz HCQRQWBSDLHMAP-GOSISDBHSA-N 1 2 320.433 2.297 20 10 DECDLO CCOC(=O)[C@@]1(C)C[N@@H+](Cc2ccc(N(C)CC)cc2)CCO1 ZINC001197114444 798150403 /nfs/dbraw/zinc/15/04/03/798150403.db2.gz HCQRQWBSDLHMAP-GOSISDBHSA-N 1 2 320.433 2.297 20 10 DECDLO Oc1cccc(F)c1C[NH2+]Cc1nc(Br)c[nH]1 ZINC001207621300 800790719 /nfs/dbraw/zinc/79/07/19/800790719.db2.gz DKQDBIBKOYJLFQ-UHFFFAOYSA-N 1 2 300.131 2.307 20 10 DECDLO COc1cc(N(C)C)ccc1C[N@H+](C)Cc1cc(C)nn1C ZINC001231854016 801737324 /nfs/dbraw/zinc/73/73/24/801737324.db2.gz VRQSCSUZSYAWIA-UHFFFAOYSA-N 1 2 302.422 2.435 20 10 DECDLO COc1cc(N(C)C)ccc1C[N@@H+](C)Cc1cc(C)nn1C ZINC001231854016 801737329 /nfs/dbraw/zinc/73/73/29/801737329.db2.gz VRQSCSUZSYAWIA-UHFFFAOYSA-N 1 2 302.422 2.435 20 10 DECDLO COCc1noc2c1C[N@H+](Cc1cc(Cl)c(O)cc1O)CC2 ZINC001232260128 801831020 /nfs/dbraw/zinc/83/10/20/801831020.db2.gz PJTWYUGSOPDECP-UHFFFAOYSA-N 1 2 324.764 2.444 20 10 DECDLO COCc1noc2c1C[N@@H+](Cc1cc(Cl)c(O)cc1O)CC2 ZINC001232260128 801831027 /nfs/dbraw/zinc/83/10/27/801831027.db2.gz PJTWYUGSOPDECP-UHFFFAOYSA-N 1 2 324.764 2.444 20 10 DECDLO CN(C)c1ccc(C[N@@H+]2CC(F)(F)C[C@]2(C)CO)c(O)c1 ZINC001232836313 801968983 /nfs/dbraw/zinc/96/89/83/801968983.db2.gz NDASZXDAMNJEAI-CQSZACIVSA-N 1 2 300.349 2.050 20 10 DECDLO CN(C)c1ccc(C[N@H+]2CC(F)(F)C[C@]2(C)CO)c(O)c1 ZINC001232836313 801968988 /nfs/dbraw/zinc/96/89/88/801968988.db2.gz NDASZXDAMNJEAI-CQSZACIVSA-N 1 2 300.349 2.050 20 10 DECDLO Oc1ccc(F)c(F)c1CN1CC([NH+]2CCC(F)CC2)C1 ZINC001233335427 802080387 /nfs/dbraw/zinc/08/03/87/802080387.db2.gz UWNPBXRYVPQQGO-UHFFFAOYSA-N 1 2 300.324 2.289 20 10 DECDLO CCN1CC[N@H+](Cc2ccc(C(F)(F)F)cc2O)CC1=O ZINC001233455138 802120951 /nfs/dbraw/zinc/12/09/51/802120951.db2.gz XTHAQYWFPHKRES-UHFFFAOYSA-N 1 2 302.296 2.075 20 10 DECDLO CC(=O)[C@@H]1C[N@H+](Cc2ccc(C(F)(F)F)cc2O)CCO1 ZINC001233455461 802121190 /nfs/dbraw/zinc/12/11/90/802121190.db2.gz LVLADZAFXVQWNG-ZDUSSCGKSA-N 1 2 303.280 2.201 20 10 DECDLO Cc1cc(C[NH2+][C@@H](C)c2cccc(-c3nn[nH]n3)c2O)cc(C)n1 ZINC001605660852 1070813784 /nfs/dbraw/zinc/81/37/84/1070813784.db2.gz IZTXHPXGYZUTFQ-LBPRGKRZSA-N 1 2 324.388 2.435 20 10 DECDLO Cc1nc(C[NH2+][C@@H](C)c2cccc(-c3nn[nH]n3)c2O)cs1 ZINC001606042785 1071027318 /nfs/dbraw/zinc/02/73/18/1071027318.db2.gz BRHGFQDONGPDNU-QMMMGPOBSA-N 1 2 316.390 2.188 20 10 DECDLO CC1(C)COCCN1CC[NH2+]Cc1cc(Cl)cc(F)c1O ZINC001461143991 1058594580 /nfs/dbraw/zinc/59/45/80/1058594580.db2.gz AQKBQIKGDWQTNV-UHFFFAOYSA-N 1 2 316.804 2.385 20 10 DECDLO CCS(=O)(=O)C[C@H](C)[N@H+](C)Cc1ccc(Cl)cc1O ZINC001621182417 1078170891 /nfs/dbraw/zinc/17/08/91/1078170891.db2.gz DEASOUASCIRUTR-JTQLQIEISA-N 1 2 305.827 2.301 20 10 DECDLO CCS(=O)(=O)C[C@H](C)[N@@H+](C)Cc1ccc(Cl)cc1O ZINC001621182417 1078170892 /nfs/dbraw/zinc/17/08/92/1078170892.db2.gz DEASOUASCIRUTR-JTQLQIEISA-N 1 2 305.827 2.301 20 10 DECDLO O=C(N[C@@H]1CCn2c[nH+]cc21)c1cc2cc(O)c(O)cc2s1 ZINC001634084926 1078418830 /nfs/dbraw/zinc/41/88/30/1078418830.db2.gz LSSBALGFZNVTQX-SECBINFHSA-N 1 2 315.354 2.384 20 10 DECDLO Oc1c(Br)cccc1C[NH2+]C[C@@H]1CC(F)(F)CN1 ZINC001580885833 1076014149 /nfs/dbraw/zinc/01/41/49/1076014149.db2.gz NXXDLWVADGZRNQ-VIFPVBQESA-N 1 2 321.165 2.242 20 10 DECDLO C[C@@H]([NH2+][C@H](C)c1cccc(-c2nn[nH]n2)c1O)c1cncs1 ZINC001589952115 1076533358 /nfs/dbraw/zinc/53/33/58/1076533358.db2.gz LIEIOYPEWAWEMY-RKDXNWHRSA-N 1 2 316.390 2.441 20 10 DECDLO CC[C@H]([NH2+]C[C@@H](O)CC(C)C)c1cccc(-c2nn[nH]n2)c1O ZINC001590462883 1076631134 /nfs/dbraw/zinc/63/11/34/1076631134.db2.gz GGVJAJIDWNWPNV-FZMZJTMJSA-N 1 2 319.409 2.020 20 10 DECDLO Cc1cncc(C[NH2+][C@H](C)c2cccc(-c3nn[nH]n3)c2O)c1 ZINC001592300191 1076892539 /nfs/dbraw/zinc/89/25/39/1076892539.db2.gz PKEUNPURIARBJO-LLVKDONJSA-N 1 2 310.361 2.127 20 10 DECDLO O=C(NCc1cc(O)ccc1O)c1cccc(Cn2cc[nH+]c2)c1 ZINC001651225565 1079795578 /nfs/dbraw/zinc/79/55/78/1079795578.db2.gz OREZSJCABQBYBD-UHFFFAOYSA-N 1 2 323.352 2.273 20 10 DECDLO CNC(=O)[C@@H](Cc1ccccc1)[NH2+]Cc1ccc(F)c(F)c1O ZINC001652196352 1079857445 /nfs/dbraw/zinc/85/74/45/1079857445.db2.gz GTXKYHZEMDAJGH-CQSZACIVSA-N 1 2 320.339 2.117 20 10 DECDLO CC(C)(C)S(=O)(=O)CC[NH2+]Cc1cc(Cl)cc(F)c1O ZINC001656504765 1080098033 /nfs/dbraw/zinc/09/80/33/1080098033.db2.gz MGWUPZZKETYEDW-UHFFFAOYSA-N 1 2 323.817 2.488 20 10 DECDLO O=C1Nc2ccccc2C[C@@H]1[NH2+]Cc1ccc(F)c(F)c1O ZINC001660463140 1080335898 /nfs/dbraw/zinc/33/58/98/1080335898.db2.gz SSCCMECJUDXVEK-ZDUSSCGKSA-N 1 2 304.296 2.323 20 10 DECDLO COc1c(O)ccc(C[NH2+]Cc2c(O)cccc2F)c1[N+](=O)[O-] ZINC001660742548 1080388994 /nfs/dbraw/zinc/38/89/94/1080388994.db2.gz OEMGNSXNBWSVLX-UHFFFAOYSA-N 1 2 322.292 2.444 20 10 DECDLO Oc1cc(C[NH+]2CCSCC2)c(O)cc1Br ZINC001236770013 1138422979 /nfs/dbraw/zinc/42/29/79/1138422979.db2.gz ZQAYKYPISISKPG-UHFFFAOYSA-N 1 2 304.209 2.409 20 10 DECDLO COc1ccc(C[NH+]2CC3(C2)CCN(C(C)=O)C3)c(O)c1Cl ZINC001236813688 1138437485 /nfs/dbraw/zinc/43/74/85/1138437485.db2.gz PCXRCBJOWXLLHS-UHFFFAOYSA-N 1 2 324.808 2.108 20 10 DECDLO COc1cc(C[NH+]2CC(N3CCC(F)CC3)C2)c(O)c(OC)c1 ZINC001237677615 1138753808 /nfs/dbraw/zinc/75/38/08/1138753808.db2.gz FTZIKUVRTAGCSI-UHFFFAOYSA-N 1 2 324.396 2.028 20 10 DECDLO Nc1ccc(CNC(=O)N2CC[C@@H](Oc3cc[nH+]cc3)C2)cc1 ZINC001337070448 1142675271 /nfs/dbraw/zinc/67/52/71/1142675271.db2.gz QWJQBBCMWQPEKH-MRXNPFEDSA-N 1 2 312.373 2.027 20 10 DECDLO CC(C)C[C@@H](C[NH3+])[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001325321374 1147892516 /nfs/dbraw/zinc/89/25/16/1147892516.db2.gz VWZWDEYXDGUPAZ-INIZCTEOSA-N 1 2 322.472 2.041 20 10 DECDLO CC(C)[C@@H](C(=O)Nc1ccc(N)cc1)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000062461177 184238009 /nfs/dbraw/zinc/23/80/09/184238009.db2.gz VVTAOQQDEBYPQH-ZENOOKHLSA-N 1 2 305.422 2.341 20 10 DECDLO CC(C)[C@@H](C(=O)Nc1ccc(N)cc1)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000062461177 184238010 /nfs/dbraw/zinc/23/80/10/184238010.db2.gz VVTAOQQDEBYPQH-ZENOOKHLSA-N 1 2 305.422 2.341 20 10 DECDLO COc1cc(O)c(C[N@@H+]2CCC[C@@H]2c2nc(C)no2)cc1OC ZINC000285110774 131139445 /nfs/dbraw/zinc/13/94/45/131139445.db2.gz LTQFHTSPCNHXTI-GFCCVEGCSA-N 1 2 319.361 2.438 20 10 DECDLO COc1cc(O)c(C[N@H+]2CCC[C@@H]2c2nc(C)no2)cc1OC ZINC000285110774 131139446 /nfs/dbraw/zinc/13/94/46/131139446.db2.gz LTQFHTSPCNHXTI-GFCCVEGCSA-N 1 2 319.361 2.438 20 10 DECDLO COc1ccc(N2CC[NH+]([C@@H](C)c3nnc(C)o3)CC2)cc1F ZINC000084866118 401911132 /nfs/dbraw/zinc/91/11/32/401911132.db2.gz CRXUVGJLOIMNKK-NSHDSACASA-N 1 2 320.368 2.409 20 10 DECDLO CCOCC[N@@H+](CC(=O)OC)Cc1cc(Cl)ccc1O ZINC000152296892 402087632 /nfs/dbraw/zinc/08/76/32/402087632.db2.gz ZBRIRAGDGKIZDI-UHFFFAOYSA-N 1 2 301.770 2.057 20 10 DECDLO Cc1ccc(C(=O)N2CCCC[C@H]2c2[nH]cc[nH+]2)c(O)c1O ZINC000177677601 402425508 /nfs/dbraw/zinc/42/55/08/402425508.db2.gz KXGKKZGEXQHGJS-LBPRGKRZSA-N 1 2 301.346 2.497 20 10 DECDLO CCNC(=O)C(C)(C)C[NH2+][C@H](C)c1ccc(F)c(F)c1O ZINC000187872445 402511958 /nfs/dbraw/zinc/51/19/58/402511958.db2.gz ZDIQSNGEJNMWTD-SECBINFHSA-N 1 2 300.349 2.483 20 10 DECDLO O=C(NCc1ccc(N2CCCC2)cc1)[C@H]1CCn2cc[nH+]c2C1 ZINC000178765862 402536288 /nfs/dbraw/zinc/53/62/88/402536288.db2.gz OULAHVLKAQKISD-INIZCTEOSA-N 1 2 324.428 2.362 20 10 DECDLO O=C1NCC[N@H+](Cc2cc(F)ccc2O)[C@@H]1c1ccccc1 ZINC000180014533 402605170 /nfs/dbraw/zinc/60/51/70/402605170.db2.gz UMKXBKULBKQFDT-MRXNPFEDSA-N 1 2 300.333 2.204 20 10 DECDLO Cc1ccc(C(=O)N2CC[C@H](C)[C@@H](n3cc[nH+]c3)C2)c(O)c1O ZINC000182606700 402703711 /nfs/dbraw/zinc/70/37/11/402703711.db2.gz ZEQPTTADWROMSR-FZMZJTMJSA-N 1 2 315.373 2.326 20 10 DECDLO Cc1cc(O)c(C[N@H+](C)Cc2ncnn2CC(F)F)cc1C ZINC000278277429 402862463 /nfs/dbraw/zinc/86/24/63/402862463.db2.gz PQTFBGZQZYRYPX-UHFFFAOYSA-N 1 2 310.348 2.498 20 10 DECDLO Cc1cc(O)c(C[N@@H+](C)Cc2ncnn2CC(F)F)cc1C ZINC000278277429 402862466 /nfs/dbraw/zinc/86/24/66/402862466.db2.gz PQTFBGZQZYRYPX-UHFFFAOYSA-N 1 2 310.348 2.498 20 10 DECDLO CS(=O)(=O)C1(C[NH2+]Cc2cc(Cl)cc(Cl)c2O)CC1 ZINC000279699705 402961262 /nfs/dbraw/zinc/96/12/62/402961262.db2.gz RAVUDRNFYNAMCH-UHFFFAOYSA-N 1 2 324.229 2.366 20 10 DECDLO CCOC(=O)[C@H](F)C1C[NH+](Cc2c(O)cccc2Cl)C1 ZINC000294023042 403626736 /nfs/dbraw/zinc/62/67/36/403626736.db2.gz VAJRDFOPIBODJS-CYBMUJFWSA-N 1 2 301.745 2.379 20 10 DECDLO C[C@@H]([NH2+][C@H](C)[C@@H](C)N1CCOCC1)c1ccc(F)c(F)c1O ZINC000187703387 287062918 /nfs/dbraw/zinc/06/29/18/287062918.db2.gz FEDLMSHRYQFHPY-IJLUTSLNSA-N 1 2 314.376 2.430 20 10 DECDLO C[C@H](CS(C)(=O)=O)[N@H+](C)C/C=C/c1ccc(N(C)C)cc1 ZINC000835027182 649868434 /nfs/dbraw/zinc/86/84/34/649868434.db2.gz CYEJQMVMLZCUKW-PSKZRQQASA-N 1 2 310.463 2.131 20 10 DECDLO C[C@H](CS(C)(=O)=O)[N@@H+](C)C/C=C/c1ccc(N(C)C)cc1 ZINC000835027182 649868435 /nfs/dbraw/zinc/86/84/35/649868435.db2.gz CYEJQMVMLZCUKW-PSKZRQQASA-N 1 2 310.463 2.131 20 10 DECDLO COc1ccc(O)c(C[N@@H+]2CCNC(=O)[C@@H]2c2cccs2)c1 ZINC000373214645 534201156 /nfs/dbraw/zinc/20/11/56/534201156.db2.gz FNIVQQWPYRFNKY-HNNXBMFYSA-N 1 2 318.398 2.135 20 10 DECDLO COc1ccc(O)c(C[N@H+]2CCNC(=O)[C@@H]2c2cccs2)c1 ZINC000373214645 534201159 /nfs/dbraw/zinc/20/11/59/534201159.db2.gz FNIVQQWPYRFNKY-HNNXBMFYSA-N 1 2 318.398 2.135 20 10 DECDLO COC(=O)[C@@]1(F)CC[N@H+](C/C=C/c2ccc(N(C)C)cc2)C1 ZINC000835030045 649869087 /nfs/dbraw/zinc/86/90/87/649869087.db2.gz VKQQHMVNLQASCR-LAQIPUCWSA-N 1 2 306.381 2.353 20 10 DECDLO COC(=O)[C@@]1(F)CC[N@@H+](C/C=C/c2ccc(N(C)C)cc2)C1 ZINC000835030045 649869088 /nfs/dbraw/zinc/86/90/88/649869088.db2.gz VKQQHMVNLQASCR-LAQIPUCWSA-N 1 2 306.381 2.353 20 10 DECDLO CCn1nccc1C[NH+]1CCN(c2ccc(OC)c(F)c2)CC1 ZINC000180550518 523727658 /nfs/dbraw/zinc/72/76/58/523727658.db2.gz JZAQOWPUEFJFGR-UHFFFAOYSA-N 1 2 318.396 2.373 20 10 DECDLO Cc1cc(Br)cc(C[N@@H+]2C[C@H](F)C[C@H]2CO)c1O ZINC000364842763 526158478 /nfs/dbraw/zinc/15/84/78/526158478.db2.gz JWNMJYYEDVAUCH-NEPJUHHUSA-N 1 2 318.186 2.368 20 10 DECDLO Cc1cc(Br)cc(C[N@H+]2C[C@H](F)C[C@H]2CO)c1O ZINC000364842763 526158488 /nfs/dbraw/zinc/15/84/88/526158488.db2.gz JWNMJYYEDVAUCH-NEPJUHHUSA-N 1 2 318.186 2.368 20 10 DECDLO O=S1(=O)C[C@H]([NH2+]Cc2ccc3c(c2)CCO3)c2ccccc21 ZINC000267911965 527314545 /nfs/dbraw/zinc/31/45/45/527314545.db2.gz DZYFWVPQFDIPGX-HNNXBMFYSA-N 1 2 315.394 2.240 20 10 DECDLO C[C@H](Cn1cc[nH+]c1)NC(=O)NCc1cccc(Cl)c1O ZINC000892027207 624749520 /nfs/dbraw/zinc/74/95/20/624749520.db2.gz APLYHBGAPMNDLK-SNVBAGLBSA-N 1 2 308.769 2.130 20 10 DECDLO Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)Cn1cc[nH+]c1 ZINC000840558095 625185780 /nfs/dbraw/zinc/18/57/80/625185780.db2.gz XMICYUYILKLYRD-CQSZACIVSA-N 1 2 300.406 2.005 20 10 DECDLO CO[C@@H]1CC[C@@H]2OCC[N@H+](Cc3cc(F)cc(F)c3O)[C@@H]2C1 ZINC000894096763 636112969 /nfs/dbraw/zinc/11/29/69/636112969.db2.gz ZOQYGRIGEWIXQF-YUELXQCFSA-N 1 2 313.344 2.439 20 10 DECDLO CO[C@@H]1CC[C@@H]2OCC[N@@H+](Cc3cc(F)cc(F)c3O)[C@@H]2C1 ZINC000894096763 636112970 /nfs/dbraw/zinc/11/29/70/636112970.db2.gz ZOQYGRIGEWIXQF-YUELXQCFSA-N 1 2 313.344 2.439 20 10 DECDLO C[C@H](O)[C@@H]1CC[N@H+](Cc2cc(Br)cc(F)c2O)C1 ZINC000894430634 637034471 /nfs/dbraw/zinc/03/44/71/637034471.db2.gz HOWNZENIYVRVSF-DTWKUNHWSA-N 1 2 318.186 2.497 20 10 DECDLO C[C@H](O)[C@@H]1CC[N@@H+](Cc2cc(Br)cc(F)c2O)C1 ZINC000894430634 637034476 /nfs/dbraw/zinc/03/44/76/637034476.db2.gz HOWNZENIYVRVSF-DTWKUNHWSA-N 1 2 318.186 2.497 20 10 DECDLO COC(=O)[C@H]1CSCC[N@H+](Cc2cccc(Cl)c2O)C1 ZINC000840977942 650398765 /nfs/dbraw/zinc/39/87/65/650398765.db2.gz NVXOBHCOCDKTIA-LLVKDONJSA-N 1 2 315.822 2.384 20 10 DECDLO COC(=O)[C@H]1CSCC[N@@H+](Cc2cccc(Cl)c2O)C1 ZINC000840977942 650398768 /nfs/dbraw/zinc/39/87/68/650398768.db2.gz NVXOBHCOCDKTIA-LLVKDONJSA-N 1 2 315.822 2.384 20 10 DECDLO C[C@H](CCS(C)(=O)=O)[NH2+][C@@H](C)c1cc(F)cc(F)c1O ZINC000756657262 639682674 /nfs/dbraw/zinc/68/26/74/639682674.db2.gz CACNKHYCXNNSSW-BDAKNGLRSA-N 1 2 307.362 2.144 20 10 DECDLO C[C@@H]([NH2+][C@@H](C)c1cc(F)cc(F)c1O)[C@@H]1CN(C)CCO1 ZINC000756762329 639692617 /nfs/dbraw/zinc/69/26/17/639692617.db2.gz XPJVOEJXTPUXMK-RBZYPMLTSA-N 1 2 300.349 2.040 20 10 DECDLO Oc1c(F)cc(Cl)cc1C[NH2+]CCC1(O)CCOCC1 ZINC000809694296 639809675 /nfs/dbraw/zinc/80/96/75/639809675.db2.gz NPTLCSOEWCKYEQ-UHFFFAOYSA-N 1 2 303.761 2.206 20 10 DECDLO COC(=O)[C@H]1[C@H](C[NH2+]Cc2cccc(Cl)c2O)C1(F)F ZINC000898218208 641051577 /nfs/dbraw/zinc/05/15/77/641051577.db2.gz AUEYVURVBZZABI-WCBMZHEXSA-N 1 2 305.708 2.190 20 10 DECDLO C[N@H+](CC(=O)NCc1ccco1)Cc1c(O)cccc1Cl ZINC000768196383 641059355 /nfs/dbraw/zinc/05/93/55/641059355.db2.gz PXKKAJQFTMLVKC-UHFFFAOYSA-N 1 2 308.765 2.387 20 10 DECDLO C[N@@H+](CC(=O)NCc1ccco1)Cc1c(O)cccc1Cl ZINC000768196383 641059360 /nfs/dbraw/zinc/05/93/60/641059360.db2.gz PXKKAJQFTMLVKC-UHFFFAOYSA-N 1 2 308.765 2.387 20 10 DECDLO COc1ccc(O)c([C@H](C)Nc2nc(N(C)C)nc(C)[nH+]2)c1 ZINC000768522925 641092568 /nfs/dbraw/zinc/09/25/68/641092568.db2.gz CRWLRIDEJRIWGK-VIFPVBQESA-N 1 2 303.366 2.133 20 10 DECDLO CCN(C)c1ccc(C[N@H+](CCS(C)(=O)=O)C2CC2)cc1 ZINC000773796943 641825362 /nfs/dbraw/zinc/82/53/62/641825362.db2.gz PTKDMYMETRSHKG-UHFFFAOYSA-N 1 2 310.463 2.152 20 10 DECDLO CCN(C)c1ccc(C[N@@H+](CCS(C)(=O)=O)C2CC2)cc1 ZINC000773796943 641825366 /nfs/dbraw/zinc/82/53/66/641825366.db2.gz PTKDMYMETRSHKG-UHFFFAOYSA-N 1 2 310.463 2.152 20 10 DECDLO OCCO[C@H]1CCC[N@H+](Cc2cc(Cl)cc(F)c2O)C1 ZINC000775689114 642080142 /nfs/dbraw/zinc/08/01/42/642080142.db2.gz ZWFBCOHXFPGDAF-LBPRGKRZSA-N 1 2 303.761 2.158 20 10 DECDLO OCCO[C@H]1CCC[N@@H+](Cc2cc(Cl)cc(F)c2O)C1 ZINC000775689114 642080152 /nfs/dbraw/zinc/08/01/52/642080152.db2.gz ZWFBCOHXFPGDAF-LBPRGKRZSA-N 1 2 303.761 2.158 20 10 DECDLO CS(=O)(=O)[C@H]1CCC[C@H]([NH2+]Cc2cccc(Cl)c2O)C1 ZINC000776208845 642143715 /nfs/dbraw/zinc/14/37/15/642143715.db2.gz LVQCLORHKMRENG-RYUDHWBXSA-N 1 2 317.838 2.491 20 10 DECDLO C[C@@H]1C[C@H]1N1C[C@H]([NH2+]Cc2cc(Cl)cc(F)c2O)CC1=O ZINC000776221811 642145438 /nfs/dbraw/zinc/14/54/38/642145438.db2.gz ULSYXSZCYCQMET-XTWCZFFVSA-N 1 2 312.772 2.284 20 10 DECDLO COC(=O)c1ccc(O)c([C@H](C)[NH2+]Cc2csc(N)n2)c1 ZINC000902497837 643053165 /nfs/dbraw/zinc/05/31/65/643053165.db2.gz ABDOOAGDIJABEV-QMMMGPOBSA-N 1 2 307.375 2.068 20 10 DECDLO NC(=O)[C@@H]1[C@@H]2CCC[C@@H]2C[N@@H+]1Cc1cc(Cl)cc(F)c1O ZINC000787422325 643493479 /nfs/dbraw/zinc/49/34/79/643493479.db2.gz DZYZZDFSURRUIY-DYLAAIIWSA-N 1 2 312.772 2.271 20 10 DECDLO NC(=O)[C@@H]1[C@@H]2CCC[C@@H]2C[N@H+]1Cc1cc(Cl)cc(F)c1O ZINC000787422325 643493482 /nfs/dbraw/zinc/49/34/82/643493482.db2.gz DZYZZDFSURRUIY-DYLAAIIWSA-N 1 2 312.772 2.271 20 10 DECDLO CCOC(=O)[C@H]([NH2+]Cc1cc(C)ccc1O)[C@H]1CCCOC1 ZINC000789578209 643750414 /nfs/dbraw/zinc/75/04/14/643750414.db2.gz BVIFEXRSYGSKBY-XJKSGUPXSA-N 1 2 307.390 2.149 20 10 DECDLO CCOC(=O)[C@H]([NH2+]Cc1cc(C)c(C)cc1O)[C@H]1CCCOC1 ZINC000789581727 643751195 /nfs/dbraw/zinc/75/11/95/643751195.db2.gz SYGJGDJYDNWLHY-WMLDXEAASA-N 1 2 321.417 2.457 20 10 DECDLO COC[C@@H]([NH2+]Cc1cc(Cl)cc(F)c1O)[C@H]1CCCO1 ZINC000789777589 643775097 /nfs/dbraw/zinc/77/50/97/643775097.db2.gz YULLWYMMKPSLNZ-CHWSQXEVSA-N 1 2 303.761 2.468 20 10 DECDLO C[N@@H+](Cc1c(O)ccc(Cl)c1F)C[C@@H]1CCS(=O)(=O)C1 ZINC000792166960 644082613 /nfs/dbraw/zinc/08/26/13/644082613.db2.gz WNUBLGDOTZYQLN-VIFPVBQESA-N 1 2 321.801 2.051 20 10 DECDLO C[N@H+](Cc1c(O)ccc(Cl)c1F)C[C@@H]1CCS(=O)(=O)C1 ZINC000792166960 644082616 /nfs/dbraw/zinc/08/26/16/644082616.db2.gz WNUBLGDOTZYQLN-VIFPVBQESA-N 1 2 321.801 2.051 20 10 DECDLO CC[C@@H]([NH2+]Cc1nnc2n1CCOC2)c1cccc(Cl)c1O ZINC000806161455 645804149 /nfs/dbraw/zinc/80/41/49/645804149.db2.gz KTBJGAVQWSORBJ-GFCCVEGCSA-N 1 2 322.796 2.408 20 10 DECDLO O=C(CCc1[nH]cc[nH+]1)NCc1cccc(Br)c1O ZINC000807416759 645948779 /nfs/dbraw/zinc/94/87/79/645948779.db2.gz MMCMNCUTVBCEGK-UHFFFAOYSA-N 1 2 324.178 2.127 20 10 DECDLO Cn1nccc1CC[NH2+]Cc1cccc(Br)c1O ZINC000231033203 646754348 /nfs/dbraw/zinc/75/43/48/646754348.db2.gz XYMWYQICOUJBIK-UHFFFAOYSA-N 1 2 310.195 2.221 20 10 DECDLO CC(C)C[C@H](C(=O)NCc1ccc(O)c(O)c1)n1cc[nH+]c1 ZINC000821070433 647983554 /nfs/dbraw/zinc/98/35/54/647983554.db2.gz BOFJQRXRIKUUKO-CYBMUJFWSA-N 1 2 303.362 2.198 20 10 DECDLO COc1c(O)c(CNCC[N@@H+]2CCCC2(C)C)ccc1[N+](=O)[O-] ZINC000825331282 648742936 /nfs/dbraw/zinc/74/29/36/648742936.db2.gz CBGLUEJSFGITHF-UHFFFAOYSA-N 1 2 323.393 2.273 20 10 DECDLO COc1c(O)c(CNCC[N@H+]2CCCC2(C)C)ccc1[N+](=O)[O-] ZINC000825331282 648742940 /nfs/dbraw/zinc/74/29/40/648742940.db2.gz CBGLUEJSFGITHF-UHFFFAOYSA-N 1 2 323.393 2.273 20 10 DECDLO CO[C@@]1(CO)CCC[N@H+](Cc2cc(Cl)cc(F)c2O)C1 ZINC000826952901 648952259 /nfs/dbraw/zinc/95/22/59/648952259.db2.gz WPOYFKXUKAEUDJ-AWEZNQCLSA-N 1 2 303.761 2.158 20 10 DECDLO CO[C@@]1(CO)CCC[N@@H+](Cc2cc(Cl)cc(F)c2O)C1 ZINC000826952901 648952262 /nfs/dbraw/zinc/95/22/62/648952262.db2.gz WPOYFKXUKAEUDJ-AWEZNQCLSA-N 1 2 303.761 2.158 20 10 DECDLO C[C@H](NC(=O)[C@H]1CCc2c[nH+]cn2C1)c1ccc(N(C)C)cc1 ZINC000844138570 651082561 /nfs/dbraw/zinc/08/25/61/651082561.db2.gz HYOXVXDRFMUHIB-ZFWWWQNUSA-N 1 2 312.417 2.389 20 10 DECDLO Oc1ccc(Cl)cc1CNc1cc(N2CCOCC2)nc[nH+]1 ZINC000845709500 651272669 /nfs/dbraw/zinc/27/26/69/651272669.db2.gz SGWWFJALBDSKJF-UHFFFAOYSA-N 1 2 320.780 2.284 20 10 DECDLO Oc1ccc(Cl)cc1CNc1cc(N2CCOCC2)[nH+]cn1 ZINC000845709500 651272671 /nfs/dbraw/zinc/27/26/71/651272671.db2.gz SGWWFJALBDSKJF-UHFFFAOYSA-N 1 2 320.780 2.284 20 10 DECDLO CCOC(=O)[C@@H]1CSCC[N@@H+]1Cc1cccc(CC)c1O ZINC000848881337 651542818 /nfs/dbraw/zinc/54/28/18/651542818.db2.gz OHDCKVBSYLWHDQ-AWEZNQCLSA-N 1 2 309.431 2.435 20 10 DECDLO CCOC(=O)[C@@H]1CSCC[N@H+]1Cc1cccc(CC)c1O ZINC000848881337 651542822 /nfs/dbraw/zinc/54/28/22/651542822.db2.gz OHDCKVBSYLWHDQ-AWEZNQCLSA-N 1 2 309.431 2.435 20 10 DECDLO COc1ccc(N2CC[NH+](Cc3nn(C)cc3C)CC2)cc1 ZINC000929152693 693907178 /nfs/dbraw/zinc/90/71/78/693907178.db2.gz DSFNTTWSMBBGKQ-UHFFFAOYSA-N 1 2 300.406 2.059 20 10 DECDLO O=C(N[C@H]1CCN(c2cccc[nH+]2)C1)N1Cc2cccc(O)c2C1 ZINC000875419969 689622531 /nfs/dbraw/zinc/62/25/31/689622531.db2.gz MYYBTDWDJAZXBD-AWEZNQCLSA-N 1 2 324.384 2.091 20 10 DECDLO C[C@H]([NH2+][C@H](CO)C[C@@H]1CCCO1)c1cc(F)cc(F)c1O ZINC000886669814 692154925 /nfs/dbraw/zinc/15/49/25/692154925.db2.gz FGNNCRUKZMWQIU-DLOVCJGASA-N 1 2 301.333 2.251 20 10 DECDLO C[C@]1(CO)CC[N@H+](Cc2cc(Br)c(F)cc2O)C1 ZINC001144298348 790846306 /nfs/dbraw/zinc/84/63/06/790846306.db2.gz CDOKUCVKDWWTTK-ZDUSSCGKSA-N 1 2 318.186 2.498 20 10 DECDLO C[C@]1(CO)CC[N@@H+](Cc2cc(Br)c(F)cc2O)C1 ZINC001144298348 790846318 /nfs/dbraw/zinc/84/63/18/790846318.db2.gz CDOKUCVKDWWTTK-ZDUSSCGKSA-N 1 2 318.186 2.498 20 10 DECDLO CN1CC[C@H]1C[NH2+]Cc1cc(Br)cc(F)c1O ZINC000715791256 792511098 /nfs/dbraw/zinc/51/10/98/792511098.db2.gz GKFSFULQIQVMEE-JTQLQIEISA-N 1 2 303.175 2.088 20 10 DECDLO COC[C@@H]1Cn2nccc2C[N@H+](Cc2c(O)cccc2F)C1 ZINC001137835761 796144042 /nfs/dbraw/zinc/14/40/42/796144042.db2.gz MYCBYZASQFFIPG-LBPRGKRZSA-N 1 2 305.353 2.006 20 10 DECDLO COC[C@@H]1Cn2nccc2C[N@@H+](Cc2c(O)cccc2F)C1 ZINC001137835761 796144046 /nfs/dbraw/zinc/14/40/46/796144046.db2.gz MYCBYZASQFFIPG-LBPRGKRZSA-N 1 2 305.353 2.006 20 10 DECDLO O=C(NC1CC[NH+](Cc2c(O)cccc2F)CC1)C(F)(F)F ZINC001137839029 796145476 /nfs/dbraw/zinc/14/54/76/796145476.db2.gz OQMFTJMXJZEUIO-UHFFFAOYSA-N 1 2 320.286 2.174 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CC[C@@]2(CCOC2)C1 ZINC001139125604 796326099 /nfs/dbraw/zinc/32/60/99/796326099.db2.gz XQMBHXZMRFLELN-GOSISDBHSA-N 1 2 315.369 2.419 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CC[C@@]2(CCOC2)C1 ZINC001139125604 796326103 /nfs/dbraw/zinc/32/61/03/796326103.db2.gz XQMBHXZMRFLELN-GOSISDBHSA-N 1 2 315.369 2.419 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CC[C@@H]2CCO[C@H]2C1 ZINC001139124957 796326584 /nfs/dbraw/zinc/32/65/84/796326584.db2.gz IMSZBZSVLINRPO-WBMJQRKESA-N 1 2 315.369 2.418 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CC[C@@H]2CCO[C@H]2C1 ZINC001139124957 796326588 /nfs/dbraw/zinc/32/65/88/796326588.db2.gz IMSZBZSVLINRPO-WBMJQRKESA-N 1 2 315.369 2.418 20 10 DECDLO COC[C@@H]1CC[N@H+](Cc2c(O)ccc3c(C)cc(=O)oc32)C1 ZINC001139126555 796328243 /nfs/dbraw/zinc/32/82/43/796328243.db2.gz KFVUVQVZVVMBKA-GFCCVEGCSA-N 1 2 303.358 2.275 20 10 DECDLO COC[C@@H]1CC[N@@H+](Cc2c(O)ccc3c(C)cc(=O)oc32)C1 ZINC001139126555 796328249 /nfs/dbraw/zinc/32/82/49/796328249.db2.gz KFVUVQVZVVMBKA-GFCCVEGCSA-N 1 2 303.358 2.275 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CCC[C@@H](O)[C@H](C)C1 ZINC001139127485 796328751 /nfs/dbraw/zinc/32/87/51/796328751.db2.gz WZOBKWOATSVQET-IUODEOHRSA-N 1 2 317.385 2.400 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CCC[C@@H](O)[C@H](C)C1 ZINC001139127485 796328754 /nfs/dbraw/zinc/32/87/54/796328754.db2.gz WZOBKWOATSVQET-IUODEOHRSA-N 1 2 317.385 2.400 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1C[C@@H](C)C[C@H]1CO ZINC001139127423 796329580 /nfs/dbraw/zinc/32/95/80/796329580.db2.gz VZVHAKNXOLUXOD-JQWIXIFHSA-N 1 2 303.358 2.010 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1C[C@@H](C)C[C@H]1CO ZINC001139127423 796329585 /nfs/dbraw/zinc/32/95/85/796329585.db2.gz VZVHAKNXOLUXOD-JQWIXIFHSA-N 1 2 303.358 2.010 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CCCC[C@@H](O)C1 ZINC001139127366 796329764 /nfs/dbraw/zinc/32/97/64/796329764.db2.gz UJNLIUCDPREIPD-GFCCVEGCSA-N 1 2 303.358 2.154 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CCCC[C@@H](O)C1 ZINC001139127366 796329769 /nfs/dbraw/zinc/32/97/69/796329769.db2.gz UJNLIUCDPREIPD-GFCCVEGCSA-N 1 2 303.358 2.154 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CC[C@]12CCOC2 ZINC001139133800 796332398 /nfs/dbraw/zinc/33/23/98/796332398.db2.gz QUDLXZRSWTXWLK-QGZVFWFLSA-N 1 2 301.342 2.172 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CC[C@]12CCOC2 ZINC001139133800 796332405 /nfs/dbraw/zinc/33/24/05/796332405.db2.gz QUDLXZRSWTXWLK-QGZVFWFLSA-N 1 2 301.342 2.172 20 10 DECDLO C[C@@]1(O)CC[N@H+](Cc2cc(Br)ccc2O)C[C@@H]1F ZINC001203636024 796391039 /nfs/dbraw/zinc/39/10/39/796391039.db2.gz NFRSHLNNSKKCAJ-QWHCGFSZSA-N 1 2 318.186 2.450 20 10 DECDLO C[C@@]1(O)CC[N@@H+](Cc2cc(Br)ccc2O)C[C@@H]1F ZINC001203636024 796391042 /nfs/dbraw/zinc/39/10/42/796391042.db2.gz NFRSHLNNSKKCAJ-QWHCGFSZSA-N 1 2 318.186 2.450 20 10 DECDLO COCCCC[NH+]1CCN(Cc2c(F)ccc(F)c2O)CC1 ZINC001139690573 796411252 /nfs/dbraw/zinc/41/12/52/796411252.db2.gz YEVFMMCLDAJOPK-UHFFFAOYSA-N 1 2 314.376 2.215 20 10 DECDLO C[C@@H]1C[N@H+](Cc2ccc(N3CCOCC3)cc2F)CCCC1=O ZINC001140660320 796552015 /nfs/dbraw/zinc/55/20/15/796552015.db2.gz OBJDSVOLLOPGQS-CQSZACIVSA-N 1 2 320.408 2.463 20 10 DECDLO C[C@@H]1C[N@@H+](Cc2ccc(N3CCOCC3)cc2F)CCCC1=O ZINC001140660320 796552020 /nfs/dbraw/zinc/55/20/20/796552020.db2.gz OBJDSVOLLOPGQS-CQSZACIVSA-N 1 2 320.408 2.463 20 10 DECDLO COc1ccc(N2CC[NH+](Cc3cc(C)n[nH]3)CC2)c(C)c1 ZINC001203080905 796602856 /nfs/dbraw/zinc/60/28/56/796602856.db2.gz GYHXNPCCFGVPQZ-UHFFFAOYSA-N 1 2 300.406 2.357 20 10 DECDLO COC(=O)[C@@H]1CCCC[N@@H+]1Cc1ccc2c(c1)OCCN2C ZINC001141141356 796638605 /nfs/dbraw/zinc/63/86/05/796638605.db2.gz XOSHJTPBTGZGOZ-HNNXBMFYSA-N 1 2 304.390 2.043 20 10 DECDLO COC(=O)[C@@H]1CCCC[N@H+]1Cc1ccc2c(c1)OCCN2C ZINC001141141356 796638608 /nfs/dbraw/zinc/63/86/08/796638608.db2.gz XOSHJTPBTGZGOZ-HNNXBMFYSA-N 1 2 304.390 2.043 20 10 DECDLO CCOCc1ncn2c1C[N@H+](Cc1cccc(OC)c1O)CC2 ZINC001203594128 800086624 /nfs/dbraw/zinc/08/66/24/800086624.db2.gz SHHRTDOEXLHAFT-UHFFFAOYSA-N 1 2 317.389 2.150 20 10 DECDLO CCOCc1ncn2c1C[N@@H+](Cc1cccc(OC)c1O)CC2 ZINC001203594128 800086633 /nfs/dbraw/zinc/08/66/33/800086633.db2.gz SHHRTDOEXLHAFT-UHFFFAOYSA-N 1 2 317.389 2.150 20 10 DECDLO CCn1nnc2c1CC[N@H+](Cc1cccc(C)c1O)[C@H]2COC ZINC001231591443 801690945 /nfs/dbraw/zinc/69/09/45/801690945.db2.gz CTJPSNXBIPZMHR-HNNXBMFYSA-N 1 2 316.405 2.058 20 10 DECDLO CCn1nnc2c1CC[N@@H+](Cc1cccc(C)c1O)[C@H]2COC ZINC001231591443 801690949 /nfs/dbraw/zinc/69/09/49/801690949.db2.gz CTJPSNXBIPZMHR-HNNXBMFYSA-N 1 2 316.405 2.058 20 10 DECDLO Oc1c(Cl)cccc1C[NH+]1CCN(c2cncnc2)CC1 ZINC001231914455 801749756 /nfs/dbraw/zinc/74/97/56/801749756.db2.gz LRUGQIXJJWBFHU-UHFFFAOYSA-N 1 2 304.781 2.158 20 10 DECDLO COc1ccc(N2CCN(Cc3c[nH+]c(C)[nH]3)CC2)c(C)c1 ZINC001232465456 801893603 /nfs/dbraw/zinc/89/36/03/801893603.db2.gz MYOCOKOZMGOACE-UHFFFAOYSA-N 1 2 300.406 2.357 20 10 DECDLO Oc1ccc(F)c(F)c1C[NH+]1CCN(c2nccs2)CC1 ZINC001233331865 802077170 /nfs/dbraw/zinc/07/71/70/802077170.db2.gz NTCQIDWKRZXPAN-UHFFFAOYSA-N 1 2 311.357 2.449 20 10 DECDLO COC[C@H]1Cn2nccc2C[N@H+](Cc2c(O)ccc(F)c2F)C1 ZINC001233334152 802079190 /nfs/dbraw/zinc/07/91/90/802079190.db2.gz WAMZMTNVHFMZTC-LLVKDONJSA-N 1 2 323.343 2.145 20 10 DECDLO COC[C@H]1Cn2nccc2C[N@@H+](Cc2c(O)ccc(F)c2F)C1 ZINC001233334152 802079198 /nfs/dbraw/zinc/07/91/98/802079198.db2.gz WAMZMTNVHFMZTC-LLVKDONJSA-N 1 2 323.343 2.145 20 10 DECDLO Cc1ccnc(N2CC[NH+](Cc3c(O)ccc(F)c3F)CC2)n1 ZINC001233336146 802079427 /nfs/dbraw/zinc/07/94/27/802079427.db2.gz AGJVRUGRIXLXSX-UHFFFAOYSA-N 1 2 320.343 2.091 20 10 DECDLO Oc1ccc(F)c(F)c1C[N@H+]1CC[C@H](Oc2ncccn2)C1 ZINC001233336278 802080517 /nfs/dbraw/zinc/08/05/17/802080517.db2.gz GGPBILOKDLZZGA-JTQLQIEISA-N 1 2 307.300 2.114 20 10 DECDLO C[C@H]([NH2+][C@@H]1CCCSC1)c1cccc(-c2nn[nH]n2)c1O ZINC001603659302 1070026713 /nfs/dbraw/zinc/02/67/13/1070026713.db2.gz ZXUAUHDMUXHQFO-VHSXEESVSA-N 1 2 305.407 2.119 20 10 DECDLO C[C@@H](O)CC(C)(C)C[NH2+][C@@H](C)c1cccc(-c2nn[nH]n2)c1O ZINC001603697349 1070049633 /nfs/dbraw/zinc/04/96/33/1070049633.db2.gz YJACPSJDHCWSJZ-MNOVXSKESA-N 1 2 319.409 2.020 20 10 DECDLO CCC[C@](C)(O)C[NH2+][C@H](CC)c1cccc(-c2nn[nH]n2)c1O ZINC001604127746 1070233701 /nfs/dbraw/zinc/23/37/01/1070233701.db2.gz FNSLFNREGQQICC-CJNGLKHVSA-N 1 2 319.409 2.164 20 10 DECDLO COCC(C)(C)CC[NH2+][C@H](C)c1cccc(-c2nn[nH]n2)c1O ZINC001605043653 1070592885 /nfs/dbraw/zinc/59/28/85/1070592885.db2.gz ADKWOPVUIYRVHQ-LLVKDONJSA-N 1 2 319.409 2.286 20 10 DECDLO CC(C)n1cc(C[NH2+]Cc2cccc(Cl)c2O)c(=O)[nH]c1=O ZINC001474681780 1060917432 /nfs/dbraw/zinc/91/74/32/1060917432.db2.gz NOYSCIVKNDTATK-UHFFFAOYSA-N 1 2 323.780 2.179 20 10 DECDLO C[N@H+](Cc1cccc(C(N)=O)c1)Cc1ccc(F)c(F)c1O ZINC001621171076 1078170649 /nfs/dbraw/zinc/17/06/49/1078170649.db2.gz JOMVFXBIGCOIJZ-UHFFFAOYSA-N 1 2 306.312 2.401 20 10 DECDLO C[N@@H+](Cc1cccc(C(N)=O)c1)Cc1ccc(F)c(F)c1O ZINC001621171076 1078170652 /nfs/dbraw/zinc/17/06/52/1078170652.db2.gz JOMVFXBIGCOIJZ-UHFFFAOYSA-N 1 2 306.312 2.401 20 10 DECDLO O=C(NCc1cccc(O)c1O)c1cccc(Cn2cc[nH+]c2)c1 ZINC001637046787 1078501319 /nfs/dbraw/zinc/50/13/19/1078501319.db2.gz YHZFIHWYFBCKNQ-UHFFFAOYSA-N 1 2 323.352 2.273 20 10 DECDLO C[C@@H]1[C@H](CO)CC[N@@H+]1Cc1cc(F)cc(Br)c1O ZINC001235293612 1079010904 /nfs/dbraw/zinc/01/09/04/1079010904.db2.gz AAPWQVWARABKMQ-BDAKNGLRSA-N 1 2 318.186 2.497 20 10 DECDLO C[C@@H]1[C@H](CO)CC[N@H+]1Cc1cc(F)cc(Br)c1O ZINC001235293612 1079010908 /nfs/dbraw/zinc/01/09/08/1079010908.db2.gz AAPWQVWARABKMQ-BDAKNGLRSA-N 1 2 318.186 2.497 20 10 DECDLO C[C@@H]([NH2+]C[C@H]1CCC(C)(C)O1)c1cccc(-c2nn[nH]n2)c1O ZINC001589961166 1076536745 /nfs/dbraw/zinc/53/67/45/1076536745.db2.gz BQLLWDYAQBPRLD-GHMZBOCLSA-N 1 2 317.393 2.181 20 10 DECDLO CC[C@@H]([NH2+]CC(C)(C)OC)c1cccc(-c2nn[nH]n2)c1O ZINC001590462850 1076631113 /nfs/dbraw/zinc/63/11/13/1076631113.db2.gz GANVBQNKQZPJGV-GFCCVEGCSA-N 1 2 305.382 2.038 20 10 DECDLO Oc1c(F)cc(Cl)cc1C[NH2+]CCN1C[C@H]2CC[C@@H](C1)O2 ZINC001662469938 1080610971 /nfs/dbraw/zinc/61/09/71/1080610971.db2.gz SURHFZMLEWYCCB-BETUJISGSA-N 1 2 314.788 2.138 20 10 DECDLO COc1ccc(N2CC3(CC[N@@H+]3Cc3cn[nH]c3)C2)cc1F ZINC001277009570 1083731423 /nfs/dbraw/zinc/73/14/23/1083731423.db2.gz KEFDDKGPBXRAFC-UHFFFAOYSA-N 1 2 302.353 2.022 20 10 DECDLO COc1ccc(N2CC3(CC[N@H+]3Cc3cn[nH]c3)C2)cc1F ZINC001277009570 1083731432 /nfs/dbraw/zinc/73/14/32/1083731432.db2.gz KEFDDKGPBXRAFC-UHFFFAOYSA-N 1 2 302.353 2.022 20 10 DECDLO Oc1c(Cl)cccc1C[NH+]1CC2(CN(Cc3cn[nH]c3)C2)C1 ZINC001276380217 1083744439 /nfs/dbraw/zinc/74/44/39/1083744439.db2.gz KJXVKSCYRDDONI-UHFFFAOYSA-N 1 2 318.808 2.087 20 10 DECDLO CC(C)(C)NC(=O)[C@@H]1CCC2(C[NH+](Cc3ccccc3O)C2)O1 ZINC001277442577 1083972768 /nfs/dbraw/zinc/97/27/68/1083972768.db2.gz XPBXZTABTQUIND-HNNXBMFYSA-N 1 2 318.417 2.040 20 10 DECDLO CC[N@H+](CC(N)=O)Cc1cc(Cl)cc(Br)c1O ZINC000708135231 1086677337 /nfs/dbraw/zinc/67/73/37/1086677337.db2.gz YDRZCFCGQYTOKC-UHFFFAOYSA-N 1 2 321.602 2.115 20 10 DECDLO CC[N@@H+](CC(N)=O)Cc1cc(Cl)cc(Br)c1O ZINC000708135231 1086677339 /nfs/dbraw/zinc/67/73/39/1086677339.db2.gz YDRZCFCGQYTOKC-UHFFFAOYSA-N 1 2 321.602 2.115 20 10 DECDLO CN1C(=O)C[C@]2(CCC[N@H+](Cc3cccc(Cl)c3O)C2)C1=O ZINC001274234685 1091142061 /nfs/dbraw/zinc/14/20/61/1091142061.db2.gz OGLAOMGATLFSPY-INIZCTEOSA-N 1 2 322.792 2.017 20 10 DECDLO CN1C(=O)C[C@]2(CCC[N@@H+](Cc3cccc(Cl)c3O)C2)C1=O ZINC001274234685 1091142063 /nfs/dbraw/zinc/14/20/63/1091142063.db2.gz OGLAOMGATLFSPY-INIZCTEOSA-N 1 2 322.792 2.017 20 10 DECDLO C[C@]1(CO)CC[N@H+](Cc2c(O)ccc(Cl)c2Cl)C[C@@H]1O ZINC001237077004 1138498144 /nfs/dbraw/zinc/49/81/44/1138498144.db2.gz BMGFWMSEZDTXBI-GXTWGEPZSA-N 1 2 320.216 2.264 20 10 DECDLO C[C@]1(CO)CC[N@@H+](Cc2c(O)ccc(Cl)c2Cl)C[C@@H]1O ZINC001237077004 1138498165 /nfs/dbraw/zinc/49/81/65/1138498165.db2.gz BMGFWMSEZDTXBI-GXTWGEPZSA-N 1 2 320.216 2.264 20 10 DECDLO C[C@@]1(CO)CC[N@H+](Cc2c(O)ccc(Cl)c2Cl)C[C@H]1O ZINC001237077008 1138499032 /nfs/dbraw/zinc/49/90/32/1138499032.db2.gz BMGFWMSEZDTXBI-OCCSQVGLSA-N 1 2 320.216 2.264 20 10 DECDLO C[C@@]1(CO)CC[N@@H+](Cc2c(O)ccc(Cl)c2Cl)C[C@H]1O ZINC001237077008 1138499035 /nfs/dbraw/zinc/49/90/35/1138499035.db2.gz BMGFWMSEZDTXBI-OCCSQVGLSA-N 1 2 320.216 2.264 20 10 DECDLO Cc1cc(F)cc(C[NH+]2CCN(C(=O)c3ccco3)CC2)c1O ZINC001238055582 1138818979 /nfs/dbraw/zinc/81/89/79/1138818979.db2.gz AKQXKVNBLIHUAI-UHFFFAOYSA-N 1 2 318.348 2.391 20 10 DECDLO CC1(C)C=Cc2c(O)c(C[N@@H+]3CCNC(=O)C3(C)C)ccc2O1 ZINC001249244992 1141864212 /nfs/dbraw/zinc/86/42/12/1141864212.db2.gz SQTCJSSWMQGCCN-UHFFFAOYSA-N 1 2 316.401 2.287 20 10 DECDLO CC1(C)C=Cc2c(O)c(C[N@H+]3CCNC(=O)C3(C)C)ccc2O1 ZINC001249244992 1141864213 /nfs/dbraw/zinc/86/42/13/1141864213.db2.gz SQTCJSSWMQGCCN-UHFFFAOYSA-N 1 2 316.401 2.287 20 10 DECDLO COC(=O)C[N@H+](C)Cc1cc(C)c(Br)cc1O ZINC001250133401 1142087302 /nfs/dbraw/zinc/08/73/02/1142087302.db2.gz LTTALKPRADIKCG-UHFFFAOYSA-N 1 2 302.168 2.068 20 10 DECDLO COC(=O)C[N@@H+](C)Cc1cc(C)c(Br)cc1O ZINC001250133401 1142087310 /nfs/dbraw/zinc/08/73/10/1142087310.db2.gz LTTALKPRADIKCG-UHFFFAOYSA-N 1 2 302.168 2.068 20 10 DECDLO CCN(CC)c1ccc(CNC(=O)C[C@H]([NH3+])C(F)F)cc1F ZINC001263099182 1144355481 /nfs/dbraw/zinc/35/54/81/1144355481.db2.gz AKIFWWIYMUQNPQ-LBPRGKRZSA-N 1 2 317.355 2.271 20 10 DECDLO C[C@H]([NH2+][C@@H](CO)C[C@H](O)C(C)(C)C)c1ccc(F)c(F)c1O ZINC000284368460 299349987 /nfs/dbraw/zinc/34/99/87/299349987.db2.gz ODAHKPFYKBXNIV-CWSCBRNRSA-N 1 2 317.376 2.479 20 10 DECDLO COC[C@H]1C[N@H+](Cc2cc(Br)ccc2O)CCO1 ZINC000093528198 193264115 /nfs/dbraw/zinc/26/41/15/193264115.db2.gz CYUIEPSJFIXMON-GFCCVEGCSA-N 1 2 316.195 2.002 20 10 DECDLO COC[C@H]1C[N@@H+](Cc2cc(Br)ccc2O)CCO1 ZINC000093528198 193264117 /nfs/dbraw/zinc/26/41/17/193264117.db2.gz CYUIEPSJFIXMON-GFCCVEGCSA-N 1 2 316.195 2.002 20 10 DECDLO CC[N@H+](Cc1cccc(Cl)c1O)[C@@H](C)CS(C)(=O)=O ZINC000180244416 285105578 /nfs/dbraw/zinc/10/55/78/285105578.db2.gz CGIKLENJXKYCGL-JTQLQIEISA-N 1 2 305.827 2.301 20 10 DECDLO CC[N@@H+](Cc1cccc(Cl)c1O)[C@@H](C)CS(C)(=O)=O ZINC000180244416 285105580 /nfs/dbraw/zinc/10/55/80/285105580.db2.gz CGIKLENJXKYCGL-JTQLQIEISA-N 1 2 305.827 2.301 20 10 DECDLO C[C@H]([NH2+]C[C@](C)(O)C(F)(F)F)c1cc([N+](=O)[O-])ccc1O ZINC000273546772 130134982 /nfs/dbraw/zinc/13/49/82/130134982.db2.gz ZOAPDUGXTKRXKN-CPCISQLKSA-N 1 2 308.256 2.264 20 10 DECDLO COc1cc(O)c(C[N@@H+]2CCC[C@H]2c2nc(C)no2)cc1OC ZINC000285110778 131139770 /nfs/dbraw/zinc/13/97/70/131139770.db2.gz LTQFHTSPCNHXTI-LBPRGKRZSA-N 1 2 319.361 2.438 20 10 DECDLO COc1cc(O)c(C[N@H+]2CCC[C@H]2c2nc(C)no2)cc1OC ZINC000285110778 131139772 /nfs/dbraw/zinc/13/97/72/131139772.db2.gz LTQFHTSPCNHXTI-LBPRGKRZSA-N 1 2 319.361 2.438 20 10 DECDLO COCCC[N@H+](CC(=O)OC)Cc1cc(Cl)ccc1O ZINC000111238298 401702796 /nfs/dbraw/zinc/70/27/96/401702796.db2.gz LYAMNWHIZOILGR-UHFFFAOYSA-N 1 2 301.770 2.057 20 10 DECDLO COCCC[N@@H+](CC(=O)OC)Cc1cc(Cl)ccc1O ZINC000111238298 401702797 /nfs/dbraw/zinc/70/27/97/401702797.db2.gz LYAMNWHIZOILGR-UHFFFAOYSA-N 1 2 301.770 2.057 20 10 DECDLO Cc1nc(CN2CC[NH+](Cc3c(O)cccc3Cl)CC2)no1 ZINC000123142509 402112506 /nfs/dbraw/zinc/11/25/06/402112506.db2.gz UWPQCMOPLJKLEL-UHFFFAOYSA-N 1 2 322.796 2.055 20 10 DECDLO CCS(=O)(=O)CC[NH2+]Cc1cc(Cl)cc(Cl)c1O ZINC000069172871 402215318 /nfs/dbraw/zinc/21/53/18/402215318.db2.gz WMGWDEKJDJEHOR-UHFFFAOYSA-N 1 2 312.218 2.223 20 10 DECDLO COc1c(O)c(C[NH2+][C@@H]2CCCc3cn[nH]c32)ccc1[N+](=O)[O-] ZINC000278545694 402867892 /nfs/dbraw/zinc/86/78/92/402867892.db2.gz YESKJRAEKDCTKF-LLVKDONJSA-N 1 2 318.333 2.199 20 10 DECDLO COc1c(O)c(C[NH2+][C@@H]2CCCc3c[nH]nc32)ccc1[N+](=O)[O-] ZINC000278545694 402867895 /nfs/dbraw/zinc/86/78/95/402867895.db2.gz YESKJRAEKDCTKF-LLVKDONJSA-N 1 2 318.333 2.199 20 10 DECDLO COCCOCCOCC[N@H+](C)Cc1cccc(Cl)c1O ZINC000276204444 403153713 /nfs/dbraw/zinc/15/37/13/403153713.db2.gz OGVHOBSWXNVGCR-UHFFFAOYSA-N 1 2 317.813 2.157 20 10 DECDLO COCCOCCOCC[N@@H+](C)Cc1cccc(Cl)c1O ZINC000276204444 403153714 /nfs/dbraw/zinc/15/37/14/403153714.db2.gz OGVHOBSWXNVGCR-UHFFFAOYSA-N 1 2 317.813 2.157 20 10 DECDLO CCOC(=O)[C@H](F)C1C[NH+](Cc2ccc(N(C)C)c(F)c2)C1 ZINC000293921492 403600307 /nfs/dbraw/zinc/60/03/07/403600307.db2.gz MQDKBIMQNXWTSB-OAHLLOKOSA-N 1 2 312.360 2.225 20 10 DECDLO NC(=O)[C@H]([NH2+]Cc1ccc(N2CCCCC2)cc1)c1ccccn1 ZINC000295144574 403773525 /nfs/dbraw/zinc/77/35/25/403773525.db2.gz QJKDTGGMQQVUGP-GOSISDBHSA-N 1 2 324.428 2.388 20 10 DECDLO Cc1c2ccccc2n(C)c1CNC(=O)NCc1c[nH+]cn1C ZINC000358090237 404753337 /nfs/dbraw/zinc/75/33/37/404753337.db2.gz IIOWIHCMXDKBAU-UHFFFAOYSA-N 1 2 311.389 2.220 20 10 DECDLO NC(=O)[C@H]1c2ccccc2CC[N@H+]1Cc1cc(F)ccc1O ZINC000361053063 404895088 /nfs/dbraw/zinc/89/50/88/404895088.db2.gz PLKAESIYYVLRFG-MRXNPFEDSA-N 1 2 300.333 2.116 20 10 DECDLO NC(=O)[C@H]1c2ccccc2CC[N@@H+]1Cc1cc(F)ccc1O ZINC000361053063 404895092 /nfs/dbraw/zinc/89/50/92/404895092.db2.gz PLKAESIYYVLRFG-MRXNPFEDSA-N 1 2 300.333 2.116 20 10 DECDLO CC[C@@H]([NH2+][C@H](C(N)=O)c1ccccn1)c1ccc(N(C)C)cc1 ZINC000297286527 280195266 /nfs/dbraw/zinc/19/52/66/280195266.db2.gz LPDZILGDFGSLIZ-WBVHZDCISA-N 1 2 312.417 2.415 20 10 DECDLO COC[C@H]([NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1O)[C@H]1CCCO1 ZINC000278628682 293165336 /nfs/dbraw/zinc/16/53/36/293165336.db2.gz CPNRHXBRFABDBS-RIEGTJTDSA-N 1 2 310.350 2.145 20 10 DECDLO CN(C)c1ccc(/C=C/C[NH+]2CCN(C(=O)C3CC3)CC2)cc1 ZINC000835025744 649867977 /nfs/dbraw/zinc/86/79/77/649867977.db2.gz MNSGLCHMBZJWBI-ONEGZZNKSA-N 1 2 313.445 2.320 20 10 DECDLO COc1ccc(O)c(C[N@@H+]2CCOC[C@H]2c2c(C)n[nH]c2C)c1 ZINC000375016651 534200291 /nfs/dbraw/zinc/20/02/91/534200291.db2.gz FROYBDXPGDQYHJ-HNNXBMFYSA-N 1 2 317.389 2.314 20 10 DECDLO COc1ccc(O)c(C[N@H+]2CCOC[C@H]2c2c(C)n[nH]c2C)c1 ZINC000375016651 534200297 /nfs/dbraw/zinc/20/02/97/534200297.db2.gz FROYBDXPGDQYHJ-HNNXBMFYSA-N 1 2 317.389 2.314 20 10 DECDLO CCCOC(=O)[C@@H](C)[N@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000158639357 520215030 /nfs/dbraw/zinc/21/50/30/520215030.db2.gz KPZPWUOLXKKHMH-OAHLLOKOSA-N 1 2 320.433 2.297 20 10 DECDLO CCCOC(=O)[C@@H](C)[N@@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000158639357 520215037 /nfs/dbraw/zinc/21/50/37/520215037.db2.gz KPZPWUOLXKKHMH-OAHLLOKOSA-N 1 2 320.433 2.297 20 10 DECDLO Cc1nc(CN2CC[NH+](Cc3cccc(Cl)c3O)CC2)no1 ZINC000180153563 526866147 /nfs/dbraw/zinc/86/61/47/526866147.db2.gz SVQVCMUVNJIZHX-UHFFFAOYSA-N 1 2 322.796 2.055 20 10 DECDLO CN(C)c1noc(C[NH2+]C/C=C\c2ccc(N(C)C)cc2)n1 ZINC000835047660 649871427 /nfs/dbraw/zinc/87/14/27/649871427.db2.gz TWTLYKURTZWHNZ-WAYWQWQTSA-N 1 2 301.394 2.005 20 10 DECDLO CN(C)c1ccc(/C=C\C[N@@H+]2CCC[C@H](S(C)(=O)=O)C2)cc1 ZINC000835048055 649871457 /nfs/dbraw/zinc/87/14/57/649871457.db2.gz YZCRRQSHAJDIQZ-AATOQMJSSA-N 1 2 322.474 2.275 20 10 DECDLO CN(C)c1ccc(/C=C\C[N@H+]2CCC[C@H](S(C)(=O)=O)C2)cc1 ZINC000835048055 649871460 /nfs/dbraw/zinc/87/14/60/649871460.db2.gz YZCRRQSHAJDIQZ-AATOQMJSSA-N 1 2 322.474 2.275 20 10 DECDLO [NH3+]C[C@H]1CN(Cc2cc(Cl)cc(Cl)c2O)CCCO1 ZINC000313333625 633514195 /nfs/dbraw/zinc/51/41/95/633514195.db2.gz ACHSPDKUZFOUHU-NSHDSACASA-N 1 2 305.205 2.249 20 10 DECDLO Cc1nnc([C@H]2CCC[N@H+](Cc3cc(F)cc(F)c3O)C2)[nH]1 ZINC000894093872 636110681 /nfs/dbraw/zinc/11/06/81/636110681.db2.gz HRHMTPVJHPDLJN-JTQLQIEISA-N 1 2 308.332 2.477 20 10 DECDLO Cc1nnc([C@H]2CCC[N@@H+](Cc3cc(F)cc(F)c3O)C2)[nH]1 ZINC000894093872 636110682 /nfs/dbraw/zinc/11/06/82/636110682.db2.gz HRHMTPVJHPDLJN-JTQLQIEISA-N 1 2 308.332 2.477 20 10 DECDLO Oc1c(F)cc(F)cc1C[NH2+]C[C@@H]1CCN1C1CCOCC1 ZINC000922954006 636881032 /nfs/dbraw/zinc/88/10/32/636881032.db2.gz GBAXLRZVSIYALD-AWEZNQCLSA-N 1 2 312.360 2.013 20 10 DECDLO C[N@H+](CCCNC(=O)C1CCC1)Cc1cc(F)cc(F)c1O ZINC000894564801 637108634 /nfs/dbraw/zinc/10/86/34/637108634.db2.gz ABCJFAFGTAJWKS-UHFFFAOYSA-N 1 2 312.360 2.409 20 10 DECDLO C[N@@H+](CCCNC(=O)C1CCC1)Cc1cc(F)cc(F)c1O ZINC000894564801 637108639 /nfs/dbraw/zinc/10/86/39/637108639.db2.gz ABCJFAFGTAJWKS-UHFFFAOYSA-N 1 2 312.360 2.409 20 10 DECDLO C[C@H]1C[N@H+](Cc2cc(F)cc(F)c2O)CC2(CCOCC2)O1 ZINC000894595149 637126535 /nfs/dbraw/zinc/12/65/35/637126535.db2.gz AINVTNSGFFZRRC-NSHDSACASA-N 1 2 313.344 2.440 20 10 DECDLO C[C@H]1C[N@@H+](Cc2cc(F)cc(F)c2O)CC2(CCOCC2)O1 ZINC000894595149 637126536 /nfs/dbraw/zinc/12/65/36/637126536.db2.gz AINVTNSGFFZRRC-NSHDSACASA-N 1 2 313.344 2.440 20 10 DECDLO CC[C@@H](CN1CCOCC1)[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000896617894 638609007 /nfs/dbraw/zinc/60/90/07/638609007.db2.gz LAMJYKYQTKPNIT-LBPRGKRZSA-N 1 2 316.804 2.385 20 10 DECDLO C[C@@H]([NH2+]CC(C)(C)N1CCOCC1)c1cc(F)cc(F)c1O ZINC000756369932 639655646 /nfs/dbraw/zinc/65/56/46/639655646.db2.gz DOPDFMMJNXPTAP-LLVKDONJSA-N 1 2 314.376 2.432 20 10 DECDLO CC(C)C(=O)NCCC[NH2+][C@H](C)c1cc(F)cc(F)c1O ZINC000756774287 639694056 /nfs/dbraw/zinc/69/40/56/639694056.db2.gz BOCZQBSJRQIQSS-SNVBAGLBSA-N 1 2 300.349 2.483 20 10 DECDLO COC[C@@](C)(CC(=O)OC)[NH2+]Cc1cccc(Cl)c1O ZINC000757922520 639895719 /nfs/dbraw/zinc/89/57/19/639895719.db2.gz CFCFRXAWMROCFE-CQSZACIVSA-N 1 2 301.770 2.103 20 10 DECDLO Nc1ccc(CCNC(=O)NCCCNc2cccc[nH+]2)cc1 ZINC000841704648 650544995 /nfs/dbraw/zinc/54/49/95/650544995.db2.gz DEXYWJOQOLLFPD-UHFFFAOYSA-N 1 2 313.405 2.008 20 10 DECDLO Cc1noc(C[NH2+][C@@H](C)c2ccc(N3CCOCC3)cc2)n1 ZINC000765760163 640816039 /nfs/dbraw/zinc/81/60/39/640816039.db2.gz XPTAQNRKSFPZBP-LBPRGKRZSA-N 1 2 302.378 2.065 20 10 DECDLO Nc1ccc(CCNC(=O)N2CCC[C@H](c3[nH]cc[nH+]3)C2)cc1 ZINC000841956331 650611923 /nfs/dbraw/zinc/61/19/23/650611923.db2.gz CMPKDGYVMYMYNE-AWEZNQCLSA-N 1 2 313.405 2.124 20 10 DECDLO C[C@H](NC(=O)c1cc([C@H]2CCC[N@@H+]2C)n[nH]1)c1ccccc1O ZINC000899182333 641974708 /nfs/dbraw/zinc/97/47/08/641974708.db2.gz XUEQZJZDFQDCQJ-XHDPSFHLSA-N 1 2 314.389 2.373 20 10 DECDLO C[C@H](NC(=O)c1cc([C@H]2CCC[N@H+]2C)n[nH]1)c1ccccc1O ZINC000899182333 641974711 /nfs/dbraw/zinc/97/47/11/641974711.db2.gz XUEQZJZDFQDCQJ-XHDPSFHLSA-N 1 2 314.389 2.373 20 10 DECDLO COc1c(O)c(CN2CC[N@H+](C)C[C@H]2C(C)C)ccc1[N+](=O)[O-] ZINC000775058419 642000779 /nfs/dbraw/zinc/00/07/79/642000779.db2.gz YRTVXQJZKZVVDT-AWEZNQCLSA-N 1 2 323.393 2.081 20 10 DECDLO COc1c(O)c(CN2CC[N@@H+](C)C[C@H]2C(C)C)ccc1[N+](=O)[O-] ZINC000775058419 642000783 /nfs/dbraw/zinc/00/07/83/642000783.db2.gz YRTVXQJZKZVVDT-AWEZNQCLSA-N 1 2 323.393 2.081 20 10 DECDLO COc1c(O)c(C[N@@H+]2CCN(C)C[C@H]2C(C)C)ccc1[N+](=O)[O-] ZINC000775058419 642000790 /nfs/dbraw/zinc/00/07/90/642000790.db2.gz YRTVXQJZKZVVDT-AWEZNQCLSA-N 1 2 323.393 2.081 20 10 DECDLO COc1c(O)c(C[N@H+]2CCN(C)C[C@H]2C(C)C)ccc1[N+](=O)[O-] ZINC000775058419 642000792 /nfs/dbraw/zinc/00/07/92/642000792.db2.gz YRTVXQJZKZVVDT-AWEZNQCLSA-N 1 2 323.393 2.081 20 10 DECDLO C[C@@H](NC(=O)[C@@H]1CCn2c[nH+]cc2C1)c1ccc(N(C)C)cc1 ZINC000775402420 642039130 /nfs/dbraw/zinc/03/91/30/642039130.db2.gz ARMGPCAXBISNTD-UKRRQHHQSA-N 1 2 312.417 2.389 20 10 DECDLO CCOC(=O)C[N@H+](C)Cc1cc(C)cc(Br)c1O ZINC000781897268 642796387 /nfs/dbraw/zinc/79/63/87/642796387.db2.gz QQFFGBCTXCEBEI-UHFFFAOYSA-N 1 2 316.195 2.458 20 10 DECDLO CCOC(=O)C[N@@H+](C)Cc1cc(C)cc(Br)c1O ZINC000781897268 642796392 /nfs/dbraw/zinc/79/63/92/642796392.db2.gz QQFFGBCTXCEBEI-UHFFFAOYSA-N 1 2 316.195 2.458 20 10 DECDLO C[C@@H]([NH2+][C@@H](C)c1cc(F)cc(F)c1O)c1nnnn1C1CC1 ZINC000790758135 643889268 /nfs/dbraw/zinc/88/92/68/643889268.db2.gz XGFGURMEDPOMSG-JGVFFNPUSA-N 1 2 309.320 2.404 20 10 DECDLO CC[C@H](C)[C@@H]([NH2+][C@@H]1CCN(c2ccc(OC)cc2)C1)C(=O)OC ZINC000905781442 644032797 /nfs/dbraw/zinc/03/27/97/644032797.db2.gz XORIFCALNFLFSE-JJRVBVJISA-N 1 2 320.433 2.451 20 10 DECDLO CC[C@H]([NH2+]C[C@H]1CN(C)CCN1C)c1cccc(Cl)c1O ZINC000806139580 645802479 /nfs/dbraw/zinc/80/24/79/645802479.db2.gz PVOMSMVSXGRKMF-WFASDCNBSA-N 1 2 311.857 2.332 20 10 DECDLO O=C(NCCc1ccc(O)c(O)c1)Nc1ccn2cc[nH+]c2c1 ZINC000810228338 646342205 /nfs/dbraw/zinc/34/22/05/646342205.db2.gz SPACQWDNVACDHI-UHFFFAOYSA-N 1 2 312.329 2.110 20 10 DECDLO C[C@@H](O)[C@H]1CCN(c2cc(NCc3ccccc3O)[nH+]cn2)C1 ZINC000840253577 646653005 /nfs/dbraw/zinc/65/30/05/646653005.db2.gz LZLAKQCJTCODAY-OCCSQVGLSA-N 1 2 314.389 2.001 20 10 DECDLO C[C@@H](O)[C@H]1CCN(c2cc(NCc3ccccc3O)nc[nH+]2)C1 ZINC000840253577 646653006 /nfs/dbraw/zinc/65/30/06/646653006.db2.gz LZLAKQCJTCODAY-OCCSQVGLSA-N 1 2 314.389 2.001 20 10 DECDLO C[C@H]([NH2+]Cc1ncn(C)n1)c1cccc(C(F)(F)F)c1O ZINC000815600354 647034384 /nfs/dbraw/zinc/03/43/84/647034384.db2.gz QZLFWTFYFPMXEM-QMMMGPOBSA-N 1 2 300.284 2.390 20 10 DECDLO Cc1cc(O)c(C[N@H+](CCS(C)(=O)=O)C2CC2)cc1Cl ZINC000824902367 648669812 /nfs/dbraw/zinc/66/98/12/648669812.db2.gz VKNSOMIMYXHWJW-UHFFFAOYSA-N 1 2 317.838 2.363 20 10 DECDLO Cc1cc(O)c(C[N@@H+](CCS(C)(=O)=O)C2CC2)cc1Cl ZINC000824902367 648669815 /nfs/dbraw/zinc/66/98/15/648669815.db2.gz VKNSOMIMYXHWJW-UHFFFAOYSA-N 1 2 317.838 2.363 20 10 DECDLO Oc1cc(F)c(Cl)cc1CN1CC[NH+]([C@@H]2CCOC2)CC1 ZINC000827125994 648976908 /nfs/dbraw/zinc/97/69/08/648976908.db2.gz VEGGMKXSVDCJEL-GFCCVEGCSA-N 1 2 314.788 2.091 20 10 DECDLO CC[C@@H](C(=O)N[C@@H](C)c1ccccc1O)[N@@H+]1CCO[C@@H](CC)C1 ZINC000827964526 649112660 /nfs/dbraw/zinc/11/26/60/649112660.db2.gz OLOCEEWFLPSXDB-DZKIICNBSA-N 1 2 320.433 2.459 20 10 DECDLO CC[C@@H](C(=O)N[C@@H](C)c1ccccc1O)[N@H+]1CCO[C@@H](CC)C1 ZINC000827964526 649112661 /nfs/dbraw/zinc/11/26/61/649112661.db2.gz OLOCEEWFLPSXDB-DZKIICNBSA-N 1 2 320.433 2.459 20 10 DECDLO C[C@H](NC(=O)[C@H]1COCC[N@@H+]1C1CCCC1)c1ccccc1O ZINC000827970189 649114101 /nfs/dbraw/zinc/11/41/01/649114101.db2.gz ZAELRDAGLPYFPF-XJKSGUPXSA-N 1 2 318.417 2.213 20 10 DECDLO C[C@H](NC(=O)[C@H]1COCC[N@H+]1C1CCCC1)c1ccccc1O ZINC000827970189 649114104 /nfs/dbraw/zinc/11/41/04/649114104.db2.gz ZAELRDAGLPYFPF-XJKSGUPXSA-N 1 2 318.417 2.213 20 10 DECDLO c1n[nH]c2c1C[N@H+](Cc1ccc(N3CCOCC3)cc1)CCC2 ZINC000828013986 649121068 /nfs/dbraw/zinc/12/10/68/649121068.db2.gz QFMFXNLHRZZACO-UHFFFAOYSA-N 1 2 312.417 2.195 20 10 DECDLO c1n[nH]c2c1C[N@@H+](Cc1ccc(N3CCOCC3)cc1)CCC2 ZINC000828013986 649121074 /nfs/dbraw/zinc/12/10/74/649121074.db2.gz QFMFXNLHRZZACO-UHFFFAOYSA-N 1 2 312.417 2.195 20 10 DECDLO Cc1cc(C(=O)C[N@H+](C)CCCO)c(C)n1-c1ccc(F)cn1 ZINC000829468919 649311549 /nfs/dbraw/zinc/31/15/49/649311549.db2.gz UPERILAZIKWUAK-UHFFFAOYSA-N 1 2 319.380 2.125 20 10 DECDLO Cc1cc(C(=O)C[N@@H+](C)CCCO)c(C)n1-c1ccc(F)cn1 ZINC000829468919 649311553 /nfs/dbraw/zinc/31/15/53/649311553.db2.gz UPERILAZIKWUAK-UHFFFAOYSA-N 1 2 319.380 2.125 20 10 DECDLO Cc1cc(N(C)C)ccc1CNC(=O)[C@@H]1CCc2c[nH+]cn2C1 ZINC000844134807 651081843 /nfs/dbraw/zinc/08/18/43/651081843.db2.gz QUTZKRVBTYRIAE-OAHLLOKOSA-N 1 2 312.417 2.136 20 10 DECDLO COC(=O)[C@@H]1C[N@H+](C/C=C\c2ccc(N(C)C)cc2)C[C@H](C)O1 ZINC000846060409 651305322 /nfs/dbraw/zinc/30/53/22/651305322.db2.gz NDXOMONHQXBWBN-DEUPEYTOSA-N 1 2 318.417 2.028 20 10 DECDLO COC(=O)[C@@H]1C[N@@H+](C/C=C\c2ccc(N(C)C)cc2)C[C@H](C)O1 ZINC000846060409 651305323 /nfs/dbraw/zinc/30/53/23/651305323.db2.gz NDXOMONHQXBWBN-DEUPEYTOSA-N 1 2 318.417 2.028 20 10 DECDLO COC(=O)[C@H]([NH2+]Cc1ccccc1O)[C@H]1CCC[C@@H](OC)C1 ZINC000846109726 651308457 /nfs/dbraw/zinc/30/84/57/651308457.db2.gz VETCRUXUBJSRRG-JGGQBBKZSA-N 1 2 307.390 2.229 20 10 DECDLO CC(C)OC(=O)[C@H](C)[N@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000093773067 684051616 /nfs/dbraw/zinc/05/16/16/684051616.db2.gz XAWBJNMUZHHNDP-HNNXBMFYSA-N 1 2 320.433 2.295 20 10 DECDLO CC(C)OC(=O)[C@H](C)[N@@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000093773067 684051620 /nfs/dbraw/zinc/05/16/20/684051620.db2.gz XAWBJNMUZHHNDP-HNNXBMFYSA-N 1 2 320.433 2.295 20 10 DECDLO CN(C)c1ccc(C[NH+]2CCN(CC(F)(F)F)CC2)cc1 ZINC000194513761 685068956 /nfs/dbraw/zinc/06/89/56/685068956.db2.gz QJHAIHGXWMYNML-UHFFFAOYSA-N 1 2 301.356 2.433 20 10 DECDLO CS[C@@H](CO)[C@H](C)[NH2+]Cc1cccc(Br)c1O ZINC000219044693 685106109 /nfs/dbraw/zinc/10/61/09/685106109.db2.gz NRWIMIVVOWICAJ-KWQFWETISA-N 1 2 320.252 2.357 20 10 DECDLO CCc1cccc(C[NH2+][C@H](C[C@H]2CCCOC2)C(=O)OC)c1O ZINC000862515961 686313801 /nfs/dbraw/zinc/31/38/01/686313801.db2.gz GWJHUPHSVPJRIE-CZUORRHYSA-N 1 2 321.417 2.403 20 10 DECDLO CN(C)C(=O)O[C@@H]1CCC[N@H+](Cc2ccc(F)c(F)c2O)C1 ZINC000877560566 690152393 /nfs/dbraw/zinc/15/23/93/690152393.db2.gz VDQDSWWOJWXKEW-LLVKDONJSA-N 1 2 314.332 2.333 20 10 DECDLO CN(C)C(=O)O[C@@H]1CCC[N@@H+](Cc2ccc(F)c(F)c2O)C1 ZINC000877560566 690152394 /nfs/dbraw/zinc/15/23/94/690152394.db2.gz VDQDSWWOJWXKEW-LLVKDONJSA-N 1 2 314.332 2.333 20 10 DECDLO CCOC(=O)C[N@H+](CC[C@@H](O)C(C)C)Cc1ccccc1O ZINC000878728449 690486954 /nfs/dbraw/zinc/48/69/54/690486954.db2.gz MYWGCBCJHBYPBZ-OAHLLOKOSA-N 1 2 309.406 2.164 20 10 DECDLO CCOC(=O)C[N@@H+](CC[C@@H](O)C(C)C)Cc1ccccc1O ZINC000878728449 690486957 /nfs/dbraw/zinc/48/69/57/690486957.db2.gz MYWGCBCJHBYPBZ-OAHLLOKOSA-N 1 2 309.406 2.164 20 10 DECDLO CC[NH+](CC)Cc1cn(Cc2cc(F)cc(C(C)=O)c2O)nn1 ZINC000880996032 691010945 /nfs/dbraw/zinc/01/09/45/691010945.db2.gz MJQFBYYVQYVLLO-UHFFFAOYSA-N 1 2 320.368 2.216 20 10 DECDLO COc1ccc(N(C)CCN(C)c2cc(CO)cc[nH+]2)cc1 ZINC000882527011 691305369 /nfs/dbraw/zinc/30/53/69/691305369.db2.gz VJDYTRFXBQDJHD-UHFFFAOYSA-N 1 2 301.390 2.155 20 10 DECDLO C[C@H]([NH2+][C@@H](CO)C[C@@H]1CCCO1)c1cc(F)cc(F)c1O ZINC000886669816 692154589 /nfs/dbraw/zinc/15/45/89/692154589.db2.gz FGNNCRUKZMWQIU-WCQGTBRESA-N 1 2 301.333 2.251 20 10 DECDLO CN(Cc1ccc(N2CCCC2)cc1)C(=O)Cc1c[nH+]cn1C ZINC001440713394 1181648356 /nfs/dbraw/zinc/64/83/56/1181648356.db2.gz IKGBZRURPFISRR-UHFFFAOYSA-N 1 2 312.417 2.221 20 10 DECDLO Cn1cc[nH+]c1C[C@@H]1CCCN(C(=O)Cc2ccc(N)cc2)C1 ZINC001332151862 1149826195 /nfs/dbraw/zinc/82/61/95/1149826195.db2.gz IEYCUFPPRCUJSS-HNNXBMFYSA-N 1 2 312.417 2.026 20 10 DECDLO CCOc1ccc(N2CC[NH+](Cc3nn(C)cc3C)CC2)cc1 ZINC001332685126 1149880270 /nfs/dbraw/zinc/88/02/70/1149880270.db2.gz PLACLTDLTRYPDO-UHFFFAOYSA-N 1 2 314.433 2.449 20 10 DECDLO C[C@@H]1CN(C2C[NH+](Cc3ccc(Cl)cc3O)C2)C[C@@H](C)O1 ZINC001140468381 777201336 /nfs/dbraw/zinc/20/13/36/777201336.db2.gz ISXMOIBGFAJEIF-VXGBXAGGSA-N 1 2 310.825 2.339 20 10 DECDLO OC[C@@H]1CC[N@@H+](Cc2cc(Br)c(F)cc2O)C1 ZINC001144300049 790848880 /nfs/dbraw/zinc/84/88/80/790848880.db2.gz PYRXRBBRSULLJE-MRVPVSSYSA-N 1 2 304.159 2.108 20 10 DECDLO C[C@H]1C[N@H+](Cc2cc(Br)c(F)cc2O)CC[C@@H]1O ZINC001144298959 790848030 /nfs/dbraw/zinc/84/80/30/790848030.db2.gz MRNGUPNSIFSCKV-UFBFGSQYSA-N 1 2 318.186 2.497 20 10 DECDLO C[C@H]1C[N@@H+](Cc2cc(Br)c(F)cc2O)CC[C@@H]1O ZINC001144298959 790848044 /nfs/dbraw/zinc/84/80/44/790848044.db2.gz MRNGUPNSIFSCKV-UFBFGSQYSA-N 1 2 318.186 2.497 20 10 DECDLO OC[C@@H]1CC[N@H+](Cc2cc(Br)c(F)cc2O)C1 ZINC001144300049 790848863 /nfs/dbraw/zinc/84/88/63/790848863.db2.gz PYRXRBBRSULLJE-MRVPVSSYSA-N 1 2 304.159 2.108 20 10 DECDLO COc1cc2[nH+]ccn2cc1NCC(=O)c1ccc(O)c(O)c1 ZINC001170322717 786908304 /nfs/dbraw/zinc/90/83/04/786908304.db2.gz NPQMBCPYLJVGDE-UHFFFAOYSA-N 1 2 313.313 2.049 20 10 DECDLO CN(CC[NH+](C)C)Cc1cc(Br)cc(F)c1O ZINC000715711757 792506588 /nfs/dbraw/zinc/50/65/88/792506588.db2.gz HZINTLKLKGNQGJ-UHFFFAOYSA-N 1 2 305.191 2.287 20 10 DECDLO CCOC[C@@H]1C[N@H+](Cc2cccc(F)c2O)Cc2cn(C)nc21 ZINC001138125733 796167390 /nfs/dbraw/zinc/16/73/90/796167390.db2.gz WUURIIZUEIJZDJ-AWEZNQCLSA-N 1 2 319.380 2.401 20 10 DECDLO CCOC[C@@H]1C[N@@H+](Cc2cccc(F)c2O)Cc2cn(C)nc21 ZINC001138125733 796167394 /nfs/dbraw/zinc/16/73/94/796167394.db2.gz WUURIIZUEIJZDJ-AWEZNQCLSA-N 1 2 319.380 2.401 20 10 DECDLO CC[NH+](CC)C[C@@H]1CN(Cc2c(F)ccc(F)c2O)CCO1 ZINC001139690250 796410771 /nfs/dbraw/zinc/41/07/71/796410771.db2.gz TWKAGJBNDDGYKX-GFCCVEGCSA-N 1 2 314.376 2.213 20 10 DECDLO Oc1cc(F)cc(F)c1C[N@@H+]1C[C@@H]2COC[C@H](C1)C2(F)F ZINC001140584288 796541836 /nfs/dbraw/zinc/54/18/36/796541836.db2.gz LSEXMIDMPROXLE-DTORHVGOSA-N 1 2 305.271 2.384 20 10 DECDLO Oc1cc(F)cc(F)c1C[N@H+]1C[C@@H]2COC[C@H](C1)C2(F)F ZINC001140584288 796541837 /nfs/dbraw/zinc/54/18/37/796541837.db2.gz LSEXMIDMPROXLE-DTORHVGOSA-N 1 2 305.271 2.384 20 10 DECDLO C[C@H]1C[NH+](Cc2ccc(N3CCOCC3)cc2F)C[C@H](C)O1 ZINC001140662331 796551950 /nfs/dbraw/zinc/55/19/50/796551950.db2.gz ONZJFWGAFIEJRE-KBPBESRZSA-N 1 2 308.397 2.272 20 10 DECDLO Fc1cc(N2CCOCC2)ccc1C[N@@H+]1CCOC[C@@H]1C1CC1 ZINC001140664537 796553383 /nfs/dbraw/zinc/55/33/83/796553383.db2.gz KOYICSAFMWCACC-GOSISDBHSA-N 1 2 320.408 2.273 20 10 DECDLO Fc1cc(N2CCOCC2)ccc1C[N@H+]1CCOC[C@@H]1C1CC1 ZINC001140664537 796553388 /nfs/dbraw/zinc/55/33/88/796553388.db2.gz KOYICSAFMWCACC-GOSISDBHSA-N 1 2 320.408 2.273 20 10 DECDLO COc1cc(O)c(CN2CCc3c([nH+]cn3C)C2)cc1Cl ZINC001232269345 801835789 /nfs/dbraw/zinc/83/57/89/801835789.db2.gz WKTRCRPSMYCXHX-UHFFFAOYSA-N 1 2 307.781 2.346 20 10 DECDLO COc1cc(Cl)cc(C[N@@H+]2CCc3c(cnn3C)C2)c1O ZINC001233290767 802065052 /nfs/dbraw/zinc/06/50/52/802065052.db2.gz UVZPMCOWTBPTOM-UHFFFAOYSA-N 1 2 307.781 2.346 20 10 DECDLO COc1cc(Cl)cc(C[N@H+]2CCc3c(cnn3C)C2)c1O ZINC001233290767 802065056 /nfs/dbraw/zinc/06/50/56/802065056.db2.gz UVZPMCOWTBPTOM-UHFFFAOYSA-N 1 2 307.781 2.346 20 10 DECDLO CCOC(=O)[C@H]1C[N@H+](Cc2cc(C(C)(C)C)ccc2O)CCO1 ZINC001233286128 802065085 /nfs/dbraw/zinc/06/50/85/802065085.db2.gz GOTSKTSSFJDHKX-MRXNPFEDSA-N 1 2 321.417 2.454 20 10 DECDLO CCOC(=O)[C@H]1C[N@@H+](Cc2cc(C(C)(C)C)ccc2O)CCO1 ZINC001233286128 802065088 /nfs/dbraw/zinc/06/50/88/802065088.db2.gz GOTSKTSSFJDHKX-MRXNPFEDSA-N 1 2 321.417 2.454 20 10 DECDLO C[C@H]([NH2+]CCCC(C)(C)CO)c1cccc(-c2nn[nH]n2)c1O ZINC001603662182 1070029083 /nfs/dbraw/zinc/02/90/83/1070029083.db2.gz GZSVMCPFAMNPIB-NSHDSACASA-N 1 2 319.409 2.022 20 10 DECDLO COC1(OC)CCOC[C@H]1[NH2+]Cc1c(O)ccc(Cl)c1F ZINC001461727795 1058702215 /nfs/dbraw/zinc/70/22/15/1058702215.db2.gz IJTROIMIAXAINL-GFCCVEGCSA-N 1 2 319.760 2.052 20 10 DECDLO CS(=O)(=O)C[C@H]1CCCC[N@@H+]1Cc1ccc(Cl)cc1O ZINC001474523820 1060887625 /nfs/dbraw/zinc/88/76/25/1060887625.db2.gz JKRFBSSTNYDBJQ-CYBMUJFWSA-N 1 2 317.838 2.445 20 10 DECDLO CS(=O)(=O)C[C@H]1CCCC[N@H+]1Cc1ccc(Cl)cc1O ZINC001474523820 1060887628 /nfs/dbraw/zinc/88/76/28/1060887628.db2.gz JKRFBSSTNYDBJQ-CYBMUJFWSA-N 1 2 317.838 2.445 20 10 DECDLO CC[C@@H]([NH2+]CCc1ccoc1)c1cccc(-c2nn[nH]n2)c1O ZINC001590470627 1076635272 /nfs/dbraw/zinc/63/52/72/1076635272.db2.gz ROZPKRZDJRSSAD-CQSZACIVSA-N 1 2 313.361 2.449 20 10 DECDLO CO[C@](C)(C[NH2+][C@H](C)c1cccc(-c2nn[nH]n2)c1O)C1CC1 ZINC001591317591 1076720836 /nfs/dbraw/zinc/72/08/36/1076720836.db2.gz GNVVPXVCXUVMAA-QLJPJBMISA-N 1 2 317.393 2.038 20 10 DECDLO C[C@H]1C[N@H+](Cc2cc(F)cc(Br)c2O)CC[C@H]1O ZINC001235297492 1084377020 /nfs/dbraw/zinc/37/70/20/1084377020.db2.gz MMZYKLXOVUBRNP-QPUJVOFHSA-N 1 2 318.186 2.497 20 10 DECDLO C[C@H]1C[N@@H+](Cc2cc(F)cc(Br)c2O)CC[C@H]1O ZINC001235297492 1084377028 /nfs/dbraw/zinc/37/70/28/1084377028.db2.gz MMZYKLXOVUBRNP-QPUJVOFHSA-N 1 2 318.186 2.497 20 10 DECDLO [NH3+][C@]12C[C@H]1CN(Cc1cc(Cl)cc(Br)c1O)C2 ZINC001236022106 1084592160 /nfs/dbraw/zinc/59/21/60/1084592160.db2.gz CACYDTZMMQTCQP-UFBFGSQYSA-N 1 2 317.614 2.341 20 10 DECDLO COC(=O)c1cnc2c(c1)C[N@@H+](Cc1c(O)cccc1F)CC2 ZINC001137841661 1086730410 /nfs/dbraw/zinc/73/04/10/1086730410.db2.gz OQGHHUUIPNFHAD-UHFFFAOYSA-N 1 2 316.332 2.271 20 10 DECDLO COC(=O)c1cnc2c(c1)C[N@H+](Cc1c(O)cccc1F)CC2 ZINC001137841661 1086730414 /nfs/dbraw/zinc/73/04/14/1086730414.db2.gz OQGHHUUIPNFHAD-UHFFFAOYSA-N 1 2 316.332 2.271 20 10 DECDLO CC1(C(N)=O)CC[NH+](Cc2cc(Cl)cc(F)c2O)CC1 ZINC001237620431 1138717897 /nfs/dbraw/zinc/71/78/97/1138717897.db2.gz MLTWASFAGZBCSD-UHFFFAOYSA-N 1 2 300.761 2.272 20 10 DECDLO O=C1NCC[C@]12CCC[N@@H+](Cc1cc(F)cc(Cl)c1O)C2 ZINC001237801026 1138792732 /nfs/dbraw/zinc/79/27/32/1138792732.db2.gz PVVRKRYXLXSXSS-HNNXBMFYSA-N 1 2 312.772 2.287 20 10 DECDLO O=C1NCC[C@]12CCC[N@H+](Cc1cc(F)cc(Cl)c1O)C2 ZINC001237801026 1138792743 /nfs/dbraw/zinc/79/27/43/1138792743.db2.gz PVVRKRYXLXSXSS-HNNXBMFYSA-N 1 2 312.772 2.287 20 10 DECDLO CCOC(=O)c1cc(C[NH2+]Cc2cccc(Cl)c2O)[nH]n1 ZINC001262378284 1144310466 /nfs/dbraw/zinc/31/04/66/1144310466.db2.gz XXXBCWDGWZQGPZ-UHFFFAOYSA-N 1 2 309.753 2.235 20 10 DECDLO Oc1cc(F)c(F)cc1C[NH2+]C1(c2ncccn2)CCOCC1 ZINC001308954331 1147491634 /nfs/dbraw/zinc/49/16/34/1147491634.db2.gz YEISPNKMIFNYDU-UHFFFAOYSA-N 1 2 321.327 2.256 20 10 DECDLO CCc1nnc([C@@H](C)[NH2+][C@H](C)c2cc(C(=O)OC)ccc2O)[nH]1 ZINC000273347964 130109867 /nfs/dbraw/zinc/10/98/67/130109867.db2.gz BCSJNDAPNXTHIH-NXEZZACHSA-N 1 2 318.377 2.271 20 10 DECDLO CCc1nnc([C@@H](C)[NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2O)[nH]1 ZINC000273539528 130134186 /nfs/dbraw/zinc/13/41/86/130134186.db2.gz YADLURKEKVBIHJ-RKDXNWHRSA-N 1 2 305.338 2.393 20 10 DECDLO COc1c(O)c(C[N@@H+]2C[C@@H](C)OC(C)(C)C2)ccc1[N+](=O)[O-] ZINC000278140193 286187124 /nfs/dbraw/zinc/18/71/24/286187124.db2.gz AXCOMRNYFBJMJN-SNVBAGLBSA-N 1 2 310.350 2.308 20 10 DECDLO COc1c(O)c(C[N@H+]2C[C@@H](C)OC(C)(C)C2)ccc1[N+](=O)[O-] ZINC000278140193 286187125 /nfs/dbraw/zinc/18/71/25/286187125.db2.gz AXCOMRNYFBJMJN-SNVBAGLBSA-N 1 2 310.350 2.308 20 10 DECDLO C[C@H]([NH2+]Cc1ncn(C)n1)c1ccc(Br)cc1O ZINC000186214688 402411493 /nfs/dbraw/zinc/41/14/93/402411493.db2.gz XLTXQUBYQCHBFQ-QMMMGPOBSA-N 1 2 311.183 2.134 20 10 DECDLO COc1c(O)c(C[N@@H+]2C[C@H](C)O[C@@H](C3CC3)C2)ccc1[N+](=O)[O-] ZINC000280492810 403005639 /nfs/dbraw/zinc/00/56/39/403005639.db2.gz FLQSGZOLOAIEJC-IINYFYTJSA-N 1 2 322.361 2.308 20 10 DECDLO COc1c(O)c(C[N@H+]2C[C@H](C)O[C@@H](C3CC3)C2)ccc1[N+](=O)[O-] ZINC000280492810 403005640 /nfs/dbraw/zinc/00/56/40/403005640.db2.gz FLQSGZOLOAIEJC-IINYFYTJSA-N 1 2 322.361 2.308 20 10 DECDLO CC(C)S(=O)(=O)CC[NH2+][C@H](C)c1ccc(F)c(F)c1O ZINC000290354762 404138979 /nfs/dbraw/zinc/13/89/79/404138979.db2.gz QIQUILMRSFTBCE-SECBINFHSA-N 1 2 307.362 2.144 20 10 DECDLO CN(C)C(=O)N1CC[NH+](C/C=C\c2ccc(N(C)C)cc2)CC1 ZINC000835025961 649868222 /nfs/dbraw/zinc/86/82/22/649868222.db2.gz PCDXHLJPSNMDJO-WAYWQWQTSA-N 1 2 316.449 2.065 20 10 DECDLO Cc1ccc(O)c(C[N@@H+]2CCNC(=O)[C@H]2c2cccs2)c1 ZINC000377243499 534195777 /nfs/dbraw/zinc/19/57/77/534195777.db2.gz JMWCQMTYYRJROG-OAHLLOKOSA-N 1 2 302.399 2.435 20 10 DECDLO Cc1ccc(O)c(C[N@H+]2CCNC(=O)[C@H]2c2cccs2)c1 ZINC000377243499 534195783 /nfs/dbraw/zinc/19/57/83/534195783.db2.gz JMWCQMTYYRJROG-OAHLLOKOSA-N 1 2 302.399 2.435 20 10 DECDLO CCCCC[N@H+](CC(N)=O)Cc1cc(F)cc(C(C)=O)c1O ZINC000183039060 520159194 /nfs/dbraw/zinc/15/91/94/520159194.db2.gz OBDUCCQFDWGUHI-UHFFFAOYSA-N 1 2 310.369 2.211 20 10 DECDLO CCCCC[N@@H+](CC(N)=O)Cc1cc(F)cc(C(C)=O)c1O ZINC000183039060 520159201 /nfs/dbraw/zinc/15/92/01/520159201.db2.gz OBDUCCQFDWGUHI-UHFFFAOYSA-N 1 2 310.369 2.211 20 10 DECDLO C[C@H]([NH2+]Cc1nnc2n1CCCC2)c1ccc(F)c(F)c1O ZINC000187917644 525494500 /nfs/dbraw/zinc/49/45/00/525494500.db2.gz QXVDSNJNUUYCRG-VIFPVBQESA-N 1 2 308.332 2.449 20 10 DECDLO Cn1c[nH+]cc1CNC(=O)NCc1ccc(N2CCCC2)cc1 ZINC000290810154 624557405 /nfs/dbraw/zinc/55/74/05/624557405.db2.gz ZPNYVWAVXKROSX-UHFFFAOYSA-N 1 2 313.405 2.020 20 10 DECDLO CC(=O)c1cc(Cl)cc(C[N@H+](CC(N)=O)C2CCCC2)c1O ZINC000122709046 625127812 /nfs/dbraw/zinc/12/78/12/625127812.db2.gz CWVOROQCCWPRIP-UHFFFAOYSA-N 1 2 324.808 2.478 20 10 DECDLO CC(=O)c1cc(Cl)cc(C[N@@H+](CC(N)=O)C2CCCC2)c1O ZINC000122709046 625127815 /nfs/dbraw/zinc/12/78/15/625127815.db2.gz CWVOROQCCWPRIP-UHFFFAOYSA-N 1 2 324.808 2.478 20 10 DECDLO OC[C@H]1CCC[N@H+]1Cc1cc(Br)cc(F)c1O ZINC000893920524 636065466 /nfs/dbraw/zinc/06/54/66/636065466.db2.gz BPYUDBHTWVSLJX-SNVBAGLBSA-N 1 2 304.159 2.251 20 10 DECDLO COc1cc(C)cc(C[N@H+](C)Cc2nnc3ccccn32)c1O ZINC000893987261 636084744 /nfs/dbraw/zinc/08/47/44/636084744.db2.gz QAJNFDCKMIFOOB-UHFFFAOYSA-N 1 2 312.373 2.384 20 10 DECDLO COc1cc(C)cc(C[N@@H+](C)Cc2nnc3ccccn32)c1O ZINC000893987261 636084749 /nfs/dbraw/zinc/08/47/49/636084749.db2.gz QAJNFDCKMIFOOB-UHFFFAOYSA-N 1 2 312.373 2.384 20 10 DECDLO COC(=O)[C@H]1CC12CC[NH+](Cc1cc(F)cc(F)c1O)CC2 ZINC000894026818 636095483 /nfs/dbraw/zinc/09/54/83/636095483.db2.gz JBVXHSRYVPBCAN-GFCCVEGCSA-N 1 2 311.328 2.446 20 10 DECDLO C[C@@H](O)[C@@H]1CC[N@H+](Cc2cc(Br)cc(F)c2O)C1 ZINC000894430636 637035021 /nfs/dbraw/zinc/03/50/21/637035021.db2.gz HOWNZENIYVRVSF-RKDXNWHRSA-N 1 2 318.186 2.497 20 10 DECDLO C[C@@H](O)[C@@H]1CC[N@@H+](Cc2cc(Br)cc(F)c2O)C1 ZINC000894430636 637035023 /nfs/dbraw/zinc/03/50/23/637035023.db2.gz HOWNZENIYVRVSF-RKDXNWHRSA-N 1 2 318.186 2.497 20 10 DECDLO C[N@H+](Cc1cc(F)cc(F)c1O)C(C)(C)CN1CCOCC1 ZINC000895017743 637379179 /nfs/dbraw/zinc/37/91/79/637379179.db2.gz XQWWMYKIKRBKLP-UHFFFAOYSA-N 1 2 314.376 2.213 20 10 DECDLO C[N@@H+](Cc1cc(F)cc(F)c1O)C(C)(C)CN1CCOCC1 ZINC000895017743 637379187 /nfs/dbraw/zinc/37/91/87/637379187.db2.gz XQWWMYKIKRBKLP-UHFFFAOYSA-N 1 2 314.376 2.213 20 10 DECDLO CCn1ccc(C[NH2+][C@@H](C)c2cc(C(=O)OC)ccc2O)n1 ZINC000840839995 650365387 /nfs/dbraw/zinc/36/53/87/650365387.db2.gz CPLLUKLHAQORDL-NSHDSACASA-N 1 2 303.362 2.246 20 10 DECDLO CN1CCCc2cc(CNC(=O)CCCn3cc[nH+]c3)ccc21 ZINC000748638691 638581782 /nfs/dbraw/zinc/58/17/82/638581782.db2.gz OHPPGDXTMXCWMV-UHFFFAOYSA-N 1 2 312.417 2.362 20 10 DECDLO C[C@@H](CC(N)=O)[NH2+][C@@H](C)c1cc(Br)cc(F)c1O ZINC000756662160 639683634 /nfs/dbraw/zinc/68/36/34/639683634.db2.gz WSXYSRBDRKVDOA-BQBZGAKWSA-N 1 2 319.174 2.208 20 10 DECDLO Fc1cc(C[N@H+]2C[C@H]3CC[C@@H](C2)O3)ccc1N1CCOCC1 ZINC000769435837 641240237 /nfs/dbraw/zinc/24/02/37/641240237.db2.gz SPOYTPQWIKAJBS-GASCZTMLSA-N 1 2 306.381 2.026 20 10 DECDLO Fc1cc(C[N@@H+]2C[C@H]3CC[C@@H](C2)O3)ccc1N1CCOCC1 ZINC000769435837 641240246 /nfs/dbraw/zinc/24/02/46/641240246.db2.gz SPOYTPQWIKAJBS-GASCZTMLSA-N 1 2 306.381 2.026 20 10 DECDLO CCC[C@H]1C[N@H+](Cc2ccc([N+](=O)[O-])c(OC)c2O)CCO1 ZINC000774906285 641980507 /nfs/dbraw/zinc/98/05/07/641980507.db2.gz WXQOUGGKSSXEGG-LBPRGKRZSA-N 1 2 310.350 2.310 20 10 DECDLO CCC[C@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])c(OC)c2O)CCO1 ZINC000774906285 641980508 /nfs/dbraw/zinc/98/05/08/641980508.db2.gz WXQOUGGKSSXEGG-LBPRGKRZSA-N 1 2 310.350 2.310 20 10 DECDLO COc1c(O)c(C[N@@H+]2CCO[C@H](C(C)C)C2)ccc1[N+](=O)[O-] ZINC000775055407 642000568 /nfs/dbraw/zinc/00/05/68/642000568.db2.gz CYFLGXNIVFGWKE-ZDUSSCGKSA-N 1 2 310.350 2.166 20 10 DECDLO COc1c(O)c(C[N@H+]2CCO[C@H](C(C)C)C2)ccc1[N+](=O)[O-] ZINC000775055407 642000575 /nfs/dbraw/zinc/00/05/75/642000575.db2.gz CYFLGXNIVFGWKE-ZDUSSCGKSA-N 1 2 310.350 2.166 20 10 DECDLO COc1c(O)c(C[NH2+][C@@H](C)c2nnc(C)s2)ccc1[N+](=O)[O-] ZINC000775063209 642001662 /nfs/dbraw/zinc/00/16/62/642001662.db2.gz ODNLDEDAMZNQHI-ZETCQYMHSA-N 1 2 324.362 2.320 20 10 DECDLO OCC[C@H]1CSCC[N@@H+]1Cc1cc(Cl)cc(F)c1O ZINC000775738035 642088081 /nfs/dbraw/zinc/08/80/81/642088081.db2.gz YIWHGBWHRKPHIK-NSHDSACASA-N 1 2 305.802 2.485 20 10 DECDLO OCC[C@H]1CSCC[N@H+]1Cc1cc(Cl)cc(F)c1O ZINC000775738035 642088083 /nfs/dbraw/zinc/08/80/83/642088083.db2.gz YIWHGBWHRKPHIK-NSHDSACASA-N 1 2 305.802 2.485 20 10 DECDLO COCCO[C@@H]1CC[N@H+](Cc2cc(Cl)cc(F)c2O)C1 ZINC000783715162 643040782 /nfs/dbraw/zinc/04/07/82/643040782.db2.gz INKZSINJZSARDF-GFCCVEGCSA-N 1 2 303.761 2.422 20 10 DECDLO COCCO[C@@H]1CC[N@@H+](Cc2cc(Cl)cc(F)c2O)C1 ZINC000783715162 643040787 /nfs/dbraw/zinc/04/07/87/643040787.db2.gz INKZSINJZSARDF-GFCCVEGCSA-N 1 2 303.761 2.422 20 10 DECDLO C[C@@H](NC(=O)CCc1c[nH+]cn1C)c1ccc(N(C)C)cc1 ZINC000793856779 644314188 /nfs/dbraw/zinc/31/41/88/644314188.db2.gz QUXAQERRPJAWAM-CYBMUJFWSA-N 1 2 300.406 2.296 20 10 DECDLO Cc1cc(Br)cc(C[N@@H+]2CC[C@](F)(CO)C2)c1O ZINC000802660096 645541413 /nfs/dbraw/zinc/54/14/13/645541413.db2.gz BECCJBYAPKBDJU-CYBMUJFWSA-N 1 2 318.186 2.369 20 10 DECDLO Cc1cc(Br)cc(C[N@H+]2CC[C@](F)(CO)C2)c1O ZINC000802660096 645541416 /nfs/dbraw/zinc/54/14/16/645541416.db2.gz BECCJBYAPKBDJU-CYBMUJFWSA-N 1 2 318.186 2.369 20 10 DECDLO COc1ccc(O)c(CNC(=O)Nc2ccn3cc[nH+]c3c2)c1 ZINC000810229015 646341735 /nfs/dbraw/zinc/34/17/35/646341735.db2.gz PZPJBRVTECSGEA-UHFFFAOYSA-N 1 2 312.329 2.370 20 10 DECDLO C[C@H](C[S@@](C)=O)[NH2+]Cc1cccc(Br)c1O ZINC000164282412 646433780 /nfs/dbraw/zinc/43/37/80/646433780.db2.gz ZBAHMCYOKNRSJR-BCTVWOGZSA-N 1 2 306.225 2.011 20 10 DECDLO C[C@@H](NC(=O)N1CCn2c[nH+]cc2C1)c1ccc(N(C)C)cc1 ZINC000812199859 646617174 /nfs/dbraw/zinc/61/71/74/646617174.db2.gz IIJZMVOQBIUZGE-CYBMUJFWSA-N 1 2 313.405 2.236 20 10 DECDLO CCN(C)c1ccc(C[N@@H+]2CCO[C@H](C(=O)C3CC3)C2)cc1 ZINC000815094293 646967652 /nfs/dbraw/zinc/96/76/52/646967652.db2.gz IEOIKXLDCOJZMK-KRWDZBQOSA-N 1 2 302.418 2.323 20 10 DECDLO CCN(C)c1ccc(C[N@H+]2CCO[C@H](C(=O)C3CC3)C2)cc1 ZINC000815094293 646967655 /nfs/dbraw/zinc/96/76/55/646967655.db2.gz IEOIKXLDCOJZMK-KRWDZBQOSA-N 1 2 302.418 2.323 20 10 DECDLO CN1CCCc2cc(CNC(=O)[C@H]3CCc4c[nH+]cn4C3)ccc21 ZINC000816911046 647196507 /nfs/dbraw/zinc/19/65/07/647196507.db2.gz ZRIHXZUFAMGFFK-INIZCTEOSA-N 1 2 324.428 2.144 20 10 DECDLO C[C@H]([NH2+]C[C@H]1C[NH2+]CCO1)c1ccc(Cl)c(Cl)c1[O-] ZINC000817984158 647400540 /nfs/dbraw/zinc/40/05/40/647400540.db2.gz VMGVCGPQSBAFRY-DTWKUNHWSA-N 1 2 305.205 2.338 20 10 DECDLO CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@H]1CCC[N@@H+]1C1CC1 ZINC000819756546 647720262 /nfs/dbraw/zinc/72/02/62/647720262.db2.gz XYFSTXFYZDOCBH-CYBMUJFWSA-N 1 2 309.406 2.121 20 10 DECDLO CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@H]1CCC[N@H+]1C1CC1 ZINC000819756546 647720271 /nfs/dbraw/zinc/72/02/71/647720271.db2.gz XYFSTXFYZDOCBH-CYBMUJFWSA-N 1 2 309.406 2.121 20 10 DECDLO CN(C)C(=O)N[C@H]1CCC[N@H+](Cc2cccc(Cl)c2O)C1 ZINC000825280060 648735678 /nfs/dbraw/zinc/73/56/78/648735678.db2.gz WXFFBCFRWRFMRU-LBPRGKRZSA-N 1 2 311.813 2.281 20 10 DECDLO CN(C)C(=O)N[C@H]1CCC[N@@H+](Cc2cccc(Cl)c2O)C1 ZINC000825280060 648735683 /nfs/dbraw/zinc/73/56/83/648735683.db2.gz WXFFBCFRWRFMRU-LBPRGKRZSA-N 1 2 311.813 2.281 20 10 DECDLO CO[C@@H](C[NH2+]Cc1cc(Cl)cc(F)c1O)[C@@H]1CCOC1 ZINC000826821666 648931675 /nfs/dbraw/zinc/93/16/75/648931675.db2.gz AXTOLIMKZSJPSC-RNCFNFMXSA-N 1 2 303.761 2.326 20 10 DECDLO CC[C@H](C(=O)N[C@@H](C)c1ccccc1O)[N@@H+]1CCO[C@H](CC)C1 ZINC000827964529 649112681 /nfs/dbraw/zinc/11/26/81/649112681.db2.gz OLOCEEWFLPSXDB-SQWLQELKSA-N 1 2 320.433 2.459 20 10 DECDLO CC[C@H](C(=O)N[C@@H](C)c1ccccc1O)[N@H+]1CCO[C@H](CC)C1 ZINC000827964529 649112684 /nfs/dbraw/zinc/11/26/84/649112684.db2.gz OLOCEEWFLPSXDB-SQWLQELKSA-N 1 2 320.433 2.459 20 10 DECDLO C[C@@H](O)CNc1cc(NCc2cc(Cl)ccc2O)nc[nH+]1 ZINC000845709561 651272845 /nfs/dbraw/zinc/27/28/45/651272845.db2.gz UWMILYJFFLQSTP-SECBINFHSA-N 1 2 308.769 2.240 20 10 DECDLO C[C@@H](O)CNc1cc(NCc2cc(Cl)ccc2O)[nH+]cn1 ZINC000845709561 651272848 /nfs/dbraw/zinc/27/28/48/651272848.db2.gz UWMILYJFFLQSTP-SECBINFHSA-N 1 2 308.769 2.240 20 10 DECDLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)NCc1c(O)ccc2c1CCCC2 ZINC000847590598 651404332 /nfs/dbraw/zinc/40/43/32/651404332.db2.gz BHNPXFGGSCIABD-GFCCVEGCSA-N 1 2 313.401 2.489 20 10 DECDLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)NCc1c(O)ccc2c1CCCC2 ZINC000847590598 651404333 /nfs/dbraw/zinc/40/43/33/651404333.db2.gz BHNPXFGGSCIABD-GFCCVEGCSA-N 1 2 313.401 2.489 20 10 DECDLO C[C@H]1CN(C(=[NH2+])NCc2cc(Cl)cc(Cl)c2O)CCO1 ZINC000849028664 651588210 /nfs/dbraw/zinc/58/82/10/651588210.db2.gz UGQAUUPZQCLJTD-QMMMGPOBSA-N 1 2 318.204 2.444 20 10 DECDLO C[C@H]([NH2+][C@H]1C[C@H](O)C1)c1cc(Br)c(F)cc1O ZINC000850579488 651956653 /nfs/dbraw/zinc/95/66/53/651956653.db2.gz YIQZTTBLLPVMIO-FXQIFTODSA-N 1 2 304.159 2.468 20 10 DECDLO CON(C)CC[NH2+][C@@H](C)c1cc(Br)cc(F)c1O ZINC000850479248 651936267 /nfs/dbraw/zinc/93/62/67/651936267.db2.gz OJVZDQPSUAMYIU-QMMMGPOBSA-N 1 2 321.190 2.438 20 10 DECDLO COC(=O)C[N@H+](Cc1ccc(N2CCOCC2)c(F)c1)C(C)C ZINC000093287144 684048722 /nfs/dbraw/zinc/04/87/22/684048722.db2.gz HXMKMCUCKNVKTC-UHFFFAOYSA-N 1 2 324.396 2.046 20 10 DECDLO COC(=O)C[N@@H+](Cc1ccc(N2CCOCC2)c(F)c1)C(C)C ZINC000093287144 684048724 /nfs/dbraw/zinc/04/87/24/684048724.db2.gz HXMKMCUCKNVKTC-UHFFFAOYSA-N 1 2 324.396 2.046 20 10 DECDLO C[C@H](CC[S@](C)=O)[NH2+]Cc1cccc(Br)c1O ZINC000125428225 684145760 /nfs/dbraw/zinc/14/57/60/684145760.db2.gz PEONSSTWERNOFO-VVVCHXIZSA-N 1 2 320.252 2.401 20 10 DECDLO CC[C@H]1C[N@H+](Cc2ccc(N3CCOCC3)c(F)c2)CCO1 ZINC000125560231 684146705 /nfs/dbraw/zinc/14/67/05/684146705.db2.gz HJLGMPHWTRNVLI-HNNXBMFYSA-N 1 2 308.397 2.273 20 10 DECDLO CC[C@H]1C[N@@H+](Cc2ccc(N3CCOCC3)c(F)c2)CCO1 ZINC000125560231 684146708 /nfs/dbraw/zinc/14/67/08/684146708.db2.gz HJLGMPHWTRNVLI-HNNXBMFYSA-N 1 2 308.397 2.273 20 10 DECDLO CC[C@H](C(=O)NCc1c(O)cccc1F)[N@@H+]1CCO[C@H](CC)C1 ZINC000928709019 693831294 /nfs/dbraw/zinc/83/12/94/693831294.db2.gz VTJWUJNJQFZWBD-IUODEOHRSA-N 1 2 324.396 2.037 20 10 DECDLO CC[C@H](C(=O)NCc1c(O)cccc1F)[N@H+]1CCO[C@H](CC)C1 ZINC000928709019 693831299 /nfs/dbraw/zinc/83/12/99/693831299.db2.gz VTJWUJNJQFZWBD-IUODEOHRSA-N 1 2 324.396 2.037 20 10 DECDLO Cn1c[nH+]cc1[C@@H]1C[C@H]1C(=O)NCc1ccc2cccnc2c1O ZINC000862026337 686225394 /nfs/dbraw/zinc/22/53/94/686225394.db2.gz KWJVRZOPBLHYCL-ZIAGYGMSSA-N 1 2 322.368 2.094 20 10 DECDLO COC(=O)[C@@H]1C[N@H+](C/C=C/c2ccc(N(C)C)cc2)C[C@@H](C)O1 ZINC000862487261 686309044 /nfs/dbraw/zinc/30/90/44/686309044.db2.gz NDXOMONHQXBWBN-HVMMPBATSA-N 1 2 318.417 2.028 20 10 DECDLO COC(=O)[C@@H]1C[N@@H+](C/C=C/c2ccc(N(C)C)cc2)C[C@@H](C)O1 ZINC000862487261 686309052 /nfs/dbraw/zinc/30/90/52/686309052.db2.gz NDXOMONHQXBWBN-HVMMPBATSA-N 1 2 318.417 2.028 20 10 DECDLO CCN(CC)c1ccc(CNc2nc(C)[nH+]c(N)n2)cc1F ZINC000865529125 687248495 /nfs/dbraw/zinc/24/84/95/687248495.db2.gz YNOAJQCVQXOUQQ-UHFFFAOYSA-N 1 2 304.373 2.360 20 10 DECDLO CCN(CC)c1ccc(CNc2nc(N)nc(C)[nH+]2)cc1F ZINC000865529125 687248499 /nfs/dbraw/zinc/24/84/99/687248499.db2.gz YNOAJQCVQXOUQQ-UHFFFAOYSA-N 1 2 304.373 2.360 20 10 DECDLO Cc1ccc(C[N@@H+]2CCO[C@@H](C(=O)OC(C)(C)C)C2)c(O)c1 ZINC000876755136 689927497 /nfs/dbraw/zinc/92/74/97/689927497.db2.gz KOPWNVAZKVYPEA-OAHLLOKOSA-N 1 2 307.390 2.243 20 10 DECDLO Cc1ccc(C[N@H+]2CCO[C@@H](C(=O)OC(C)(C)C)C2)c(O)c1 ZINC000876755136 689927500 /nfs/dbraw/zinc/92/75/00/689927500.db2.gz KOPWNVAZKVYPEA-OAHLLOKOSA-N 1 2 307.390 2.243 20 10 DECDLO Oc1c(C[N@@H+]2CC[C@@H](Nc3ncccn3)C2)ccc(F)c1F ZINC000877603029 690165024 /nfs/dbraw/zinc/16/50/24/690165024.db2.gz CGGABHUYUKZELT-LLVKDONJSA-N 1 2 306.316 2.147 20 10 DECDLO Oc1c(C[N@H+]2CC[C@@H](Nc3ncccn3)C2)ccc(F)c1F ZINC000877603029 690165027 /nfs/dbraw/zinc/16/50/27/690165027.db2.gz CGGABHUYUKZELT-LLVKDONJSA-N 1 2 306.316 2.147 20 10 DECDLO Fc1c[nH+]ccc1NCc1cc(F)c(N2CCOCC2)c(F)c1 ZINC000882440010 691282388 /nfs/dbraw/zinc/28/23/88/691282388.db2.gz VBXUPQQNQMHYFW-UHFFFAOYSA-N 1 2 323.318 2.370 20 10 DECDLO CCN(CC)C(=O)CCC[NH2+]Cc1cc(F)cc(F)c1O ZINC000882890699 691380098 /nfs/dbraw/zinc/38/00/98/691380098.db2.gz DYJIQUMFRZADJJ-UHFFFAOYSA-N 1 2 300.349 2.409 20 10 DECDLO O=C(CNc1cc2[nH+]c[nH]c2cc1F)c1ccc(O)c(O)c1 ZINC001170320716 786908161 /nfs/dbraw/zinc/90/81/61/786908161.db2.gz KGZXCRJBLMPIQU-UHFFFAOYSA-N 1 2 301.277 2.408 20 10 DECDLO CN1CC[C@H]([NH2+]Cc2cc(Br)cc(F)c2O)C1 ZINC000715759360 792511777 /nfs/dbraw/zinc/51/17/77/792511777.db2.gz MISMYMSPVZFZGM-JTQLQIEISA-N 1 2 303.175 2.088 20 10 DECDLO CC1(C)C[N@H+](Cc2cc(F)c(F)cc2O)C[C@]2(CCOC2)O1 ZINC001181174710 795434530 /nfs/dbraw/zinc/43/45/30/795434530.db2.gz CKOXAZXDPKTCQK-INIZCTEOSA-N 1 2 313.344 2.440 20 10 DECDLO CC1(C)C[N@@H+](Cc2cc(F)c(F)cc2O)C[C@]2(CCOC2)O1 ZINC001181174710 795434532 /nfs/dbraw/zinc/43/45/32/795434532.db2.gz CKOXAZXDPKTCQK-INIZCTEOSA-N 1 2 313.344 2.440 20 10 DECDLO Fc1cc(N2CCOCC2)ccc1C[N@@H+]1CCCCC12COC2 ZINC001140661493 796552615 /nfs/dbraw/zinc/55/26/15/796552615.db2.gz GTSGKPTXFYISSI-UHFFFAOYSA-N 1 2 320.408 2.417 20 10 DECDLO Fc1cc(N2CCOCC2)ccc1C[N@H+]1CCCCC12COC2 ZINC001140661493 796552618 /nfs/dbraw/zinc/55/26/18/796552618.db2.gz GTSGKPTXFYISSI-UHFFFAOYSA-N 1 2 320.408 2.417 20 10 DECDLO CN1CCOc2cc(C[NH+]3CC(N4CCC(F)(F)C4)C3)ccc21 ZINC001141143836 796639003 /nfs/dbraw/zinc/63/90/03/796639003.db2.gz MDEOYFJRDFGOJC-UHFFFAOYSA-N 1 2 323.387 2.040 20 10 DECDLO OC[C@H]1C[N@H+](Cc2cc(F)c(F)cc2O)C[C@@H]1C(F)(F)F ZINC001142508524 796746839 /nfs/dbraw/zinc/74/68/39/796746839.db2.gz BWXGFFGDOMGJJR-BDAKNGLRSA-N 1 2 311.250 2.273 20 10 DECDLO OC[C@H]1C[N@@H+](Cc2cc(F)c(F)cc2O)C[C@@H]1C(F)(F)F ZINC001142508524 796746842 /nfs/dbraw/zinc/74/68/42/796746842.db2.gz BWXGFFGDOMGJJR-BDAKNGLRSA-N 1 2 311.250 2.273 20 10 DECDLO CC(C)(C)[NH+]1CCN(C(=O)c2cc(O)c(O)c(Cl)c2)CC1 ZINC001193602822 797601527 /nfs/dbraw/zinc/60/15/27/797601527.db2.gz GMYQQQBVWJSXLN-UHFFFAOYSA-N 1 2 312.797 2.308 20 10 DECDLO CCOC(=O)[C@@H]1[C@H]2CCC[C@H]2C[N@@H+]1Cc1ccc(O)c(O)c1 ZINC001203878515 798193928 /nfs/dbraw/zinc/19/39/28/798193928.db2.gz AQMCTRSRRWUYMO-XEZPLFJOSA-N 1 2 305.374 2.261 20 10 DECDLO CCOC(=O)[C@@H]1[C@H]2CCC[C@H]2C[N@H+]1Cc1ccc(O)c(O)c1 ZINC001203878515 798193933 /nfs/dbraw/zinc/19/39/33/798193933.db2.gz AQMCTRSRRWUYMO-XEZPLFJOSA-N 1 2 305.374 2.261 20 10 DECDLO Cc1c[nH+]c2n1CCC21CCN(C(=O)Cc2ccc(N)cc2)CC1 ZINC001159382136 798559595 /nfs/dbraw/zinc/55/95/95/798559595.db2.gz PVLBIGBYFBGHKS-UHFFFAOYSA-N 1 2 324.428 2.280 20 10 DECDLO COC(=O)[C@@H]1C[C@H](Nc2ccc(-n3c(C)ccc3C)cc2)C[NH2+]1 ZINC001164305724 799566059 /nfs/dbraw/zinc/56/60/59/799566059.db2.gz ZSIGQXHVUNBEJT-RDJZCZTQSA-N 1 2 313.401 2.410 20 10 DECDLO COc1ccc(O)c(C[NH+]2CC(C)(NC(=O)OC(C)(C)C)C2)c1 ZINC001203678606 800104960 /nfs/dbraw/zinc/10/49/60/800104960.db2.gz NXEVKKJGQSRLDY-UHFFFAOYSA-N 1 2 322.405 2.500 20 10 DECDLO CCOC(=O)CC[N@H+](CC(=O)OCC)Cc1cccc(C)c1O ZINC001231593367 801691526 /nfs/dbraw/zinc/69/15/26/801691526.db2.gz VKUMKWNFGGVIPS-UHFFFAOYSA-N 1 2 323.389 2.019 20 10 DECDLO CCOC(=O)CC[N@@H+](CC(=O)OCC)Cc1cccc(C)c1O ZINC001231593367 801691534 /nfs/dbraw/zinc/69/15/34/801691534.db2.gz VKUMKWNFGGVIPS-UHFFFAOYSA-N 1 2 323.389 2.019 20 10 DECDLO Cc1cc(C)c(C[NH+]2CCN(C(=O)C(F)(F)F)CC2)c(O)c1 ZINC001231841344 801736052 /nfs/dbraw/zinc/73/60/52/801736052.db2.gz AOGLXDLKERKCBV-UHFFFAOYSA-N 1 2 316.323 2.216 20 10 DECDLO COc1cc(O)c(C[N@@H+]2CCN(C(C)=O)C[C@@H]2C)cc1Cl ZINC001232268545 801832614 /nfs/dbraw/zinc/83/26/14/801832614.db2.gz OXOOJPABCBHGHH-JTQLQIEISA-N 1 2 312.797 2.107 20 10 DECDLO COc1cc(O)c(C[N@H+]2CCN(C(C)=O)C[C@@H]2C)cc1Cl ZINC001232268545 801832622 /nfs/dbraw/zinc/83/26/22/801832622.db2.gz OXOOJPABCBHGHH-JTQLQIEISA-N 1 2 312.797 2.107 20 10 DECDLO Oc1cc(C[NH+]2CCN(c3ccc(F)cc3)CC2)cc(O)c1O ZINC001233011074 802003206 /nfs/dbraw/zinc/00/32/06/802003206.db2.gz YQPXNKRULCWUHZ-UHFFFAOYSA-N 1 2 318.348 2.265 20 10 DECDLO COC[C@@H]1Cn2nccc2C[N@H+](Cc2c(O)ccc(F)c2F)C1 ZINC001233334153 802081063 /nfs/dbraw/zinc/08/10/63/802081063.db2.gz WAMZMTNVHFMZTC-NSHDSACASA-N 1 2 323.343 2.145 20 10 DECDLO COC[C@@H]1Cn2nccc2C[N@@H+](Cc2c(O)ccc(F)c2F)C1 ZINC001233334153 802081070 /nfs/dbraw/zinc/08/10/70/802081070.db2.gz WAMZMTNVHFMZTC-NSHDSACASA-N 1 2 323.343 2.145 20 10 DECDLO Oc1cc(O)c(C[NH+]2CCN(Cc3ccccc3)CC2)cc1O ZINC001233484110 802127436 /nfs/dbraw/zinc/12/74/36/802127436.db2.gz YPXRYUFTTXWZAO-UHFFFAOYSA-N 1 2 314.385 2.121 20 10 DECDLO O=S1(=O)CCC[C@@H]1CC[NH2+]Cc1cc(Cl)cc(F)c1O ZINC001334382857 1150289189 /nfs/dbraw/zinc/28/91/89/1150289189.db2.gz BIJBSVJBNNIGDM-LLVKDONJSA-N 1 2 321.801 2.242 20 10 DECDLO CC[C@H]([NH2+]CC[C@@H](C)CCO)c1cccc(-c2nn[nH]n2)c1O ZINC001604053413 1070186839 /nfs/dbraw/zinc/18/68/39/1070186839.db2.gz CBPOHHFDMOHHFA-RISCZKNCSA-N 1 2 319.409 2.022 20 10 DECDLO Cn1cc[nH+]c1CCC(=O)NCc1ccc(N2CCCC2)cc1 ZINC001527444106 1070481317 /nfs/dbraw/zinc/48/13/17/1070481317.db2.gz YTFOQNDVAOJJAT-UHFFFAOYSA-N 1 2 312.417 2.269 20 10 DECDLO COc1c(O)c(C[NH2+][C@H]2C[C@H](C)n3ccnc32)ccc1[N+](=O)[O-] ZINC001462241402 1058787717 /nfs/dbraw/zinc/78/77/17/1058787717.db2.gz WQFSYEOJWQRYRQ-ONGXEEELSA-N 1 2 318.333 2.301 20 10 DECDLO C[C@H]([NH2+]C[C@H]1CCC(C)(C)O1)c1cccc(-c2nn[nH]n2)c1O ZINC001589961169 1076537627 /nfs/dbraw/zinc/53/76/27/1076537627.db2.gz BQLLWDYAQBPRLD-WDEREUQCSA-N 1 2 317.393 2.181 20 10 DECDLO CC[C@H]([NH2+][C@@H](C)c1cccc(-c2nn[nH]n2)c1O)[C@@H](O)C(C)C ZINC001590462102 1076631471 /nfs/dbraw/zinc/63/14/71/1076631471.db2.gz NFCHKRLKXZQAFB-BPNCWPANSA-N 1 2 319.409 2.018 20 10 DECDLO CC[C@H]([NH2+]C[C@H]1CCC=CO1)c1cccc(-c2nn[nH]n2)c1O ZINC001590466720 1076634600 /nfs/dbraw/zinc/63/46/00/1076634600.db2.gz MDUCYDDXIMWTJC-RISCZKNCSA-N 1 2 315.377 2.306 20 10 DECDLO CC[C@H]([NH2+]CCC(C)(C)OC)c1cccc(-c2nn[nH]n2)c1O ZINC001590469027 1076635521 /nfs/dbraw/zinc/63/55/21/1076635521.db2.gz XFWUTADXMOZEGQ-ZDUSSCGKSA-N 1 2 319.409 2.428 20 10 DECDLO CCC[C@H](C[NH2+][C@@H](C)c1cccc(-c2nn[nH]n2)c1O)OCC ZINC001590556990 1076651888 /nfs/dbraw/zinc/65/18/88/1076651888.db2.gz DMKVSQDRYIFZAN-NWDGAFQWSA-N 1 2 319.409 2.428 20 10 DECDLO CCOC[C@@H]([NH2+][C@H](C)c1cccc(-c2nn[nH]n2)c1O)C(C)C ZINC001590800445 1076678972 /nfs/dbraw/zinc/67/89/72/1076678972.db2.gz POGYWMYQTIWTSU-BXUZGUMPSA-N 1 2 319.409 2.284 20 10 DECDLO Cc1cc(N(C)C)ccc1C[N@H+]1CCN(CC(C)C)C(=O)C1 ZINC001659536940 1080242503 /nfs/dbraw/zinc/24/25/03/1080242503.db2.gz ODSWBDCJXWCWMV-UHFFFAOYSA-N 1 2 303.450 2.361 20 10 DECDLO Cc1cc(N(C)C)ccc1C[N@@H+]1CCN(CC(C)C)C(=O)C1 ZINC001659536940 1080242510 /nfs/dbraw/zinc/24/25/10/1080242510.db2.gz ODSWBDCJXWCWMV-UHFFFAOYSA-N 1 2 303.450 2.361 20 10 DECDLO COc1ccc(N2CC3(CC[N@@H+]3Cc3cccc(=O)[nH]3)C2)cc1 ZINC001276927467 1083684265 /nfs/dbraw/zinc/68/42/65/1083684265.db2.gz SAZLBIJMPQAHTQ-UHFFFAOYSA-N 1 2 311.385 2.261 20 10 DECDLO COc1ccc(N2CC3(CC[N@H+]3Cc3cccc(=O)[nH]3)C2)cc1 ZINC001276927467 1083684271 /nfs/dbraw/zinc/68/42/71/1083684271.db2.gz SAZLBIJMPQAHTQ-UHFFFAOYSA-N 1 2 311.385 2.261 20 10 DECDLO CC(C)c1ccc(C[N@@H+]2C[C@]3(F)CN(C)C(=O)[C@]3(F)C2)c(O)c1 ZINC001274779498 1091410323 /nfs/dbraw/zinc/41/03/23/1091410323.db2.gz JGAHTZBNMZLDMR-IAGOWNOFSA-N 1 2 324.371 2.220 20 10 DECDLO CC(C)c1ccc(C[N@H+]2C[C@]3(F)CN(C)C(=O)[C@]3(F)C2)c(O)c1 ZINC001274779498 1091410327 /nfs/dbraw/zinc/41/03/27/1091410327.db2.gz JGAHTZBNMZLDMR-IAGOWNOFSA-N 1 2 324.371 2.220 20 10 DECDLO COc1cc(O)c(C[NH+]2CC(Oc3cccnc3)C2)cc1OC ZINC001236757058 1138411722 /nfs/dbraw/zinc/41/17/22/1138411722.db2.gz WVSJIIRJGHYJMN-UHFFFAOYSA-N 1 2 316.357 2.068 20 10 DECDLO Oc1cc(CN2CCn3c[nH+]cc3C2)c(O)cc1Br ZINC001236772086 1138422363 /nfs/dbraw/zinc/42/23/63/1138422363.db2.gz XUWZFQFUSZPFGT-UHFFFAOYSA-N 1 2 324.178 2.073 20 10 DECDLO Oc1ccc(F)c(Cl)c1C[N@@H+]1CCO[C@]2(CCOC2)C1 ZINC001237123113 1138507985 /nfs/dbraw/zinc/50/79/85/1138507985.db2.gz HGIYUBDPIVKDMS-CQSZACIVSA-N 1 2 301.745 2.176 20 10 DECDLO Oc1ccc(F)c(Cl)c1C[N@H+]1CCO[C@]2(CCOC2)C1 ZINC001237123113 1138507988 /nfs/dbraw/zinc/50/79/88/1138507988.db2.gz HGIYUBDPIVKDMS-CQSZACIVSA-N 1 2 301.745 2.176 20 10 DECDLO Cc1coc(C[N@@H+](C)Cc2ccc(N3CCOCC3)cc2)n1 ZINC001237641929 1138731158 /nfs/dbraw/zinc/73/11/58/1138731158.db2.gz BHAPLTVZVRBLIV-UHFFFAOYSA-N 1 2 301.390 2.452 20 10 DECDLO Cc1coc(C[N@H+](C)Cc2ccc(N3CCOCC3)cc2)n1 ZINC001237641929 1138731166 /nfs/dbraw/zinc/73/11/66/1138731166.db2.gz BHAPLTVZVRBLIV-UHFFFAOYSA-N 1 2 301.390 2.452 20 10 DECDLO CNC(=O)NC1CC[NH+](Cc2cc(F)cc(Cl)c2O)CC1 ZINC001237802713 1138791995 /nfs/dbraw/zinc/79/19/95/1138791995.db2.gz OEFRGIBKIXLYDP-UHFFFAOYSA-N 1 2 315.776 2.078 20 10 DECDLO Oc1cc(Cl)c(F)cc1C[N@@H+]1CCO[C@]2(CCOC2)C1 ZINC001237933419 1138811019 /nfs/dbraw/zinc/81/10/19/1138811019.db2.gz BNDKIPTXDLCPMY-CQSZACIVSA-N 1 2 301.745 2.176 20 10 DECDLO Oc1cc(Cl)c(F)cc1C[N@H+]1CCO[C@]2(CCOC2)C1 ZINC001237933419 1138811020 /nfs/dbraw/zinc/81/10/20/1138811020.db2.gz BNDKIPTXDLCPMY-CQSZACIVSA-N 1 2 301.745 2.176 20 10 DECDLO Cc1cc(C[N@@H+]2CC[C@](F)(CO)C2)c(O)cc1Br ZINC001250120483 1142084870 /nfs/dbraw/zinc/08/48/70/1142084870.db2.gz FTKLGSOHFDSNCE-CYBMUJFWSA-N 1 2 318.186 2.369 20 10 DECDLO Cc1cc(C[N@H+]2CC[C@](F)(CO)C2)c(O)cc1Br ZINC001250120483 1142084878 /nfs/dbraw/zinc/08/48/78/1142084878.db2.gz FTKLGSOHFDSNCE-CYBMUJFWSA-N 1 2 318.186 2.369 20 10 DECDLO Oc1ccc(-c2[nH]c3ccc(N4CCOCC4)cc3[nH+]2)cc1O ZINC001250465078 1142214314 /nfs/dbraw/zinc/21/43/14/1142214314.db2.gz WWADDXKQGCOTIK-UHFFFAOYSA-N 1 2 311.341 2.478 20 10 DECDLO CC[C@H](C(=O)N(C)c1ccc(N)cc1)[N@@H+]1CCO[C@H](CC)C1 ZINC001340725908 1143413437 /nfs/dbraw/zinc/41/34/37/1143413437.db2.gz IIPNQDKSVXGVFS-HZPDHXFCSA-N 1 2 305.422 2.121 20 10 DECDLO CC[C@H](C(=O)N(C)c1ccc(N)cc1)[N@H+]1CCO[C@H](CC)C1 ZINC001340725908 1143413474 /nfs/dbraw/zinc/41/34/74/1143413474.db2.gz IIPNQDKSVXGVFS-HZPDHXFCSA-N 1 2 305.422 2.121 20 10 DECDLO O=C(C[NH2+][C@@H]1CCCN(C2CCCC2)C1)c1ccc(O)c(O)c1 ZINC001256904748 1143874384 /nfs/dbraw/zinc/87/43/84/1143874384.db2.gz MRHNEZLHSZHDDG-CQSZACIVSA-N 1 2 318.417 2.277 20 10 DECDLO O=C(Cc1ccc(-n2cc[nH+]c2)cc1)NCc1cc(O)ccc1O ZINC001303225925 1147322820 /nfs/dbraw/zinc/32/28/20/1147322820.db2.gz SOVBYDGXCICKAK-UHFFFAOYSA-N 1 2 323.352 2.142 20 10 DECDLO COC(=O)C1C[NH+](Cc2ccc(N(C)C)cc2C(F)(F)F)C1 ZINC001308978142 1147492401 /nfs/dbraw/zinc/49/24/01/1147492401.db2.gz VAEKFAMFABCJPY-UHFFFAOYSA-N 1 2 316.323 2.376 20 10 DECDLO CN(C)c1ccc(C[N@@H+]2CCOC[C@H]2[C@@H]2CCCC2=O)cc1F ZINC000375469254 529780259 /nfs/dbraw/zinc/78/02/59/529780259.db2.gz NCKBBQRFJAQBKR-YOEHRIQHSA-N 1 2 320.408 2.462 20 10 DECDLO CN(C)c1ccc(C[N@H+]2CCOC[C@H]2[C@@H]2CCCC2=O)cc1F ZINC000375469254 529780260 /nfs/dbraw/zinc/78/02/60/529780260.db2.gz NCKBBQRFJAQBKR-YOEHRIQHSA-N 1 2 320.408 2.462 20 10 DECDLO C[C@H]([NH2+]CCCN1CCOC1=O)c1ccc(F)c(F)c1O ZINC000187695750 299293807 /nfs/dbraw/zinc/29/38/07/299293807.db2.gz GBPDBGWPOCSVFL-VIFPVBQESA-N 1 2 300.305 2.163 20 10 DECDLO COC(=O)[C@@H]1C[C@H](OC)CC[N@@H+]1Cc1cc(Cl)ccc1O ZINC000370365385 533066897 /nfs/dbraw/zinc/06/68/97/533066897.db2.gz FOXYHWYKEXZLSB-OLZOCXBDSA-N 1 2 313.781 2.198 20 10 DECDLO COC(=O)[C@@H]1C[C@H](OC)CC[N@H+]1Cc1cc(Cl)ccc1O ZINC000370365385 533066900 /nfs/dbraw/zinc/06/69/00/533066900.db2.gz FOXYHWYKEXZLSB-OLZOCXBDSA-N 1 2 313.781 2.198 20 10 DECDLO CCOc1ccc(O)c(C[NH+]2CC(OC(=O)NC(C)C)C2)c1 ZINC000297499783 132019265 /nfs/dbraw/zinc/01/92/65/132019265.db2.gz VYGLJYTWUCAGMV-UHFFFAOYSA-N 1 2 308.378 2.110 20 10 DECDLO COc1c(O)c(C[N@@H+]2C[C@H](C)OC(C)(C)C2)ccc1[N+](=O)[O-] ZINC000278140191 402859269 /nfs/dbraw/zinc/85/92/69/402859269.db2.gz AXCOMRNYFBJMJN-JTQLQIEISA-N 1 2 310.350 2.308 20 10 DECDLO COc1c(O)c(C[N@H+]2C[C@H](C)OC(C)(C)C2)ccc1[N+](=O)[O-] ZINC000278140191 402859270 /nfs/dbraw/zinc/85/92/70/402859270.db2.gz AXCOMRNYFBJMJN-JTQLQIEISA-N 1 2 310.350 2.308 20 10 DECDLO COc1c(O)c(CNc2ccc(N(C)C)[nH+]c2)ccc1[N+](=O)[O-] ZINC000278884623 402881678 /nfs/dbraw/zinc/88/16/78/402881678.db2.gz OPDLRWAMQDHBKM-UHFFFAOYSA-N 1 2 318.333 2.382 20 10 DECDLO OC[C@@H](C[NH2+]Cc1cc(Cl)cc(Cl)c1O)[C@@H]1CCOC1 ZINC000280337513 402989872 /nfs/dbraw/zinc/98/98/72/402989872.db2.gz QZZFCQZHJYWRPK-MWLCHTKSSA-N 1 2 320.216 2.434 20 10 DECDLO CCOCCOC1C[NH+](Cc2cc(Cl)cc(OC)c2O)C1 ZINC000297678673 404588396 /nfs/dbraw/zinc/58/83/96/404588396.db2.gz PAQSAMASRAPLBC-UHFFFAOYSA-N 1 2 315.797 2.292 20 10 DECDLO CC(=O)c1cc(Cl)cc(C[N@H+](C)[C@H]2CCCCNC2=O)c1O ZINC000365883440 404738399 /nfs/dbraw/zinc/73/83/99/404738399.db2.gz RENHNZHCELOCRN-AWEZNQCLSA-N 1 2 324.808 2.349 20 10 DECDLO CCOC[C@@H]1C[N@H+](Cc2cc(Cl)c(F)cc2O)CCO1 ZINC000529667545 405763118 /nfs/dbraw/zinc/76/31/18/405763118.db2.gz YKBYSDPRKTYSMJ-NSHDSACASA-N 1 2 303.761 2.422 20 10 DECDLO CCOC[C@@H]1C[N@@H+](Cc2cc(Cl)c(F)cc2O)CCO1 ZINC000529667545 405763129 /nfs/dbraw/zinc/76/31/29/405763129.db2.gz YKBYSDPRKTYSMJ-NSHDSACASA-N 1 2 303.761 2.422 20 10 DECDLO CCOC[C@H]1C[N@H+](Cc2cc(Cl)c(F)cc2O)CCO1 ZINC000529667544 405763235 /nfs/dbraw/zinc/76/32/35/405763235.db2.gz YKBYSDPRKTYSMJ-LLVKDONJSA-N 1 2 303.761 2.422 20 10 DECDLO CCOC[C@H]1C[N@@H+](Cc2cc(Cl)c(F)cc2O)CCO1 ZINC000529667544 405763243 /nfs/dbraw/zinc/76/32/43/405763243.db2.gz YKBYSDPRKTYSMJ-LLVKDONJSA-N 1 2 303.761 2.422 20 10 DECDLO CCS(=O)(=O)CC[N@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC000265463871 521640238 /nfs/dbraw/zinc/64/02/38/521640238.db2.gz OHBQFTYZCXXCLJ-UHFFFAOYSA-N 1 2 310.463 2.152 20 10 DECDLO CCS(=O)(=O)CC[N@@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC000265463871 521640242 /nfs/dbraw/zinc/64/02/42/521640242.db2.gz OHBQFTYZCXXCLJ-UHFFFAOYSA-N 1 2 310.463 2.152 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@@H+]2CCO[C@H]([C@H]3CCCO3)C2)c1O ZINC000246859612 527209963 /nfs/dbraw/zinc/20/99/63/527209963.db2.gz FOSLZQKSWAXSGY-CVEARBPZSA-N 1 2 323.364 2.114 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@H+]2CCO[C@H]([C@H]3CCCO3)C2)c1O ZINC000246859612 527209976 /nfs/dbraw/zinc/20/99/76/527209976.db2.gz FOSLZQKSWAXSGY-CVEARBPZSA-N 1 2 323.364 2.114 20 10 DECDLO CCN(C)C(=O)[C@@H]([NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1O)C(C)C ZINC000296635357 527765805 /nfs/dbraw/zinc/76/58/05/527765805.db2.gz XSANUDWBDLDZCT-ABAIWWIYSA-N 1 2 323.393 2.454 20 10 DECDLO O=C1[C@@H]([NH2+]Cc2cc(Cl)cc(F)c2O)C[C@H]2CCCCN12 ZINC000835073046 649875377 /nfs/dbraw/zinc/87/53/77/649875377.db2.gz JZNOBTVXGZCVHW-YPMHNXCESA-N 1 2 312.772 2.428 20 10 DECDLO CCOC(=O)[C@H]1CCCC[N@@H+]1Cc1ccc(OC)c(OC)c1O ZINC000891486016 624213672 /nfs/dbraw/zinc/21/36/72/624213672.db2.gz YUNGBFIXJDHHRT-CYBMUJFWSA-N 1 2 323.389 2.327 20 10 DECDLO CCOC(=O)[C@H]1CCCC[N@H+]1Cc1ccc(OC)c(OC)c1O ZINC000891486016 624213674 /nfs/dbraw/zinc/21/36/74/624213674.db2.gz YUNGBFIXJDHHRT-CYBMUJFWSA-N 1 2 323.389 2.327 20 10 DECDLO CCN(CC)c1ccc(CNC(=O)NCc2c[nH+]cn2C)cc1 ZINC000290690422 624511051 /nfs/dbraw/zinc/51/10/51/624511051.db2.gz MJKJXMSDMWMTDC-UHFFFAOYSA-N 1 2 315.421 2.266 20 10 DECDLO OC[C@H]1CCC[N@H+](Cc2cc(Br)cc(F)c2O)C1 ZINC000893863292 636049679 /nfs/dbraw/zinc/04/96/79/636049679.db2.gz DMTPAVKNYZTGHY-VIFPVBQESA-N 1 2 318.186 2.498 20 10 DECDLO OC[C@H]1CCC[N@@H+](Cc2cc(Br)cc(F)c2O)C1 ZINC000893863292 636049681 /nfs/dbraw/zinc/04/96/81/636049681.db2.gz DMTPAVKNYZTGHY-VIFPVBQESA-N 1 2 318.186 2.498 20 10 DECDLO C[C@H]1C[N@H+](Cc2cc(Br)cc(F)c2O)CC[C@H]1O ZINC000894498071 637070663 /nfs/dbraw/zinc/07/06/63/637070663.db2.gz SQHZEXZKZPYROO-QPUJVOFHSA-N 1 2 318.186 2.497 20 10 DECDLO C[C@H]1C[N@@H+](Cc2cc(Br)cc(F)c2O)CC[C@H]1O ZINC000894498071 637070668 /nfs/dbraw/zinc/07/06/68/637070668.db2.gz SQHZEXZKZPYROO-QPUJVOFHSA-N 1 2 318.186 2.497 20 10 DECDLO C[C@@H]1C[N@H+](Cc2cc(Br)cc(F)c2O)CC[C@@H]1O ZINC000894498069 637070803 /nfs/dbraw/zinc/07/08/03/637070803.db2.gz SQHZEXZKZPYROO-PELKAZGASA-N 1 2 318.186 2.497 20 10 DECDLO C[C@@H]1C[N@@H+](Cc2cc(Br)cc(F)c2O)CC[C@@H]1O ZINC000894498069 637070806 /nfs/dbraw/zinc/07/08/06/637070806.db2.gz SQHZEXZKZPYROO-PELKAZGASA-N 1 2 318.186 2.497 20 10 DECDLO Oc1c(F)cc(F)cc1C[N@@H+]1CCO[C@@]2(CCSC2)C1 ZINC000895075752 637502292 /nfs/dbraw/zinc/50/22/92/637502292.db2.gz GRMPUUWUVPCLPR-AWEZNQCLSA-N 1 2 301.358 2.378 20 10 DECDLO Oc1c(F)cc(F)cc1C[N@H+]1CCO[C@@]2(CCSC2)C1 ZINC000895075752 637502300 /nfs/dbraw/zinc/50/23/00/637502300.db2.gz GRMPUUWUVPCLPR-AWEZNQCLSA-N 1 2 301.358 2.378 20 10 DECDLO Cc1cc(C[NH2+]Cc2cc(F)c(N3CCOCC3)c(F)c2)no1 ZINC000839145900 637788881 /nfs/dbraw/zinc/78/88/81/637788881.db2.gz UVJDXGLSVJIGIA-UHFFFAOYSA-N 1 2 323.343 2.388 20 10 DECDLO Cc1cc(O)c(C[N@H+](C)C[C@H]2CCS(=O)(=O)C2)c(Cl)c1 ZINC000840918623 650382221 /nfs/dbraw/zinc/38/22/21/650382221.db2.gz WUDHMHQNCGZBNQ-LLVKDONJSA-N 1 2 317.838 2.221 20 10 DECDLO Cc1cc(O)c(C[N@@H+](C)C[C@H]2CCS(=O)(=O)C2)c(Cl)c1 ZINC000840918623 650382223 /nfs/dbraw/zinc/38/22/23/650382223.db2.gz WUDHMHQNCGZBNQ-LLVKDONJSA-N 1 2 317.838 2.221 20 10 DECDLO OC[C@@]1(C(F)(F)F)CC[N@H+](Cc2cc(F)cc(F)c2O)C1 ZINC000895837038 638226040 /nfs/dbraw/zinc/22/60/40/638226040.db2.gz JUBIVKFRCWYMAW-GFCCVEGCSA-N 1 2 311.250 2.417 20 10 DECDLO OC[C@@]1(C(F)(F)F)CC[N@@H+](Cc2cc(F)cc(F)c2O)C1 ZINC000895837038 638226044 /nfs/dbraw/zinc/22/60/44/638226044.db2.gz JUBIVKFRCWYMAW-GFCCVEGCSA-N 1 2 311.250 2.417 20 10 DECDLO COc1c([O-])c(C[NH2+]CC2([NH3+])CCCCC2)ccc1[N+](=O)[O-] ZINC000841040150 650412081 /nfs/dbraw/zinc/41/20/81/650412081.db2.gz KJWVIBBVZXZFTC-UHFFFAOYSA-N 1 2 309.366 2.060 20 10 DECDLO Nc1ccc(NC(=O)NC2CCN(c3cccc[nH+]3)CC2)cc1 ZINC000841301683 650471202 /nfs/dbraw/zinc/47/12/02/650471202.db2.gz DDQAISAGYDAATE-UHFFFAOYSA-N 1 2 311.389 2.454 20 10 DECDLO COc1cc(C)cc(C[N@@H+](C)Cc2nc([C@@H](C)OC)no2)c1O ZINC000754736866 639467421 /nfs/dbraw/zinc/46/74/21/639467421.db2.gz OMFKBBOMYXOHAQ-LLVKDONJSA-N 1 2 321.377 2.432 20 10 DECDLO COc1cc(C)cc(C[N@H+](C)Cc2nc([C@@H](C)OC)no2)c1O ZINC000754736866 639467423 /nfs/dbraw/zinc/46/74/23/639467423.db2.gz OMFKBBOMYXOHAQ-LLVKDONJSA-N 1 2 321.377 2.432 20 10 DECDLO C[C@H](CN1CCOCC1)[NH2+][C@@H](C)c1cc(F)cc(F)c1O ZINC000756412994 639660111 /nfs/dbraw/zinc/66/01/11/639660111.db2.gz BDDRRRPBXPAOGA-MNOVXSKESA-N 1 2 300.349 2.042 20 10 DECDLO C[C@@H]([NH2+]CCN1CCOC(C)(C)C1)c1cc(F)cc(F)c1O ZINC000756542512 639670952 /nfs/dbraw/zinc/67/09/52/639670952.db2.gz AWOSMRWSGZRAJI-LLVKDONJSA-N 1 2 314.376 2.432 20 10 DECDLO C[C@@H]([NH2+]C[C@@H](O)C1CCOCC1)c1cc(F)cc(F)c1O ZINC000756739098 639690950 /nfs/dbraw/zinc/69/09/50/639690950.db2.gz RRBXMIIYNIQDFZ-YMTOWFKASA-N 1 2 301.333 2.109 20 10 DECDLO CC(=O)c1cn(C2C[NH+](Cc3ccc4ccccc4c3O)C2)nn1 ZINC000897940588 640981204 /nfs/dbraw/zinc/98/12/04/640981204.db2.gz RYJBZBVJPYWTKT-UHFFFAOYSA-N 1 2 322.368 2.396 20 10 DECDLO Cc1ccc(C(=O)OCc2cc[nH+]c(N(C)C)c2)c(O)c1O ZINC000767523518 640988796 /nfs/dbraw/zinc/98/87/96/640988796.db2.gz JSJVYZDSWKAUJS-UHFFFAOYSA-N 1 2 302.330 2.224 20 10 DECDLO COc1c(C)c[nH+]c(CNC(=O)c2ccc(C)c(O)c2O)c1C ZINC000770482967 641374594 /nfs/dbraw/zinc/37/45/94/641374594.db2.gz DZZWRMZSZKNMNT-UHFFFAOYSA-N 1 2 316.357 2.357 20 10 DECDLO COc1c(O)c(C[NH2+]Cc2ncc(C)s2)ccc1[N+](=O)[O-] ZINC000775026990 641996922 /nfs/dbraw/zinc/99/69/22/641996922.db2.gz DBTKGBIUMJSYBW-UHFFFAOYSA-N 1 2 309.347 2.364 20 10 DECDLO CC(C)(C)NC(=O)N1CC[NH+](Cc2cccc(F)c2O)CC1 ZINC000775984332 642119681 /nfs/dbraw/zinc/11/96/81/642119681.db2.gz QZECDCMSIYRZFG-UHFFFAOYSA-N 1 2 309.385 2.157 20 10 DECDLO C[C@@H]([NH2+]Cc1csnn1)c1ccc(N2CCOCC2)cc1 ZINC000776102933 642131135 /nfs/dbraw/zinc/13/11/35/642131135.db2.gz NFZIFBZVDGSDIB-GFCCVEGCSA-N 1 2 304.419 2.226 20 10 DECDLO O=[N+]([O-])c1cc(Cl)cc(C[NH2+][C@@H]2CCn3cc[nH+]c3C2)c1[O-] ZINC000778188662 642349716 /nfs/dbraw/zinc/34/97/16/642349716.db2.gz ZITDXEVOKVEQRV-LLVKDONJSA-N 1 2 322.752 2.255 20 10 DECDLO CN1CCCc2cc(CNC(=O)CNc3cccc[nH+]3)ccc21 ZINC000900432932 642369467 /nfs/dbraw/zinc/36/94/67/642369467.db2.gz JQXHJAWNFJOWTR-UHFFFAOYSA-N 1 2 310.401 2.192 20 10 DECDLO CC1(C)CN(Cc2cc(Cl)cc(F)c2O)CC[N@@H+]1CCO ZINC000783714556 643041703 /nfs/dbraw/zinc/04/17/03/643041703.db2.gz RRDCOGPSPMAHMY-UHFFFAOYSA-N 1 2 316.804 2.073 20 10 DECDLO CC1(C)CN(Cc2cc(Cl)cc(F)c2O)CC[N@H+]1CCO ZINC000783714556 643041707 /nfs/dbraw/zinc/04/17/07/643041707.db2.gz RRDCOGPSPMAHMY-UHFFFAOYSA-N 1 2 316.804 2.073 20 10 DECDLO O=C(c1cccc(O)c1O)N1CC[NH+](Cc2cccs2)CC1 ZINC000790475004 643856775 /nfs/dbraw/zinc/85/67/75/643856775.db2.gz LMPNYZYJIYERJB-UHFFFAOYSA-N 1 2 318.398 2.117 20 10 DECDLO OCCCC[NH+]1CCN(Cc2c(O)ccc(Cl)c2F)CC1 ZINC000792167420 644082090 /nfs/dbraw/zinc/08/20/90/644082090.db2.gz IPFQPAFSEKIAGF-UHFFFAOYSA-N 1 2 316.804 2.075 20 10 DECDLO COc1ccc(O)c(C[NH2+]Cc2ncc(CN(C)C)s2)c1 ZINC000796306864 644715674 /nfs/dbraw/zinc/71/56/74/644715674.db2.gz FSRVZZARCYKQOL-UHFFFAOYSA-N 1 2 307.419 2.209 20 10 DECDLO Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)Cc1c[nH]c[nH+]1 ZINC000910558900 645501388 /nfs/dbraw/zinc/50/13/88/645501388.db2.gz RMXHXQMPPYQUJD-CYBMUJFWSA-N 1 2 300.406 2.074 20 10 DECDLO CC[C@H]([NH2+]C[C@@H]1CN(C)CCN1C)c1cccc(Cl)c1O ZINC000806139577 645803340 /nfs/dbraw/zinc/80/33/40/645803340.db2.gz PVOMSMVSXGRKMF-DOMZBBRYSA-N 1 2 311.857 2.332 20 10 DECDLO COc1cc(C[N@H+]2CC(=O)N[C@@H](C)C2)c(O)c(C(C)(C)C)c1 ZINC000840134274 646071477 /nfs/dbraw/zinc/07/14/77/646071477.db2.gz RKDNAPXEPKZSJQ-NSHDSACASA-N 1 2 306.406 2.019 20 10 DECDLO COc1cc(C[N@@H+]2CC(=O)N[C@@H](C)C2)c(O)c(C(C)(C)C)c1 ZINC000840134274 646071481 /nfs/dbraw/zinc/07/14/81/646071481.db2.gz RKDNAPXEPKZSJQ-NSHDSACASA-N 1 2 306.406 2.019 20 10 DECDLO C[C@H]1C[N@H+](Cc2c3c(ccc2O)oc2c3CCCC2)CC(=O)N1 ZINC000840134517 646072494 /nfs/dbraw/zinc/07/24/94/646072494.db2.gz PJSKJHXDQMVWHH-NSHDSACASA-N 1 2 314.385 2.338 20 10 DECDLO C[C@H]1C[N@@H+](Cc2c3c(ccc2O)oc2c3CCCC2)CC(=O)N1 ZINC000840134517 646072497 /nfs/dbraw/zinc/07/24/97/646072497.db2.gz PJSKJHXDQMVWHH-NSHDSACASA-N 1 2 314.385 2.338 20 10 DECDLO C[C@H](NC(=O)N1CCn2c[nH+]cc2C1)c1ccc(N(C)C)cc1 ZINC000812199860 646617055 /nfs/dbraw/zinc/61/70/55/646617055.db2.gz IIJZMVOQBIUZGE-ZDUSSCGKSA-N 1 2 313.405 2.236 20 10 DECDLO COC(=O)c1ccc([O-])c([C@@H](C)[NH2+][C@H](C[NH3+])C2CCCC2)c1 ZINC000817983098 647399816 /nfs/dbraw/zinc/39/98/16/647399816.db2.gz YAVCWYLYSYCOMX-IAQYHMDHSA-N 1 2 306.406 2.347 20 10 DECDLO CCOC(=O)CC(C)(C)CC(=O)C(=O)C[NH+]1CCC(C)CC1 ZINC000819760497 647720333 /nfs/dbraw/zinc/72/03/33/647720333.db2.gz DWFXGVMXYABCGC-UHFFFAOYSA-N 1 2 311.422 2.226 20 10 DECDLO Cc1noc(C[N@@H+](C)Cc2ccc(Br)cc2O)n1 ZINC000826538554 648870630 /nfs/dbraw/zinc/87/06/30/648870630.db2.gz FYISAOBYQJDQTE-UHFFFAOYSA-N 1 2 312.167 2.478 20 10 DECDLO Cc1noc(C[N@H+](C)Cc2ccc(Br)cc2O)n1 ZINC000826538554 648870636 /nfs/dbraw/zinc/87/06/36/648870636.db2.gz FYISAOBYQJDQTE-UHFFFAOYSA-N 1 2 312.167 2.478 20 10 DECDLO Oc1c(F)cc(Cl)cc1C[N@@H+]1CC[C@H](Cn2ccnn2)C1 ZINC000826844889 648935357 /nfs/dbraw/zinc/93/53/57/648935357.db2.gz BGNYHYQLNWNQPL-JTQLQIEISA-N 1 2 310.760 2.298 20 10 DECDLO Oc1c(F)cc(Cl)cc1C[N@H+]1CC[C@H](Cn2ccnn2)C1 ZINC000826844889 648935361 /nfs/dbraw/zinc/93/53/61/648935361.db2.gz BGNYHYQLNWNQPL-JTQLQIEISA-N 1 2 310.760 2.298 20 10 DECDLO CN(C)c1ccc(/C=C/C[NH+]2CCN([C@@H]3CCOC3)CC2)cc1 ZINC000827126128 648977073 /nfs/dbraw/zinc/97/70/73/648977073.db2.gz WOWKEVQAWRWLAQ-GNAXCBTBSA-N 1 2 315.461 2.172 20 10 DECDLO C[C@H](CC(=O)NCc1ccc(N(C)C)c(F)c1)n1cc[nH+]c1 ZINC000844357044 651117010 /nfs/dbraw/zinc/11/70/10/651117010.db2.gz LIGMMOPIIRWKJN-GFCCVEGCSA-N 1 2 304.369 2.356 20 10 DECDLO COc1c(N)[nH+]cnc1N1CC=C(c2ccc(Cl)nc2)CC1 ZINC000848674185 651487196 /nfs/dbraw/zinc/48/71/96/651487196.db2.gz NYQZFWMDKNTBTA-UHFFFAOYSA-N 1 2 317.780 2.410 20 10 DECDLO COc1c(N)nc[nH+]c1N1CC=C(c2ccc(Cl)nc2)CC1 ZINC000848674185 651487200 /nfs/dbraw/zinc/48/72/00/651487200.db2.gz NYQZFWMDKNTBTA-UHFFFAOYSA-N 1 2 317.780 2.410 20 10 DECDLO Cc1cc(N(C)C)ccc1C[NH2+]Cc1nc([C@@H]2CCCO2)n[nH]1 ZINC000848923627 651562897 /nfs/dbraw/zinc/56/28/97/651562897.db2.gz HMLHIIUMODNGHT-HNNXBMFYSA-N 1 2 315.421 2.320 20 10 DECDLO CON(C)CC[NH2+][C@H](C)c1cc(Br)cc(F)c1O ZINC000850479247 651935865 /nfs/dbraw/zinc/93/58/65/651935865.db2.gz OJVZDQPSUAMYIU-MRVPVSSYSA-N 1 2 321.190 2.438 20 10 DECDLO C[C@@H]([NH2+]C/C=C\CO)c1cc(Br)cc(F)c1O ZINC000850506997 651941859 /nfs/dbraw/zinc/94/18/59/651941859.db2.gz DCWLGQVERWQKRB-YAJNLLPGSA-N 1 2 304.159 2.493 20 10 DECDLO Cc1cc(N(C)C)ccc1CNC(=O)NCCCn1cc[nH+]c1 ZINC000115780460 652236245 /nfs/dbraw/zinc/23/62/45/652236245.db2.gz XSKLKDSRUCDNGS-UHFFFAOYSA-N 1 2 315.421 2.147 20 10 DECDLO Oc1c(Br)cccc1C[NH2+]C[C@@H]1CC[C@H](O)C1 ZINC000188843988 684364925 /nfs/dbraw/zinc/36/49/25/684364925.db2.gz OJDZNAOEQTWFMK-KOLCDFICSA-N 1 2 300.196 2.405 20 10 DECDLO COC(=O)/C=C(/C)C[NH+]1CCN(c2ccc(OC)c(F)c2)CC1 ZINC000929823830 694034633 /nfs/dbraw/zinc/03/46/33/694034633.db2.gz UVVYEUOQFXPXKD-RAXLEYEMSA-N 1 2 322.380 2.076 20 10 DECDLO COc1ccc([C@H]2CN(C(=O)C3=CC(=O)CS3)CC[NH2+]2)cc1 ZINC000870146212 688498058 /nfs/dbraw/zinc/49/80/58/688498058.db2.gz VXGGUHFBWURRRG-CQSZACIVSA-N 1 2 318.398 2.249 20 10 DECDLO CCCOc1ccc(C[NH2+]Cc2nnnn2CC2CC2)cc1C ZINC000873106864 689159233 /nfs/dbraw/zinc/15/92/33/689159233.db2.gz GDNCZBXQFHYUQL-UHFFFAOYSA-N 1 2 315.421 2.470 20 10 DECDLO O=C(NCc1ccc(N2CCCC2)cc1)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000874002029 689339604 /nfs/dbraw/zinc/33/96/04/689339604.db2.gz QTMZBJFNONKXFB-HZPDHXFCSA-N 1 2 310.401 2.430 20 10 DECDLO O=C(NCc1ccc(N2CCCC2)cc1)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000874002029 689339606 /nfs/dbraw/zinc/33/96/06/689339606.db2.gz QTMZBJFNONKXFB-HZPDHXFCSA-N 1 2 310.401 2.430 20 10 DECDLO COCCOC[C@H]1CC[N@H+](Cc2ccc(F)c(F)c2O)C1 ZINC000876774865 689933251 /nfs/dbraw/zinc/93/32/51/689933251.db2.gz JFHJYXAEAUGQJY-NSHDSACASA-N 1 2 301.333 2.155 20 10 DECDLO COCCOC[C@H]1CC[N@@H+](Cc2ccc(F)c(F)c2O)C1 ZINC000876774865 689933253 /nfs/dbraw/zinc/93/32/53/689933253.db2.gz JFHJYXAEAUGQJY-NSHDSACASA-N 1 2 301.333 2.155 20 10 DECDLO CCOC(=O)[C@@H]([NH2+]Cc1ccc(C)cc1O)[C@@H]1CCCOC1 ZINC000877468212 690122254 /nfs/dbraw/zinc/12/22/54/690122254.db2.gz BOEPUBDQLHWSQL-ZBFHGGJFSA-N 1 2 307.390 2.149 20 10 DECDLO CCOC(=O)[C@H]([NH2+]Cc1ccc(C)cc1O)[C@H]1CCCOC1 ZINC000877468210 690122332 /nfs/dbraw/zinc/12/23/32/690122332.db2.gz BOEPUBDQLHWSQL-GOEBONIOSA-N 1 2 307.390 2.149 20 10 DECDLO CONC(=O)C1CC[NH+](Cc2cc(Cl)cc(F)c2O)CC1 ZINC000877786543 690228397 /nfs/dbraw/zinc/22/83/97/690228397.db2.gz NEKXTPLFMCWTQD-UHFFFAOYSA-N 1 2 316.760 2.074 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@H+]2CC[C@H]3[C@H]2CCCN3C)c1O ZINC000880129752 690809545 /nfs/dbraw/zinc/80/95/45/690809545.db2.gz AIEZMPPJDNQSQT-JKSUJKDBSA-N 1 2 306.381 2.402 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@@H+]2CC[C@H]3[C@H]2CCCN3C)c1O ZINC000880129752 690809551 /nfs/dbraw/zinc/80/95/51/690809551.db2.gz AIEZMPPJDNQSQT-JKSUJKDBSA-N 1 2 306.381 2.402 20 10 DECDLO COc1cc(O)c(CN2CC[NH2+]CC(F)(F)C2)cc1Cl ZINC001211348283 777037239 /nfs/dbraw/zinc/03/72/39/777037239.db2.gz WSEUXQYZWBSAFI-UHFFFAOYSA-N 1 2 306.740 2.095 20 10 DECDLO CN(CC[NH+](C)C)Cc1cc(Br)c(F)cc1O ZINC001144298594 790849443 /nfs/dbraw/zinc/84/94/43/790849443.db2.gz HBPXJBIOHRLSES-UHFFFAOYSA-N 1 2 305.191 2.287 20 10 DECDLO COC(=O)C[C@H]1C[N@H+](Cc2ccc(N3CCCC3)cc2)CCO1 ZINC001116442839 794957054 /nfs/dbraw/zinc/95/70/54/794957054.db2.gz SCHSNOBLXHVXOH-KRWDZBQOSA-N 1 2 318.417 2.051 20 10 DECDLO COC(=O)C[C@H]1C[N@@H+](Cc2ccc(N3CCCC3)cc2)CCO1 ZINC001116442839 794957059 /nfs/dbraw/zinc/95/70/59/794957059.db2.gz SCHSNOBLXHVXOH-KRWDZBQOSA-N 1 2 318.417 2.051 20 10 DECDLO COC[C@@H]1Cn2ccnc2C[N@H+](Cc2cccc(F)c2O)C1 ZINC001138125881 796167724 /nfs/dbraw/zinc/16/77/24/796167724.db2.gz YRENWTHIMYCGJE-LBPRGKRZSA-N 1 2 305.353 2.006 20 10 DECDLO COC[C@@H]1Cn2ccnc2C[N@@H+](Cc2cccc(F)c2O)C1 ZINC001138125881 796167726 /nfs/dbraw/zinc/16/77/26/796167726.db2.gz YRENWTHIMYCGJE-LBPRGKRZSA-N 1 2 305.353 2.006 20 10 DECDLO Cn1ncc2c1CC[N@H+](Cc1c(O)cccc1Br)C2 ZINC001140103326 796477503 /nfs/dbraw/zinc/47/75/03/796477503.db2.gz JZJBGRQIDLGCPC-UHFFFAOYSA-N 1 2 322.206 2.447 20 10 DECDLO Cn1ncc2c1CC[N@@H+](Cc1c(O)cccc1Br)C2 ZINC001140103326 796477508 /nfs/dbraw/zinc/47/75/08/796477508.db2.gz JZJBGRQIDLGCPC-UHFFFAOYSA-N 1 2 322.206 2.447 20 10 DECDLO CC1(C)COCC[N@@H+]1Cc1ccc(N2CCOCC2)cc1F ZINC001140661512 796552477 /nfs/dbraw/zinc/55/24/77/796552477.db2.gz HIPVAHUGLHZILV-UHFFFAOYSA-N 1 2 308.397 2.273 20 10 DECDLO CC1(C)COCC[N@H+]1Cc1ccc(N2CCOCC2)cc1F ZINC001140661512 796552479 /nfs/dbraw/zinc/55/24/79/796552479.db2.gz HIPVAHUGLHZILV-UHFFFAOYSA-N 1 2 308.397 2.273 20 10 DECDLO C[C@H]1CC[N@H+](Cc2ccc(N3CCOCC3)cc2F)CCC1=O ZINC001140660252 796552678 /nfs/dbraw/zinc/55/26/78/796552678.db2.gz LUNRTASEXYPVQE-AWEZNQCLSA-N 1 2 320.408 2.463 20 10 DECDLO C[C@H]1CC[N@@H+](Cc2ccc(N3CCOCC3)cc2F)CCC1=O ZINC001140660252 796552680 /nfs/dbraw/zinc/55/26/80/796552680.db2.gz LUNRTASEXYPVQE-AWEZNQCLSA-N 1 2 320.408 2.463 20 10 DECDLO Fc1cc(N2CCOCC2)ccc1C[NH+]1CC(C(F)F)C1 ZINC001140667204 796553583 /nfs/dbraw/zinc/55/35/83/796553583.db2.gz KWZZIQJWJFYZNY-UHFFFAOYSA-N 1 2 300.324 2.359 20 10 DECDLO Cc1c(O)ccc(C[N@@H+]2CCc3nc(Cl)ncc3C2)c1O ZINC001140745962 796566884 /nfs/dbraw/zinc/56/68/84/796566884.db2.gz QTVDOMZNOHKGAH-UHFFFAOYSA-N 1 2 305.765 2.408 20 10 DECDLO Cc1c(O)ccc(C[N@H+]2CCc3nc(Cl)ncc3C2)c1O ZINC001140745962 796566886 /nfs/dbraw/zinc/56/68/86/796566886.db2.gz QTVDOMZNOHKGAH-UHFFFAOYSA-N 1 2 305.765 2.408 20 10 DECDLO CC(=O)[C@@H]1C[N@H+](Cc2cc3c4c(c2)CCCN4CCC3)CCO1 ZINC001141079077 796633174 /nfs/dbraw/zinc/63/31/74/796633174.db2.gz RVKZTIDPIODRFC-SFHVURJKSA-N 1 2 314.429 2.175 20 10 DECDLO CC(=O)[C@@H]1C[N@@H+](Cc2cc3c4c(c2)CCCN4CCC3)CCO1 ZINC001141079077 796633176 /nfs/dbraw/zinc/63/31/76/796633176.db2.gz RVKZTIDPIODRFC-SFHVURJKSA-N 1 2 314.429 2.175 20 10 DECDLO CCn1cc2c(n1)C[N@@H+](Cc1cc(O)ccc1O)C[C@@H]2COC ZINC001141157654 796642225 /nfs/dbraw/zinc/64/22/25/796642225.db2.gz LEXGLMVNUPLROZ-CYBMUJFWSA-N 1 2 317.389 2.060 20 10 DECDLO CCn1cc2c(n1)C[N@H+](Cc1cc(O)ccc1O)C[C@@H]2COC ZINC001141157654 796642229 /nfs/dbraw/zinc/64/22/29/796642229.db2.gz LEXGLMVNUPLROZ-CYBMUJFWSA-N 1 2 317.389 2.060 20 10 DECDLO Oc1cc(F)c(F)cc1C[NH+]1CCN(c2cccnc2)CC1 ZINC001142508588 796746522 /nfs/dbraw/zinc/74/65/22/796746522.db2.gz DKTHAZYFLFVRIU-UHFFFAOYSA-N 1 2 305.328 2.388 20 10 DECDLO CCOc1cccc(C[N@@H+]2CCN(C(C)(C)C)C(=O)C2)c1O ZINC001203613881 800090344 /nfs/dbraw/zinc/09/03/44/800090344.db2.gz HVUDNEGRISLWJS-UHFFFAOYSA-N 1 2 306.406 2.234 20 10 DECDLO CCOc1cccc(C[N@H+]2CCN(C(C)(C)C)C(=O)C2)c1O ZINC001203613881 800090350 /nfs/dbraw/zinc/09/03/50/800090350.db2.gz HVUDNEGRISLWJS-UHFFFAOYSA-N 1 2 306.406 2.234 20 10 DECDLO CCOC(=O)[C@H]1CSCC[N@@H+]1Cc1c(C)cc(C)cc1O ZINC001231848788 801736873 /nfs/dbraw/zinc/73/68/73/801736873.db2.gz MDFIOGFSLXFHBG-CQSZACIVSA-N 1 2 309.431 2.490 20 10 DECDLO CCOC(=O)[C@H]1CSCC[N@H+]1Cc1c(C)cc(C)cc1O ZINC001231848788 801736878 /nfs/dbraw/zinc/73/68/78/801736878.db2.gz MDFIOGFSLXFHBG-CQSZACIVSA-N 1 2 309.431 2.490 20 10 DECDLO CCOC(=O)N1CC[NH+](Cc2ccc(N(C)C)cc2OC)CC1 ZINC001231853873 801737494 /nfs/dbraw/zinc/73/74/94/801737494.db2.gz SVUKKVKOYBGYQJ-UHFFFAOYSA-N 1 2 321.421 2.035 20 10 DECDLO COc1cc(O)c(C[N@H+]2CCO[C@@]3(CCOC3)C2)cc1Cl ZINC001232266674 801833431 /nfs/dbraw/zinc/83/34/31/801833431.db2.gz QYPHELGSSOSQEC-HNNXBMFYSA-N 1 2 313.781 2.046 20 10 DECDLO Oc1cc(C[NH+]2CCN(c3ccccc3)CC2)cc(O)c1O ZINC001233008469 802001122 /nfs/dbraw/zinc/00/11/22/802001122.db2.gz BQSGFULOFKICLR-UHFFFAOYSA-N 1 2 300.358 2.126 20 10 DECDLO NC(=O)[C@H]1CCCC[N@H+]1Cc1cccc(C(F)(F)F)c1O ZINC001233418003 802111653 /nfs/dbraw/zinc/11/16/53/802111653.db2.gz PTKVZCXASWXYGT-LLVKDONJSA-N 1 2 302.296 2.251 20 10 DECDLO C[C@@H]([NH2+][C@@H](C)c1cccc(-c2nn[nH]n2)c1O)c1ccns1 ZINC001603650561 1070019730 /nfs/dbraw/zinc/01/97/30/1070019730.db2.gz LBJSYMJSIRJRMX-DTWKUNHWSA-N 1 2 316.390 2.441 20 10 DECDLO COC(C)(C)[C@@H](C)[NH2+][C@@H](C)c1cccc(-c2nn[nH]n2)c1O ZINC001604995479 1070558786 /nfs/dbraw/zinc/55/87/86/1070558786.db2.gz IXYAHMKSIKZDPQ-VHSXEESVSA-N 1 2 305.382 2.036 20 10 DECDLO C[C@@H]([NH2+]Cc1cc(Cl)cc(F)c1O)[C@@H](C)N1CCOCC1 ZINC001461178286 1058601765 /nfs/dbraw/zinc/60/17/65/1058601765.db2.gz UGSORSSSTUGAJU-GHMZBOCLSA-N 1 2 316.804 2.384 20 10 DECDLO O=C(Cc1c[nH]c[nH+]1)Nc1c(-c2ccccn2)nc2ccccn21 ZINC001641972307 1078736641 /nfs/dbraw/zinc/73/66/41/1078736641.db2.gz RGVBOXSROFYWSJ-UHFFFAOYSA-N 1 2 318.340 2.301 20 10 DECDLO Cc1ccc(NC(=O)Cc2ccc(O)c(O)c2)c(N(C)C)[nH+]1 ZINC001566728874 1075327845 /nfs/dbraw/zinc/32/78/45/1075327845.db2.gz NGOHIHVHOBGVCR-UHFFFAOYSA-N 1 2 301.346 2.048 20 10 DECDLO C[C@H]([NH2+][C@@H](C)c1cccc(-c2nn[nH]n2)c1O)c1cscn1 ZINC001589952297 1076533716 /nfs/dbraw/zinc/53/37/16/1076533716.db2.gz MUJIMMGBWBFBPJ-IUCAKERBSA-N 1 2 316.390 2.441 20 10 DECDLO CCSCCC[NH2+][C@@H](C)c1cccc(-c2nn[nH]n2)c1O ZINC001590853645 1076685352 /nfs/dbraw/zinc/68/53/52/1076685352.db2.gz UZCIIGIXXKBBJU-JTQLQIEISA-N 1 2 307.423 2.366 20 10 DECDLO O=C(Cc1ccc(O)c(O)c1)Nc1cccc(-n2cc[nH+]c2)c1 ZINC001596252420 1077075539 /nfs/dbraw/zinc/07/55/39/1077075539.db2.gz MTALZNOLCKRGAX-UHFFFAOYSA-N 1 2 309.325 2.465 20 10 DECDLO Oc1c(F)cccc1C[N@H+]1C[C@@H]2[C@H](C1)OCCN2C1CCCC1 ZINC001276537940 1083485382 /nfs/dbraw/zinc/48/53/82/1083485382.db2.gz QZZIPVOJRSTISV-SJORKVTESA-N 1 2 320.408 2.359 20 10 DECDLO Oc1c(F)cccc1C[N@@H+]1C[C@@H]2[C@H](C1)OCCN2C1CCCC1 ZINC001276537940 1083485386 /nfs/dbraw/zinc/48/53/86/1083485386.db2.gz QZZIPVOJRSTISV-SJORKVTESA-N 1 2 320.408 2.359 20 10 DECDLO Oc1c(F)cccc1CN1C[C@@H]2[C@H](C1)OCC[N@@H+]2C1CCCC1 ZINC001276537940 1083485390 /nfs/dbraw/zinc/48/53/90/1083485390.db2.gz QZZIPVOJRSTISV-SJORKVTESA-N 1 2 320.408 2.359 20 10 DECDLO Oc1c(F)cccc1CN1C[C@@H]2[C@H](C1)OCC[N@H+]2C1CCCC1 ZINC001276537940 1083485393 /nfs/dbraw/zinc/48/53/93/1083485393.db2.gz QZZIPVOJRSTISV-SJORKVTESA-N 1 2 320.408 2.359 20 10 DECDLO OC[C@@H]1CCC[N@@H+]1Cc1cc(F)cc(Br)c1O ZINC001235293155 1084375046 /nfs/dbraw/zinc/37/50/46/1084375046.db2.gz FUHDFYRFMTZWQO-JTQLQIEISA-N 1 2 304.159 2.251 20 10 DECDLO OC[C@@H]1CCC[N@H+]1Cc1cc(F)cc(Br)c1O ZINC001235293155 1084375060 /nfs/dbraw/zinc/37/50/60/1084375060.db2.gz FUHDFYRFMTZWQO-JTQLQIEISA-N 1 2 304.159 2.251 20 10 DECDLO Oc1cccc(Cl)c1C[NH+]1CC2(CN(Cc3cn[nH]c3)C2)C1 ZINC001275217567 1091620457 /nfs/dbraw/zinc/62/04/57/1091620457.db2.gz UCRFOSMCWOWBGX-UHFFFAOYSA-N 1 2 318.808 2.087 20 10 DECDLO COc1cc(O)c(CN2CCc3c([nH+]cn3C)C2)c(Cl)c1 ZINC001236807268 1138435300 /nfs/dbraw/zinc/43/53/00/1138435300.db2.gz DVXDMTDILFSXTK-UHFFFAOYSA-N 1 2 307.781 2.346 20 10 DECDLO CC[C@H]([NH3+])C[N@H+](C)Cc1cc(Br)cc(F)c1[O-] ZINC001236883923 1138446933 /nfs/dbraw/zinc/44/69/33/1138446933.db2.gz IFAVTQHCSICVQA-JTQLQIEISA-N 1 2 305.191 2.463 20 10 DECDLO CC[C@H]([NH3+])C[N@@H+](C)Cc1cc(Br)cc(F)c1[O-] ZINC001236883923 1138446935 /nfs/dbraw/zinc/44/69/35/1138446935.db2.gz IFAVTQHCSICVQA-JTQLQIEISA-N 1 2 305.191 2.463 20 10 DECDLO O=C1CC[NH+](Cc2ccc(OCC(F)(F)F)cc2O)CC1 ZINC001237052894 1138491671 /nfs/dbraw/zinc/49/16/71/1138491671.db2.gz DQEVPXOOENIJLR-UHFFFAOYSA-N 1 2 303.280 2.498 20 10 DECDLO C[C@@H]([NH2+][C@H]1CCN(c2cnn(C)c2)C1)c1cc(F)cc(F)c1O ZINC001325339248 1147894333 /nfs/dbraw/zinc/89/43/33/1147894333.db2.gz HRMFDIHEHRJEEN-PWSUYJOCSA-N 1 2 322.359 2.333 20 10 DECDLO CCC[N@@H+]1CCCC[C@@H]1C(=O)OCC(=O)c1ccc(O)c(O)c1 ZINC001326587127 1148153379 /nfs/dbraw/zinc/15/33/79/1148153379.db2.gz JKVBZZFFRVWHGD-CYBMUJFWSA-N 1 2 321.373 2.088 20 10 DECDLO CCC[N@H+]1CCCC[C@@H]1C(=O)OCC(=O)c1ccc(O)c(O)c1 ZINC001326587127 1148153385 /nfs/dbraw/zinc/15/33/85/1148153385.db2.gz JKVBZZFFRVWHGD-CYBMUJFWSA-N 1 2 321.373 2.088 20 10 DECDLO CN1CCCc2cc(CNC(=O)[C@@H]3CCc4[nH+]ccn4C3)ccc21 ZINC000376942085 530065865 /nfs/dbraw/zinc/06/58/65/530065865.db2.gz XVRXXWVZRQTABK-MRXNPFEDSA-N 1 2 324.428 2.144 20 10 DECDLO O=C1CC[C@@H]([NH2+]Cc2cc(Cl)c(F)cc2O)C2(CCC2)N1 ZINC000294731083 224198858 /nfs/dbraw/zinc/19/88/58/224198858.db2.gz PZPCXWROFNFYMP-CYBMUJFWSA-N 1 2 312.772 2.476 20 10 DECDLO Oc1c(Cl)cccc1C[NH+]1CCN(c2ncc(F)cn2)CC1 ZINC000273610877 130144334 /nfs/dbraw/zinc/14/43/34/130144334.db2.gz ADVTZGFKMHJASC-UHFFFAOYSA-N 1 2 322.771 2.297 20 10 DECDLO Cc1noc([C@@H]2CCC[N@@H+]2Cc2cc3c(cc2O)OCO3)n1 ZINC000285076516 131136151 /nfs/dbraw/zinc/13/61/51/131136151.db2.gz JLSPKKYOTRMHGN-NSHDSACASA-N 1 2 303.318 2.149 20 10 DECDLO Cc1noc([C@@H]2CCC[N@H+]2Cc2cc3c(cc2O)OCO3)n1 ZINC000285076516 131136153 /nfs/dbraw/zinc/13/61/53/131136153.db2.gz JLSPKKYOTRMHGN-NSHDSACASA-N 1 2 303.318 2.149 20 10 DECDLO COC(=O)[C@H]([NH2+]Cc1cc(Cl)cc(C(C)=O)c1O)C1CC1 ZINC000285169725 131144224 /nfs/dbraw/zinc/14/42/24/131144224.db2.gz VBAJAPRSKUYEST-CYBMUJFWSA-N 1 2 311.765 2.289 20 10 DECDLO O=C(NCC[NH2+]Cc1cc(Cl)cc(Cl)c1O)C1CC1 ZINC000134225212 401900530 /nfs/dbraw/zinc/90/05/30/401900530.db2.gz BSJFRDVEKILKGW-UHFFFAOYSA-N 1 2 303.189 2.315 20 10 DECDLO CC(=O)c1cc(Cl)cc(C[N@@H+](CC(N)=O)CC(C)C)c1O ZINC000050146235 402026175 /nfs/dbraw/zinc/02/61/75/402026175.db2.gz NOFAKPWDMIZPGU-UHFFFAOYSA-N 1 2 312.797 2.192 20 10 DECDLO CC(=O)c1cc(Cl)cc(C[N@H+](CC(N)=O)CC(C)C)c1O ZINC000050146235 402026176 /nfs/dbraw/zinc/02/61/76/402026176.db2.gz NOFAKPWDMIZPGU-UHFFFAOYSA-N 1 2 312.797 2.192 20 10 DECDLO CCC[C@H]1C(=O)NCC[N@H+]1Cc1cc(Cl)cc(OC)c1O ZINC000184700449 402293214 /nfs/dbraw/zinc/29/32/14/402293214.db2.gz XXTVSYAQPURVHM-LBPRGKRZSA-N 1 2 312.797 2.155 20 10 DECDLO CCC[C@H]1C(=O)NCC[N@@H+]1Cc1cc(Cl)cc(OC)c1O ZINC000184700449 402293216 /nfs/dbraw/zinc/29/32/16/402293216.db2.gz XXTVSYAQPURVHM-LBPRGKRZSA-N 1 2 312.797 2.155 20 10 DECDLO COCCCN(C)CC[NH2+][C@H](C)c1ccc(F)c(F)c1O ZINC000187735281 402510184 /nfs/dbraw/zinc/51/01/84/402510184.db2.gz ODTNZCCMJVSJJX-LLVKDONJSA-N 1 2 302.365 2.289 20 10 DECDLO COc1cc(Cl)cc(C[N@@H+]2CCO[C@@]3(CCOC3)C2)c1O ZINC000187533602 402503587 /nfs/dbraw/zinc/50/35/87/402503587.db2.gz LCAOMXIIBPRZNG-HNNXBMFYSA-N 1 2 313.781 2.046 20 10 DECDLO COc1cc(Cl)cc(C[N@H+]2CCO[C@@]3(CCOC3)C2)c1O ZINC000187533602 402503590 /nfs/dbraw/zinc/50/35/90/402503590.db2.gz LCAOMXIIBPRZNG-HNNXBMFYSA-N 1 2 313.781 2.046 20 10 DECDLO C[C@@H]([NH2+]CCN1CCOC(C)(C)C1)c1ccc(F)c(F)c1O ZINC000187701700 402508467 /nfs/dbraw/zinc/50/84/67/402508467.db2.gz XHPRXMGMPVUQPZ-LLVKDONJSA-N 1 2 314.376 2.432 20 10 DECDLO C[C@@H]1CCN(C(=O)c2cccc(O)c2O)C[C@@H]1n1cc[nH+]c1 ZINC000193133443 402766535 /nfs/dbraw/zinc/76/65/35/402766535.db2.gz KTFGTUYHCNTHGR-YPMHNXCESA-N 1 2 301.346 2.018 20 10 DECDLO C[C@@H]1CCNC(=O)[C@@H]1[NH2+]Cc1cc(Cl)cc(Cl)c1O ZINC000193700542 402775959 /nfs/dbraw/zinc/77/59/59/402775959.db2.gz VJGXZDILKXXHMT-RDDDGLTNSA-N 1 2 303.189 2.313 20 10 DECDLO COc1c(O)c(C[N@H+](C)Cc2cscn2)ccc1[N+](=O)[O-] ZINC000278143928 402859654 /nfs/dbraw/zinc/85/96/54/402859654.db2.gz BMOYNAOGDHLYQY-UHFFFAOYSA-N 1 2 309.347 2.398 20 10 DECDLO COc1c(O)c(C[N@@H+](C)Cc2cscn2)ccc1[N+](=O)[O-] ZINC000278143928 402859656 /nfs/dbraw/zinc/85/96/56/402859656.db2.gz BMOYNAOGDHLYQY-UHFFFAOYSA-N 1 2 309.347 2.398 20 10 DECDLO CC[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1O)[C@@H](O)C(F)(F)F ZINC000270776433 280190571 /nfs/dbraw/zinc/19/05/71/280190571.db2.gz BQSSDUCNYRLWKF-MWLCHTKSSA-N 1 2 308.256 2.092 20 10 DECDLO CCN(CC)c1ccc(C[N@@H+]2CCN3C(=O)OC[C@H]3C2)cc1F ZINC000378344995 528299171 /nfs/dbraw/zinc/29/91/71/528299171.db2.gz FXWUAZRFBBPVAL-CQSZACIVSA-N 1 2 321.396 2.308 20 10 DECDLO CCN(CC)c1ccc(C[N@H+]2CCN3C(=O)OC[C@H]3C2)cc1F ZINC000378344995 528299174 /nfs/dbraw/zinc/29/91/74/528299174.db2.gz FXWUAZRFBBPVAL-CQSZACIVSA-N 1 2 321.396 2.308 20 10 DECDLO CCN(C(=O)C=Cc1c[nH]c[nH+]1)c1ccc(OC)c(OC)c1 ZINC000492869860 535657528 /nfs/dbraw/zinc/65/75/28/535657528.db2.gz ZOQMLSCTWUIOFY-YVMONPNESA-N 1 2 301.346 2.493 20 10 DECDLO CCN(C)c1ccc([C@H](C)[NH2+][C@H](C(N)=O)c2ccccn2)cc1 ZINC000297348335 535765574 /nfs/dbraw/zinc/76/55/74/535765574.db2.gz OZTLROFZBALJKI-GUYCJALGSA-N 1 2 312.417 2.415 20 10 DECDLO CCN(C)c1ccc([C@H](C)[NH2+][C@@H](C(N)=O)c2ccccn2)cc1 ZINC000297348338 535765644 /nfs/dbraw/zinc/76/56/44/535765644.db2.gz OZTLROFZBALJKI-SUMWQHHRSA-N 1 2 312.417 2.415 20 10 DECDLO OC[C@@H](C[C@H]1CCCO1)[NH2+]Cc1cc(Cl)cc(F)c1O ZINC000895746094 638175209 /nfs/dbraw/zinc/17/52/09/638175209.db2.gz BNEGWNZKEAMFLK-VXGBXAGGSA-N 1 2 303.761 2.204 20 10 DECDLO CN(C)c1ccc(CNC(=O)C[N@H+](C)Cc2ccoc2)cc1 ZINC000745983458 638302456 /nfs/dbraw/zinc/30/24/56/638302456.db2.gz PNAJQIGKYPJWFR-UHFFFAOYSA-N 1 2 301.390 2.094 20 10 DECDLO CN(C)c1ccc(CNC(=O)C[N@@H+](C)Cc2ccoc2)cc1 ZINC000745983458 638302459 /nfs/dbraw/zinc/30/24/59/638302459.db2.gz PNAJQIGKYPJWFR-UHFFFAOYSA-N 1 2 301.390 2.094 20 10 DECDLO Cc1nc2n(n1)C[C@H]([NH2+][C@H](C)c1cc(F)cc(F)c1O)CC2 ZINC000756535025 639670314 /nfs/dbraw/zinc/67/03/14/639670314.db2.gz MWENNVISQDVRSP-LDYMZIIASA-N 1 2 308.332 2.236 20 10 DECDLO C[C@@H]([NH2+]CCCN1CCOC1=O)c1cc(F)cc(F)c1O ZINC000756539969 639670332 /nfs/dbraw/zinc/67/03/32/639670332.db2.gz YNOFEPHXWBGAIT-SECBINFHSA-N 1 2 300.305 2.163 20 10 DECDLO Cc1nc(N(C)C)nc(NCCCSc2nccs2)[nH+]1 ZINC000764395060 640632033 /nfs/dbraw/zinc/63/20/33/640632033.db2.gz NPAXFBGFSZPZRW-UHFFFAOYSA-N 1 2 310.452 2.297 20 10 DECDLO CN(C)c1ccc(C[N@@H+]2CCO[C@@H](c3ccnn3C)C2)cc1F ZINC000897558654 640795638 /nfs/dbraw/zinc/79/56/38/640795638.db2.gz LFZRWLRCSNTPSJ-QGZVFWFLSA-N 1 2 318.396 2.199 20 10 DECDLO CN(C)c1ccc(C[N@H+]2CCO[C@@H](c3ccnn3C)C2)cc1F ZINC000897558654 640795640 /nfs/dbraw/zinc/79/56/40/640795640.db2.gz LFZRWLRCSNTPSJ-QGZVFWFLSA-N 1 2 318.396 2.199 20 10 DECDLO Cc1cc(O)c(C[NH+]2CCN(C)CCN(C)CC2)c(Cl)c1 ZINC000897858876 640954440 /nfs/dbraw/zinc/95/44/40/640954440.db2.gz NSZOQILUNGNRAC-UHFFFAOYSA-N 1 2 311.857 2.033 20 10 DECDLO CCNS(=O)(=O)CC[NH2+][C@H](CC)c1cccc(Cl)c1O ZINC000806145964 641198433 /nfs/dbraw/zinc/19/84/33/641198433.db2.gz PPZMPJGDPXTSAI-GFCCVEGCSA-N 1 2 320.842 2.026 20 10 DECDLO COc1cccc(O)c1C[N@H+](C)CC(=O)NCc1ccccc1 ZINC000769466067 641244465 /nfs/dbraw/zinc/24/44/65/641244465.db2.gz HJNMECUPWIHFMS-UHFFFAOYSA-N 1 2 314.385 2.149 20 10 DECDLO COc1cccc(O)c1C[N@@H+](C)CC(=O)NCc1ccccc1 ZINC000769466067 641244471 /nfs/dbraw/zinc/24/44/71/641244471.db2.gz HJNMECUPWIHFMS-UHFFFAOYSA-N 1 2 314.385 2.149 20 10 DECDLO CCC[N@H+](CC(=O)OC)Cc1ccc(N2CCOCC2)c(F)c1 ZINC000771935356 641574101 /nfs/dbraw/zinc/57/41/01/641574101.db2.gz NTNXFWSIONRRNE-UHFFFAOYSA-N 1 2 324.396 2.047 20 10 DECDLO CCC[N@@H+](CC(=O)OC)Cc1ccc(N2CCOCC2)c(F)c1 ZINC000771935356 641574105 /nfs/dbraw/zinc/57/41/05/641574105.db2.gz NTNXFWSIONRRNE-UHFFFAOYSA-N 1 2 324.396 2.047 20 10 DECDLO COc1c(O)c(C[N@@H+]2C[C@H](C)O[C@H](C)[C@@H]2C)ccc1[N+](=O)[O-] ZINC000775097980 642006568 /nfs/dbraw/zinc/00/65/68/642006568.db2.gz MZYHPYDOKTVONP-GARJFASQSA-N 1 2 310.350 2.307 20 10 DECDLO COc1c(O)c(C[N@H+]2C[C@H](C)O[C@H](C)[C@@H]2C)ccc1[N+](=O)[O-] ZINC000775097980 642006572 /nfs/dbraw/zinc/00/65/72/642006572.db2.gz MZYHPYDOKTVONP-GARJFASQSA-N 1 2 310.350 2.307 20 10 DECDLO OC1CCN(c2ccc(CNc3cc[nH+]cc3F)cc2F)CC1 ZINC000775483797 642050875 /nfs/dbraw/zinc/05/08/75/642050875.db2.gz BKFIFBZYGXVFLQ-UHFFFAOYSA-N 1 2 319.355 2.355 20 10 DECDLO CNC(=O)[C@H]1CCC[N@H+](Cc2cc(Cl)cc(F)c2O)C1 ZINC000775698330 642081455 /nfs/dbraw/zinc/08/14/55/642081455.db2.gz OYBQMZKKIWHPCN-VIFPVBQESA-N 1 2 300.761 2.143 20 10 DECDLO CNC(=O)[C@H]1CCC[N@@H+](Cc2cc(Cl)cc(F)c2O)C1 ZINC000775698330 642081457 /nfs/dbraw/zinc/08/14/57/642081457.db2.gz OYBQMZKKIWHPCN-VIFPVBQESA-N 1 2 300.761 2.143 20 10 DECDLO CCN(CC)c1ccc(CNC(=O)Cc2c[nH]c[nH+]2)cc1F ZINC000900635025 642429959 /nfs/dbraw/zinc/42/99/59/642429959.db2.gz DHZDRWNXBDUGKY-UHFFFAOYSA-N 1 2 304.369 2.254 20 10 DECDLO CCOC(=O)[C@@H]([NH2+]Cc1cccc(C)c1O)C1CCOCC1 ZINC000789579281 643750366 /nfs/dbraw/zinc/75/03/66/643750366.db2.gz FYRUFQVIPGZOCZ-HNNXBMFYSA-N 1 2 307.390 2.149 20 10 DECDLO O=C1CCCN1[C@H]1CC[N@@H+](Cc2cc(Cl)cc(F)c2O)C1 ZINC000792185335 644086114 /nfs/dbraw/zinc/08/61/14/644086114.db2.gz JVMVMVYLVHEIHW-LBPRGKRZSA-N 1 2 312.772 2.381 20 10 DECDLO O=C1CCCN1[C@H]1CC[N@H+](Cc2cc(Cl)cc(F)c2O)C1 ZINC000792185335 644086119 /nfs/dbraw/zinc/08/61/19/644086119.db2.gz JVMVMVYLVHEIHW-LBPRGKRZSA-N 1 2 312.772 2.381 20 10 DECDLO CC(C)(C)[C@H](O)C[C@@H](CO)[NH2+]Cc1cc(Cl)cc(F)c1O ZINC000793608508 644278910 /nfs/dbraw/zinc/27/89/10/644278910.db2.gz JRRFKWVXEKTKTG-WCQYABFASA-N 1 2 319.804 2.432 20 10 DECDLO COc1ccc(CNc2cc(N3CCCC3)nc[nH+]2)c(O)c1 ZINC000795286081 644546009 /nfs/dbraw/zinc/54/60/09/644546009.db2.gz ZDHBJUDGTIYEHW-UHFFFAOYSA-N 1 2 300.362 2.403 20 10 DECDLO COc1ccc(CNc2cc(N3CCCC3)[nH+]cn2)c(O)c1 ZINC000795286081 644546020 /nfs/dbraw/zinc/54/60/20/644546020.db2.gz ZDHBJUDGTIYEHW-UHFFFAOYSA-N 1 2 300.362 2.403 20 10 DECDLO COC(=O)[C@H](CC(C)C)[NH+]1CCN(c2ccc(OC)cc2)CC1 ZINC000795855595 644647418 /nfs/dbraw/zinc/64/74/18/644647418.db2.gz NFGYYIWHDWMTAZ-KRWDZBQOSA-N 1 2 320.433 2.405 20 10 DECDLO COc1ccc(CNC(=O)Nc2ccc3[nH+]ccn3c2)c(O)c1 ZINC000797628704 644902569 /nfs/dbraw/zinc/90/25/69/644902569.db2.gz SQHZRIRLVUFFPI-UHFFFAOYSA-N 1 2 312.329 2.370 20 10 DECDLO Cc1cc(NC(=O)N[C@H](C)Cc2ccc(O)c(O)c2)c(C)c[nH+]1 ZINC000797639064 644903621 /nfs/dbraw/zinc/90/36/21/644903621.db2.gz FQZFJABMCOCWEA-GFCCVEGCSA-N 1 2 315.373 2.284 20 10 DECDLO Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)CCc1[nH]cc[nH+]1 ZINC000839922415 645311463 /nfs/dbraw/zinc/31/14/63/645311463.db2.gz UEUCOWBBQICFJJ-CQSZACIVSA-N 1 2 314.433 2.464 20 10 DECDLO NC(=O)c1c[nH+]ccc1NCc1cc(Cl)cc(Cl)c1O ZINC000808089832 646029771 /nfs/dbraw/zinc/02/97/71/646029771.db2.gz LBMQWYYTRUJHRN-UHFFFAOYSA-N 1 2 312.156 2.227 20 10 DECDLO COc1ccc2ccc(O)c(C[N@H+](C)Cc3nncn3C)c2c1 ZINC000808214579 646057848 /nfs/dbraw/zinc/05/78/48/646057848.db2.gz MPLXBIPCDQINJW-UHFFFAOYSA-N 1 2 312.373 2.315 20 10 DECDLO COc1ccc2ccc(O)c(C[N@@H+](C)Cc3nncn3C)c2c1 ZINC000808214579 646057853 /nfs/dbraw/zinc/05/78/53/646057853.db2.gz MPLXBIPCDQINJW-UHFFFAOYSA-N 1 2 312.373 2.315 20 10 DECDLO CC[N@H+](Cc1cc(Cl)c(F)cc1O)[C@@H]1CCS(=O)(=O)C1 ZINC000816481210 647139890 /nfs/dbraw/zinc/13/98/90/647139890.db2.gz MOUIJSODDJFXBG-SNVBAGLBSA-N 1 2 321.801 2.194 20 10 DECDLO CC[N@@H+](Cc1cc(Cl)c(F)cc1O)[C@@H]1CCS(=O)(=O)C1 ZINC000816481210 647139892 /nfs/dbraw/zinc/13/98/92/647139892.db2.gz MOUIJSODDJFXBG-SNVBAGLBSA-N 1 2 321.801 2.194 20 10 DECDLO C[N@@H+](Cc1cc(Cl)c(F)cc1O)C[C@@H]1CCS(=O)(=O)C1 ZINC000816514263 647145561 /nfs/dbraw/zinc/14/55/61/647145561.db2.gz RJAVGQMYWGYVLU-VIFPVBQESA-N 1 2 321.801 2.051 20 10 DECDLO C[N@H+](Cc1cc(Cl)c(F)cc1O)C[C@@H]1CCS(=O)(=O)C1 ZINC000816514263 647145563 /nfs/dbraw/zinc/14/55/63/647145563.db2.gz RJAVGQMYWGYVLU-VIFPVBQESA-N 1 2 321.801 2.051 20 10 DECDLO COCC[NH2+]CCN[C@@H](C)c1ccc(Br)cc1O ZINC000817964442 647394545 /nfs/dbraw/zinc/39/45/45/647394545.db2.gz CWCWROYYIUJWOS-JTQLQIEISA-N 1 2 317.227 2.041 20 10 DECDLO O=C(NCc1c(O)ccc2c1CCCC2)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000821070984 647984126 /nfs/dbraw/zinc/98/41/26/647984126.db2.gz RSJTYLRVRMZCIG-ZIAGYGMSSA-N 1 2 311.385 2.414 20 10 DECDLO O=C(NCc1c(O)ccc2c1CCCC2)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000821070984 647984131 /nfs/dbraw/zinc/98/41/31/647984131.db2.gz RSJTYLRVRMZCIG-ZIAGYGMSSA-N 1 2 311.385 2.414 20 10 DECDLO C[C@H]1CC[C@H]([NH2+]Cc2cc(Cl)cc(F)c2O)CS1(=O)=O ZINC000827169978 648985758 /nfs/dbraw/zinc/98/57/58/648985758.db2.gz GZNUZIJDHUQHPM-KWQFWETISA-N 1 2 321.801 2.240 20 10 DECDLO CCS(=O)(=O)C1(C[NH2+]Cc2cc(Cl)cc(F)c2O)CC1 ZINC000827579299 649053047 /nfs/dbraw/zinc/05/30/47/649053047.db2.gz ARKBPZYTDVUGPZ-UHFFFAOYSA-N 1 2 321.801 2.242 20 10 DECDLO COCc1cc[nH+]c(NCc2ccc([N+](=O)[O-])c(OC)c2O)c1 ZINC000846117359 651309000 /nfs/dbraw/zinc/30/90/00/651309000.db2.gz NUIHELRTGBLZKG-UHFFFAOYSA-N 1 2 319.317 2.463 20 10 DECDLO Cc1cc(N(C)C)ccc1CNC(=O)[C@H](C)Cc1c[nH]c[nH+]1 ZINC000847500717 651399018 /nfs/dbraw/zinc/39/90/18/651399018.db2.gz NUOSRGKYNBHYJK-CYBMUJFWSA-N 1 2 300.406 2.279 20 10 DECDLO Cc1cc(N(C)C)ccc1CNC(=O)[C@H](C)Cc1c[nH+]c[nH]1 ZINC000847500717 651399019 /nfs/dbraw/zinc/39/90/19/651399019.db2.gz NUOSRGKYNBHYJK-CYBMUJFWSA-N 1 2 300.406 2.279 20 10 DECDLO CCc1cccc(CNc2ccc(N(C)CCO)c[nH+]2)c1O ZINC000848899602 651551366 /nfs/dbraw/zinc/55/13/66/651551366.db2.gz QMQYGUQEFVZOFI-UHFFFAOYSA-N 1 2 301.390 2.390 20 10 DECDLO Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)Cc1[nH]cc[nH+]1 ZINC000854949879 651596953 /nfs/dbraw/zinc/59/69/53/651596953.db2.gz YWBDWFMZCKFDLU-ZDUSSCGKSA-N 1 2 300.406 2.074 20 10 DECDLO CCN1OC[C@H]([N@H+](C)Cc2ccc(N3CCCCC3)cc2)C1=O ZINC000851716481 652213320 /nfs/dbraw/zinc/21/33/20/652213320.db2.gz NFNAPYBJHWKOJR-KRWDZBQOSA-N 1 2 317.433 2.271 20 10 DECDLO CCN1OC[C@H]([N@@H+](C)Cc2ccc(N3CCCCC3)cc2)C1=O ZINC000851716481 652213321 /nfs/dbraw/zinc/21/33/21/652213321.db2.gz NFNAPYBJHWKOJR-KRWDZBQOSA-N 1 2 317.433 2.271 20 10 DECDLO Cc1nnc([C@@H](C)[NH2+]Cc2cccc(Br)c2O)[nH]1 ZINC000392447999 685449011 /nfs/dbraw/zinc/44/90/11/685449011.db2.gz FGGLDYNYWNLXMH-SSDOTTSWSA-N 1 2 311.183 2.432 20 10 DECDLO CCOC(=O)C[N@H+](C)Cc1cc(Br)ccc1O ZINC000128530801 684171819 /nfs/dbraw/zinc/17/18/19/684171819.db2.gz JFUHXYHNWPIMFY-UHFFFAOYSA-N 1 2 302.168 2.150 20 10 DECDLO CCOC(=O)C[N@@H+](C)Cc1cc(Br)ccc1O ZINC000128530801 684171820 /nfs/dbraw/zinc/17/18/20/684171820.db2.gz JFUHXYHNWPIMFY-UHFFFAOYSA-N 1 2 302.168 2.150 20 10 DECDLO CCC[C@H]1C(=O)NCC[N@H+]1Cc1cc(C(C)(C)C)cc(O)c1O ZINC000128705904 684173222 /nfs/dbraw/zinc/17/32/22/684173222.db2.gz BGQDTZTWSZSGTC-AWEZNQCLSA-N 1 2 320.433 2.496 20 10 DECDLO CCC[C@H]1C(=O)NCC[N@@H+]1Cc1cc(C(C)(C)C)cc(O)c1O ZINC000128705904 684173224 /nfs/dbraw/zinc/17/32/24/684173224.db2.gz BGQDTZTWSZSGTC-AWEZNQCLSA-N 1 2 320.433 2.496 20 10 DECDLO COc1ccc(N2CC[NH+](Cc3cccnc3OC)CC2)cc1 ZINC000193293889 685037061 /nfs/dbraw/zinc/03/70/61/685037061.db2.gz DSXQWLSWZBCKFK-UHFFFAOYSA-N 1 2 313.401 2.421 20 10 DECDLO O=C(NCc1ccc2cccnc2c1O)[C@@H]1CCc2c[nH+]cn2C1 ZINC000862026751 686225264 /nfs/dbraw/zinc/22/52/64/686225264.db2.gz ZEHYTXZGZHPTJB-CQSZACIVSA-N 1 2 322.368 2.016 20 10 DECDLO C[C@@H](C[S@@](C)=O)[N@H+](C)Cc1cc(F)c(N(C)C)cc1F ZINC000862324339 686276113 /nfs/dbraw/zinc/27/61/13/686276113.db2.gz JYQPFYGNXQOKED-WVDJIFEKSA-N 1 2 304.406 2.230 20 10 DECDLO C[C@@H](C[S@@](C)=O)[N@@H+](C)Cc1cc(F)c(N(C)C)cc1F ZINC000862324339 686276120 /nfs/dbraw/zinc/27/61/20/686276120.db2.gz JYQPFYGNXQOKED-WVDJIFEKSA-N 1 2 304.406 2.230 20 10 DECDLO COCCOC[C@@H]1CC[N@H+](Cc2ccc(F)c(F)c2O)C1 ZINC000876774864 689933319 /nfs/dbraw/zinc/93/33/19/689933319.db2.gz JFHJYXAEAUGQJY-LLVKDONJSA-N 1 2 301.333 2.155 20 10 DECDLO COCCOC[C@@H]1CC[N@@H+](Cc2ccc(F)c(F)c2O)C1 ZINC000876774864 689933322 /nfs/dbraw/zinc/93/33/22/689933322.db2.gz JFHJYXAEAUGQJY-LLVKDONJSA-N 1 2 301.333 2.155 20 10 DECDLO CCCn1cc(C[N@H+](C)CCN(C)c2ccc(OC)cc2)nn1 ZINC000877609792 690166703 /nfs/dbraw/zinc/16/67/03/690166703.db2.gz IVZOXYJIPPHRNV-UHFFFAOYSA-N 1 2 317.437 2.265 20 10 DECDLO CCCn1cc(C[N@@H+](C)CCN(C)c2ccc(OC)cc2)nn1 ZINC000877609792 690166706 /nfs/dbraw/zinc/16/67/06/690166706.db2.gz IVZOXYJIPPHRNV-UHFFFAOYSA-N 1 2 317.437 2.265 20 10 DECDLO Cc1nc(NCCc2cc(O)c(O)cc2O)c2c([nH+]1)CCCC2 ZINC001168007070 779277501 /nfs/dbraw/zinc/27/75/01/779277501.db2.gz ZLQZELJOKNRSKW-UHFFFAOYSA-N 1 2 315.373 2.435 20 10 DECDLO CCOC[C@@H]1C[N@H+](Cc2cccc(F)c2O)Cc2ncn(C)c21 ZINC001138125502 796168236 /nfs/dbraw/zinc/16/82/36/796168236.db2.gz QRAMUJUGLFPKPD-ZDUSSCGKSA-N 1 2 319.380 2.401 20 10 DECDLO CCOC[C@@H]1C[N@@H+](Cc2cccc(F)c2O)Cc2ncn(C)c21 ZINC001138125502 796168239 /nfs/dbraw/zinc/16/82/39/796168239.db2.gz QRAMUJUGLFPKPD-ZDUSSCGKSA-N 1 2 319.380 2.401 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CC[C@@H](O)[C@H](C)C1 ZINC001139127361 796327729 /nfs/dbraw/zinc/32/77/29/796327729.db2.gz UGFVGNPYFUQELW-BXUZGUMPSA-N 1 2 303.358 2.010 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CC[C@@H](O)[C@H](C)C1 ZINC001139127361 796327732 /nfs/dbraw/zinc/32/77/32/796327732.db2.gz UGFVGNPYFUQELW-BXUZGUMPSA-N 1 2 303.358 2.010 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CC[C@@H]2OCC[C@@H]2C1 ZINC001139130748 796330942 /nfs/dbraw/zinc/33/09/42/796330942.db2.gz IZCOBNWLPYPMCL-WBMJQRKESA-N 1 2 315.369 2.418 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CC[C@@H]2OCC[C@@H]2C1 ZINC001139130748 796330947 /nfs/dbraw/zinc/33/09/47/796330947.db2.gz IZCOBNWLPYPMCL-WBMJQRKESA-N 1 2 315.369 2.418 20 10 DECDLO COc1cccc(C[N@@H+]2C[C@@H]3C[C@H]2[C@H](C(F)(F)F)O3)c1O ZINC001203596869 800086228 /nfs/dbraw/zinc/08/62/28/800086228.db2.gz QGUVLXBOPGDFKO-OUJBWJOFSA-N 1 2 303.280 2.305 20 10 DECDLO COc1cccc(C[N@H+]2C[C@@H]3C[C@H]2[C@H](C(F)(F)F)O3)c1O ZINC001203596869 800086239 /nfs/dbraw/zinc/08/62/39/800086239.db2.gz QGUVLXBOPGDFKO-OUJBWJOFSA-N 1 2 303.280 2.305 20 10 DECDLO OC[C@H]1C[C@@H](F)C[N@H+](Cc2cc(Br)ccc2O)C1 ZINC001203635642 800096688 /nfs/dbraw/zinc/09/66/88/800096688.db2.gz BVUDITBFRVHXJO-JOYOIKCWSA-N 1 2 318.186 2.307 20 10 DECDLO OC[C@H]1C[C@@H](F)C[N@@H+](Cc2cc(Br)ccc2O)C1 ZINC001203635642 800096694 /nfs/dbraw/zinc/09/66/94/800096694.db2.gz BVUDITBFRVHXJO-JOYOIKCWSA-N 1 2 318.186 2.307 20 10 DECDLO Cn1ncc(Br)c1C[N@@H+]1CCc2cccc(O)c2C1 ZINC001209710878 801260951 /nfs/dbraw/zinc/26/09/51/801260951.db2.gz CNZIUYLBGSACFW-UHFFFAOYSA-N 1 2 322.206 2.447 20 10 DECDLO Cn1ncc(Br)c1C[N@H+]1CCc2cccc(O)c2C1 ZINC001209710878 801260955 /nfs/dbraw/zinc/26/09/55/801260955.db2.gz CNZIUYLBGSACFW-UHFFFAOYSA-N 1 2 322.206 2.447 20 10 DECDLO CC(C)[N@H+](Cc1ccc(C(=O)[O-])cc1O)C1CC[NH+](C)CC1 ZINC001231452818 801669311 /nfs/dbraw/zinc/66/93/11/801669311.db2.gz GJACRWQMCGTVGZ-UHFFFAOYSA-N 1 2 306.406 2.395 20 10 DECDLO CC(C)[N@@H+](Cc1ccc(C(=O)[O-])cc1O)C1CC[NH+](C)CC1 ZINC001231452818 801669316 /nfs/dbraw/zinc/66/93/16/801669316.db2.gz GJACRWQMCGTVGZ-UHFFFAOYSA-N 1 2 306.406 2.395 20 10 DECDLO CC[N@H+]1CCO[C@@H]2CN(Cc3cccc(Cl)c3O)C[C@@H]2C1 ZINC001231911432 801748459 /nfs/dbraw/zinc/74/84/59/801748459.db2.gz LMZCADIHTJFUTI-DZGCQCFKSA-N 1 2 310.825 2.198 20 10 DECDLO CN(C)c1ccc(C[N@@H+]2C[C@@H]3C[C@H]2[C@H](C(F)(F)F)O3)c(O)c1 ZINC001232838946 801969085 /nfs/dbraw/zinc/96/90/85/801969085.db2.gz DYXUGYZRHMOYPL-SGMGOOAPSA-N 1 2 316.323 2.362 20 10 DECDLO CN(C)c1ccc(C[N@H+]2C[C@@H]3C[C@H]2[C@H](C(F)(F)F)O3)c(O)c1 ZINC001232838946 801969090 /nfs/dbraw/zinc/96/90/90/801969090.db2.gz DYXUGYZRHMOYPL-SGMGOOAPSA-N 1 2 316.323 2.362 20 10 DECDLO Oc1c(C[N@@H+]2CC[C@H](Oc3ncccn3)C2)ccc(F)c1F ZINC001233079644 802022918 /nfs/dbraw/zinc/02/29/18/802022918.db2.gz IOPIURJILKUHTO-NSHDSACASA-N 1 2 307.300 2.114 20 10 DECDLO CN1CC[N@H+](Cc2cc(O)c(O)cc2O)[C@@H](c2ccccc2)C1 ZINC001233482193 802126291 /nfs/dbraw/zinc/12/62/91/802126291.db2.gz DNAOMCDJASPZEL-OAHLLOKOSA-N 1 2 314.385 2.292 20 10 DECDLO CN1CC[N@@H+](Cc2cc(O)c(O)cc2O)[C@@H](c2ccccc2)C1 ZINC001233482193 802126295 /nfs/dbraw/zinc/12/62/95/802126295.db2.gz DNAOMCDJASPZEL-OAHLLOKOSA-N 1 2 314.385 2.292 20 10 DECDLO COC(=O)[C@@H]1CC[N@@H+]1Cc1c(O)ccc2ccc(OC)cc21 ZINC001234525153 802401538 /nfs/dbraw/zinc/40/15/38/802401538.db2.gz BSYPFPBSUXRVMZ-HNNXBMFYSA-N 1 2 301.342 2.301 20 10 DECDLO COC(=O)[C@@H]1CC[N@H+]1Cc1c(O)ccc2ccc(OC)cc21 ZINC001234525153 802401548 /nfs/dbraw/zinc/40/15/48/802401548.db2.gz BSYPFPBSUXRVMZ-HNNXBMFYSA-N 1 2 301.342 2.301 20 10 DECDLO CC[C@H](C[C@@H](C)O)[NH2+][C@@H](CC)c1cccc(-c2nn[nH]n2)c1O ZINC001604014492 1070175760 /nfs/dbraw/zinc/17/57/60/1070175760.db2.gz ABAGMXUMMGIBCT-GYSYKLTISA-N 1 2 319.409 2.163 20 10 DECDLO O=C(Cc1ccc(-n2cc[nH+]c2)cc1)NCc1cccc(O)c1O ZINC001644710666 1078857931 /nfs/dbraw/zinc/85/79/31/1078857931.db2.gz IQWVCZJUTGHHNQ-UHFFFAOYSA-N 1 2 323.352 2.142 20 10 DECDLO C[C@@H]1CC[N@H+](Cc2cc(F)cc(Br)c2O)C[C@@H]1O ZINC001235298694 1084375833 /nfs/dbraw/zinc/37/58/33/1084375833.db2.gz SXFFWHSBAVDZOE-PELKAZGASA-N 1 2 318.186 2.497 20 10 DECDLO C[C@@H]1CC[N@@H+](Cc2cc(F)cc(Br)c2O)C[C@@H]1O ZINC001235298694 1084375845 /nfs/dbraw/zinc/37/58/45/1084375845.db2.gz SXFFWHSBAVDZOE-PELKAZGASA-N 1 2 318.186 2.497 20 10 DECDLO CCCCN1C[C@@]2(F)C[N@H+](Cc3ccccc3O)C[C@@]2(F)C1=O ZINC001272618235 1079014947 /nfs/dbraw/zinc/01/49/47/1079014947.db2.gz DAXVXBDVKFFGCU-DLBZAZTESA-N 1 2 324.371 2.267 20 10 DECDLO CCCCN1C[C@@]2(F)C[N@@H+](Cc3ccccc3O)C[C@@]2(F)C1=O ZINC001272618235 1079014949 /nfs/dbraw/zinc/01/49/49/1079014949.db2.gz DAXVXBDVKFFGCU-DLBZAZTESA-N 1 2 324.371 2.267 20 10 DECDLO C[C@@H]([NH2+][C@@H]1C[C@@H](C)O[C@@H](C)C1)c1cccc(-c2nn[nH]n2)c1O ZINC001590203873 1076582854 /nfs/dbraw/zinc/58/28/54/1076582854.db2.gz XEEXSDBEPCTWQQ-WRWGMCAJSA-N 1 2 317.393 2.179 20 10 DECDLO C[C@@H](C[NH2+]Cc1cc(Cl)cc(F)c1O)CN1CCOCC1 ZINC001655696390 1080013157 /nfs/dbraw/zinc/01/31/57/1080013157.db2.gz MQMOKBXUQHVBCP-NSHDSACASA-N 1 2 316.804 2.243 20 10 DECDLO C[N@H+](CC(=O)NCc1ccccc1)Cc1cc(F)cc(F)c1O ZINC001659488151 1080240906 /nfs/dbraw/zinc/24/09/06/1080240906.db2.gz JRJXKHDBPISHDW-UHFFFAOYSA-N 1 2 320.339 2.419 20 10 DECDLO C[N@@H+](CC(=O)NCc1ccccc1)Cc1cc(F)cc(F)c1O ZINC001659488151 1080240920 /nfs/dbraw/zinc/24/09/20/1080240920.db2.gz JRJXKHDBPISHDW-UHFFFAOYSA-N 1 2 320.339 2.419 20 10 DECDLO C[C@H]1[C@@H](O)CC[N@@H+]1Cc1cc(Br)cc(F)c1O ZINC001659800003 1080252007 /nfs/dbraw/zinc/25/20/07/1080252007.db2.gz KYTCYGRFVNKLNS-CPCISQLKSA-N 1 2 304.159 2.249 20 10 DECDLO C[C@H]1[C@@H](O)CC[N@H+]1Cc1cc(Br)cc(F)c1O ZINC001659800003 1080252013 /nfs/dbraw/zinc/25/20/13/1080252013.db2.gz KYTCYGRFVNKLNS-CPCISQLKSA-N 1 2 304.159 2.249 20 10 DECDLO C[C@@]1(O)COCC[N@H+](Cc2cc(Cl)c(Cl)cc2O)C1 ZINC001236792609 1138430150 /nfs/dbraw/zinc/43/01/50/1138430150.db2.gz FUHQOUCYVZLLGN-ZDUSSCGKSA-N 1 2 306.189 2.282 20 10 DECDLO C[C@@]1(O)COCC[N@@H+](Cc2cc(Cl)c(Cl)cc2O)C1 ZINC001236792609 1138430153 /nfs/dbraw/zinc/43/01/53/1138430153.db2.gz FUHQOUCYVZLLGN-ZDUSSCGKSA-N 1 2 306.189 2.282 20 10 DECDLO CCOC(=O)C1C[NH+](Cc2c(O)cccc2OC(F)(F)F)C1 ZINC001237121897 1138507925 /nfs/dbraw/zinc/50/79/25/1138507925.db2.gz BYWJZYQIHDUXAX-UHFFFAOYSA-N 1 2 319.279 2.286 20 10 DECDLO O=C1CC2(CN1)CC[NH+](Cc1cc(F)cc(Cl)c1O)CC2 ZINC001237804788 1138794802 /nfs/dbraw/zinc/79/48/02/1138794802.db2.gz GMFVYHPTGPFNKO-UHFFFAOYSA-N 1 2 312.772 2.287 20 10 DECDLO Oc1c(Cl)cc(F)cc1C[NH+]1CCC2(C[C@H](O)CO2)CC1 ZINC001237807454 1138797476 /nfs/dbraw/zinc/79/74/76/1138797476.db2.gz JAMZQTKKAYAJKX-LBPRGKRZSA-N 1 2 315.772 2.301 20 10 DECDLO C[C@H]([NH2+]CCN1CCOC[C@H]1C)c1cc(F)cc(F)c1O ZINC001320249386 1140840986 /nfs/dbraw/zinc/84/09/86/1140840986.db2.gz YXPVYBDAALZWOA-MNOVXSKESA-N 1 2 300.349 2.042 20 10 DECDLO C[C@H]1CN(C)C(=O)C[N@@H+]1Cc1ccc2c(c1O)C=CC(C)(C)O2 ZINC001249258127 1141865394 /nfs/dbraw/zinc/86/53/94/1141865394.db2.gz CZLZGBWZIPKFAE-LBPRGKRZSA-N 1 2 316.401 2.239 20 10 DECDLO C[C@H]1CN(C)C(=O)C[N@H+]1Cc1ccc2c(c1O)C=CC(C)(C)O2 ZINC001249258127 1141865395 /nfs/dbraw/zinc/86/53/95/1141865395.db2.gz CZLZGBWZIPKFAE-LBPRGKRZSA-N 1 2 316.401 2.239 20 10 DECDLO C[C@@H]1CCN(C(=O)NCc2ccc(N)cc2)C[C@@H]1n1cc[nH+]c1 ZINC001262603727 1144322851 /nfs/dbraw/zinc/32/28/51/1144322851.db2.gz SVYQJVRIVDYYAW-CJNGLKHVSA-N 1 2 313.405 2.258 20 10 DECDLO CN(C)c1ccc(C[N@@H+]2CC(=O)N[C@@H]3CCCC[C@@H]32)cc1F ZINC000123591317 282289185 /nfs/dbraw/zinc/28/91/85/282289185.db2.gz GDZKPQCQFAJLCY-ZBFHGGJFSA-N 1 2 305.397 2.135 20 10 DECDLO CN(C)c1ccc(C[N@H+]2CC(=O)N[C@@H]3CCCC[C@@H]32)cc1F ZINC000123591317 282289187 /nfs/dbraw/zinc/28/91/87/282289187.db2.gz GDZKPQCQFAJLCY-ZBFHGGJFSA-N 1 2 305.397 2.135 20 10 DECDLO CCn1cc(C[NH+]2CCN(c3ccc(OC)c(F)c3)CC2)cn1 ZINC000091923144 193126931 /nfs/dbraw/zinc/12/69/31/193126931.db2.gz DXIYRODMJBUCIB-UHFFFAOYSA-N 1 2 318.396 2.373 20 10 DECDLO CCOC(=O)CCCC[N@H+](C)c1ccc(OCC(=O)OC)cc1 ZINC000273044413 130085672 /nfs/dbraw/zinc/08/56/72/130085672.db2.gz FJFGJNWXQGOJKG-UHFFFAOYSA-N 1 2 323.389 2.408 20 10 DECDLO CCOC(=O)CCCC[N@@H+](C)c1ccc(OCC(=O)OC)cc1 ZINC000273044413 130085675 /nfs/dbraw/zinc/08/56/75/130085675.db2.gz FJFGJNWXQGOJKG-UHFFFAOYSA-N 1 2 323.389 2.408 20 10 DECDLO CCCN(Cc1ccccc1O)C(=O)NCCn1cc[nH+]c1 ZINC000066686965 402140155 /nfs/dbraw/zinc/14/01/55/402140155.db2.gz CHEXZKIIECMTSR-UHFFFAOYSA-N 1 2 302.378 2.211 20 10 DECDLO COc1c(O)c(CN[C@@H]2CC[N@@H+]3CCCC[C@@H]23)ccc1[N+](=O)[O-] ZINC000278948907 402889461 /nfs/dbraw/zinc/88/94/61/402889461.db2.gz YZLBMJUNQBVQPO-OLZOCXBDSA-N 1 2 321.377 2.025 20 10 DECDLO COc1c(O)c(CN[C@@H]2CC[N@H+]3CCCC[C@@H]23)ccc1[N+](=O)[O-] ZINC000278948907 402889464 /nfs/dbraw/zinc/88/94/64/402889464.db2.gz YZLBMJUNQBVQPO-OLZOCXBDSA-N 1 2 321.377 2.025 20 10 DECDLO COc1c(O)c(C[NH2+][C@@H]2CCN3CCCC[C@@H]23)ccc1[N+](=O)[O-] ZINC000278948907 402889466 /nfs/dbraw/zinc/88/94/66/402889466.db2.gz YZLBMJUNQBVQPO-OLZOCXBDSA-N 1 2 321.377 2.025 20 10 DECDLO COC(=O)[C@@H](C)[N@H+](C)Cc1cc(Br)ccc1O ZINC000280203011 402974607 /nfs/dbraw/zinc/97/46/07/402974607.db2.gz BOBRYSBUEMUEPX-MRVPVSSYSA-N 1 2 302.168 2.148 20 10 DECDLO COC(=O)[C@@H](C)[N@@H+](C)Cc1cc(Br)ccc1O ZINC000280203011 402974610 /nfs/dbraw/zinc/97/46/10/402974610.db2.gz BOBRYSBUEMUEPX-MRVPVSSYSA-N 1 2 302.168 2.148 20 10 DECDLO CCOC(=O)[C@@H](F)C1C[NH+](Cc2cccc(Cl)c2O)C1 ZINC000294076413 403641766 /nfs/dbraw/zinc/64/17/66/403641766.db2.gz YSVWDCVRNWAVAC-LBPRGKRZSA-N 1 2 301.745 2.379 20 10 DECDLO CNC(=O)[C@@H]1CCCC[N@@H+]1Cc1cc(Cl)c(F)cc1O ZINC000295229516 403804658 /nfs/dbraw/zinc/80/46/58/403804658.db2.gz CRBWCGDAQRPIOR-LBPRGKRZSA-N 1 2 300.761 2.285 20 10 DECDLO CNC(=O)[C@@H]1CCCC[N@H+]1Cc1cc(Cl)c(F)cc1O ZINC000295229516 403804662 /nfs/dbraw/zinc/80/46/62/403804662.db2.gz CRBWCGDAQRPIOR-LBPRGKRZSA-N 1 2 300.761 2.285 20 10 DECDLO C[N@@H+]1CCC[C@@H](N2CC[NH+](Cc3cccc(Cl)c3[O-])CC2)C1 ZINC000367718474 405134085 /nfs/dbraw/zinc/13/40/85/405134085.db2.gz HEGNJMMMRSDSQJ-OAHLLOKOSA-N 1 2 323.868 2.257 20 10 DECDLO C[N@H+]1CCC[C@@H](N2CC[NH+](Cc3cccc(Cl)c3[O-])CC2)C1 ZINC000367718474 405134087 /nfs/dbraw/zinc/13/40/87/405134087.db2.gz HEGNJMMMRSDSQJ-OAHLLOKOSA-N 1 2 323.868 2.257 20 10 DECDLO CN1CCC2(CC[NH+](Cc3cccc(Cl)c3O)CC2)C1=O ZINC000376057341 289909333 /nfs/dbraw/zinc/90/93/33/289909333.db2.gz YQGMVMWCBOCGTH-UHFFFAOYSA-N 1 2 308.809 2.490 20 10 DECDLO COc1cc(O)c(C[N@H+](C)CC(=O)OC(C)(C)C)cc1OC ZINC000271073291 295003655 /nfs/dbraw/zinc/00/36/55/295003655.db2.gz FWPROVAKDYLZKO-UHFFFAOYSA-N 1 2 311.378 2.183 20 10 DECDLO COc1cc(O)c(C[N@@H+](C)CC(=O)OC(C)(C)C)cc1OC ZINC000271073291 295003658 /nfs/dbraw/zinc/00/36/58/295003658.db2.gz FWPROVAKDYLZKO-UHFFFAOYSA-N 1 2 311.378 2.183 20 10 DECDLO C[C@@H](c1nnnn1C)[N@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000188638439 526186492 /nfs/dbraw/zinc/18/64/92/526186492.db2.gz GQNJYCFSRJMBBK-AWEZNQCLSA-N 1 2 314.437 2.393 20 10 DECDLO C[C@@H](c1nnnn1C)[N@@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000188638439 526186496 /nfs/dbraw/zinc/18/64/96/526186496.db2.gz GQNJYCFSRJMBBK-AWEZNQCLSA-N 1 2 314.437 2.393 20 10 DECDLO Nc1ccc(CC(=O)NCc2ccc(N3CCCC3)[nH+]c2)cc1 ZINC000237906461 527478587 /nfs/dbraw/zinc/47/85/87/527478587.db2.gz UGZOVBXRUXHKOU-UHFFFAOYSA-N 1 2 310.401 2.123 20 10 DECDLO CCN(CC)c1ccc(C[NH2+]Cc2nc(N(C)C)no2)cc1 ZINC000191899797 625549288 /nfs/dbraw/zinc/54/92/88/625549288.db2.gz NKXNXBQUXWFOGT-UHFFFAOYSA-N 1 2 303.410 2.272 20 10 DECDLO CN(C)c1ccc(C[N@@H+]2CC(=O)NC[C@H]2c2ccccc2)cc1 ZINC000933326134 624170069 /nfs/dbraw/zinc/17/00/69/624170069.db2.gz YEHBTNYJXUBHNB-SFHVURJKSA-N 1 2 309.413 2.426 20 10 DECDLO CN(C)c1ccc(C[N@H+]2CC(=O)NC[C@H]2c2ccccc2)cc1 ZINC000933326134 624170070 /nfs/dbraw/zinc/17/00/70/624170070.db2.gz YEHBTNYJXUBHNB-SFHVURJKSA-N 1 2 309.413 2.426 20 10 DECDLO CN(C)c1ccc(CN(C)C(=O)CCCn2cc[nH+]c2)cc1 ZINC000122682119 625116961 /nfs/dbraw/zinc/11/69/61/625116961.db2.gz OHHBOAXEXHDWNI-UHFFFAOYSA-N 1 2 300.406 2.388 20 10 DECDLO COc1ccc(CNc2ccc(N(C)C)c[nH+]2)c(O)c1OC ZINC000893140800 625135592 /nfs/dbraw/zinc/13/55/92/625135592.db2.gz CNPDCJIIMQTDSP-UHFFFAOYSA-N 1 2 303.362 2.483 20 10 DECDLO COC(=O)C[C@@H]1CSCC[N@@H+]1Cc1cc(F)cc(F)c1O ZINC000894046581 636098615 /nfs/dbraw/zinc/09/86/15/636098615.db2.gz WPMZCILHCGRGSX-LLVKDONJSA-N 1 2 317.357 2.151 20 10 DECDLO CN1CCC2(CC[NH+](Cc3cc(F)cc(F)c3O)CC2)C1=O ZINC000894575624 637112635 /nfs/dbraw/zinc/11/26/35/637112635.db2.gz IKXVVOURSMVPON-UHFFFAOYSA-N 1 2 310.344 2.115 20 10 DECDLO C[C@H]1OCC[C@]12C[N@H+](Cc1cc(F)cc(F)c1O)C[C@@H](C)O2 ZINC000894598110 637126833 /nfs/dbraw/zinc/12/68/33/637126833.db2.gz USTKVLLOULIGFW-UVWXRNBGSA-N 1 2 313.344 2.439 20 10 DECDLO O=C1N(CC[NH2+]Cc2cccc(Cl)c2O)C[C@@H]2CCCCN12 ZINC000895343978 637950244 /nfs/dbraw/zinc/95/02/44/637950244.db2.gz TUHMYKVNRGZPCK-ZDUSSCGKSA-N 1 2 323.824 2.425 20 10 DECDLO COC(=O)[C@@H](COC(C)C)[N@H+](C)Cc1ccc(N(C)C)cc1C ZINC000840921287 650383565 /nfs/dbraw/zinc/38/35/65/650383565.db2.gz QZYWGGJKXDZDRS-QGZVFWFLSA-N 1 2 322.449 2.459 20 10 DECDLO COC(=O)[C@@H](COC(C)C)[N@@H+](C)Cc1ccc(N(C)C)cc1C ZINC000840921287 650383567 /nfs/dbraw/zinc/38/35/67/650383567.db2.gz QZYWGGJKXDZDRS-QGZVFWFLSA-N 1 2 322.449 2.459 20 10 DECDLO COC[C@@]1(C[NH2+]Cc2cc(Cl)cc(F)c2[O-])CCC[NH2+]1 ZINC000841067206 650421008 /nfs/dbraw/zinc/42/10/08/650421008.db2.gz KORXYBVWKICYBK-AWEZNQCLSA-N 1 2 302.777 2.043 20 10 DECDLO C[C@@H]([NH2+]CC1(N(C)C)CCOCC1)c1cc(F)cc(F)c1O ZINC000756574077 639676691 /nfs/dbraw/zinc/67/66/91/639676691.db2.gz NBQXLSHAKKXDNM-LLVKDONJSA-N 1 2 314.376 2.432 20 10 DECDLO COc1ccc(O)c([C@@H](C)Nc2ccc(N(C)CCO)c[nH+]2)c1 ZINC000756843238 639700998 /nfs/dbraw/zinc/70/09/98/639700998.db2.gz AHRCKFOTJJDAHI-GFCCVEGCSA-N 1 2 317.389 2.397 20 10 DECDLO C[C@@H]([NH2+][C@H](CCO)C1CCOCC1)c1cc(F)cc(F)c1O ZINC000763557844 640552346 /nfs/dbraw/zinc/55/23/46/640552346.db2.gz FTDHLBGCFOZCIB-MEBBXXQBSA-N 1 2 315.360 2.499 20 10 DECDLO CCNS(=O)(=O)CC[NH2+][C@@H](CC)c1cccc(Cl)c1O ZINC000806145966 641198381 /nfs/dbraw/zinc/19/83/81/641198381.db2.gz PPZMPJGDPXTSAI-LBPRGKRZSA-N 1 2 320.842 2.026 20 10 DECDLO C[C@H](Cn1cc[nH+]c1)NC(=O)N[C@H](C)c1ccc(N(C)C)cc1 ZINC000773238783 641747132 /nfs/dbraw/zinc/74/71/32/641747132.db2.gz XBBRBHIAWPDJTB-ZIAGYGMSSA-N 1 2 315.421 2.398 20 10 DECDLO O=C(Cc1c[nH+]cn1Cc1ccccc1)NCc1ccccc1O ZINC000774061549 641858625 /nfs/dbraw/zinc/85/86/25/641858625.db2.gz AOSQZZREMCCMOK-UHFFFAOYSA-N 1 2 321.380 2.496 20 10 DECDLO CCc1nnc(C[NH2+][C@@H](C)c2ccc(N3CCOCC3)cc2)o1 ZINC000775254082 642022347 /nfs/dbraw/zinc/02/23/47/642022347.db2.gz GFBXZKDFAFQOSP-ZDUSSCGKSA-N 1 2 316.405 2.319 20 10 DECDLO CC(C)(C)OC(=O)[C@@](C)(O)C[NH2+]Cc1cccc(Cl)c1O ZINC000776520699 642180877 /nfs/dbraw/zinc/18/08/77/642180877.db2.gz PFGUJFDOPVWANY-HNNXBMFYSA-N 1 2 315.797 2.228 20 10 DECDLO O=C(CNc1cccc[nH+]1)NCCCSc1nccs1 ZINC000900684138 642443199 /nfs/dbraw/zinc/44/31/99/642443199.db2.gz YAZQZEYQWUMGCK-UHFFFAOYSA-N 1 2 308.432 2.249 20 10 DECDLO CCOc1ccc(O)c(C[N@@H+]2CCN(CC(C)C)C(=O)[C@H]2C)c1 ZINC000779202262 642471982 /nfs/dbraw/zinc/47/19/82/642471982.db2.gz LXFPCVJPZNBYGI-CQSZACIVSA-N 1 2 320.433 2.480 20 10 DECDLO CCOc1ccc(O)c(C[N@H+]2CCN(CC(C)C)C(=O)[C@H]2C)c1 ZINC000779202262 642471986 /nfs/dbraw/zinc/47/19/86/642471986.db2.gz LXFPCVJPZNBYGI-CQSZACIVSA-N 1 2 320.433 2.480 20 10 DECDLO CC(C)C(=O)NCC[NH2+]Cc1cccc(Br)c1O ZINC000042411773 642579701 /nfs/dbraw/zinc/57/97/01/642579701.db2.gz WLVQBAFAGBOWKK-UHFFFAOYSA-N 1 2 315.211 2.017 20 10 DECDLO CC[C@H](C)[C@H]([NH2+][C@@H]1CCN(c2ccc(OC)cc2)C1)C(=O)OC ZINC000905781444 644032472 /nfs/dbraw/zinc/03/24/72/644032472.db2.gz XORIFCALNFLFSE-VBQJREDUSA-N 1 2 320.433 2.451 20 10 DECDLO Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)Cc1c[nH+]cn1C ZINC000839920184 645302824 /nfs/dbraw/zinc/30/28/24/645302824.db2.gz MRYZAUBZSSCAAO-AWEZNQCLSA-N 1 2 314.433 2.084 20 10 DECDLO COc1c(O)c(CN[C@@H](C)C[N@H+](C)C(C)C)ccc1[N+](=O)[O-] ZINC000811512267 646538613 /nfs/dbraw/zinc/53/86/13/646538613.db2.gz JQWRWHVDZOYWBI-NSHDSACASA-N 1 2 311.382 2.127 20 10 DECDLO COc1c(O)c(CN[C@@H](C)C[N@@H+](C)C(C)C)ccc1[N+](=O)[O-] ZINC000811512267 646538616 /nfs/dbraw/zinc/53/86/16/646538616.db2.gz JQWRWHVDZOYWBI-NSHDSACASA-N 1 2 311.382 2.127 20 10 DECDLO C[C@@H](NC(=O)NCc1c[nH+]cn1C)c1ccc(N(C)C)cc1 ZINC000811905591 646591007 /nfs/dbraw/zinc/59/10/07/646591007.db2.gz HIDNRJYGDCVRJC-GFCCVEGCSA-N 1 2 301.394 2.047 20 10 DECDLO C[C@@H]([NH2+]Cc1cn(C)nn1)c1cccc(C(F)(F)F)c1O ZINC000815615075 647035358 /nfs/dbraw/zinc/03/53/58/647035358.db2.gz HPYDSJMZCQBUHI-MRVPVSSYSA-N 1 2 300.284 2.390 20 10 DECDLO C[C@H](CS(C)(=O)=O)[N@H+](C)Cc1cc(Cl)c(F)cc1O ZINC000816510722 647144381 /nfs/dbraw/zinc/14/43/81/647144381.db2.gz DWCKENQTHBWYGY-MRVPVSSYSA-N 1 2 309.790 2.050 20 10 DECDLO C[C@H](CS(C)(=O)=O)[N@@H+](C)Cc1cc(Cl)c(F)cc1O ZINC000816510722 647144382 /nfs/dbraw/zinc/14/43/82/647144382.db2.gz DWCKENQTHBWYGY-MRVPVSSYSA-N 1 2 309.790 2.050 20 10 DECDLO Cc1cc(C(=O)NCCc2[nH]cc[nH+]2)c(C)n1-c1ccccn1 ZINC000174746015 647303073 /nfs/dbraw/zinc/30/30/73/647303073.db2.gz QHUCUMZQFMXOEW-UHFFFAOYSA-N 1 2 309.373 2.185 20 10 DECDLO CN(C)C(=O)O[C@H]1CC[N@H+](Cc2cc(Cl)cc(F)c2O)C1 ZINC000824576935 648614230 /nfs/dbraw/zinc/61/42/30/648614230.db2.gz VSEMNVXQCYANSD-NSHDSACASA-N 1 2 316.760 2.457 20 10 DECDLO CN(C)C(=O)O[C@H]1CC[N@@H+](Cc2cc(Cl)cc(F)c2O)C1 ZINC000824576935 648614232 /nfs/dbraw/zinc/61/42/32/648614232.db2.gz VSEMNVXQCYANSD-NSHDSACASA-N 1 2 316.760 2.457 20 10 DECDLO Cc1cc(Cl)cc(C[NH+]2CCN([C@@H]3CCOC3)CC2)c1O ZINC000827119276 648974510 /nfs/dbraw/zinc/97/45/10/648974510.db2.gz JJWJWLXGCNQSKD-OAHLLOKOSA-N 1 2 310.825 2.261 20 10 DECDLO Cc1cc(C[N@@H+]2CCNC(=O)[C@@H]2C)ccc1N1CCCCC1 ZINC000827654917 649062487 /nfs/dbraw/zinc/06/24/87/649062487.db2.gz FOQKFEUMQCBEFR-HNNXBMFYSA-N 1 2 301.434 2.306 20 10 DECDLO Cc1cc(C[N@H+]2CCNC(=O)[C@@H]2C)ccc1N1CCCCC1 ZINC000827654917 649062491 /nfs/dbraw/zinc/06/24/91/649062491.db2.gz FOQKFEUMQCBEFR-HNNXBMFYSA-N 1 2 301.434 2.306 20 10 DECDLO OCC1(C[NH2+]Cc2cccc(Br)c2O)CCC1 ZINC000184368349 649260314 /nfs/dbraw/zinc/26/03/14/649260314.db2.gz OXQBWLKZIXXDSW-UHFFFAOYSA-N 1 2 300.196 2.407 20 10 DECDLO COc1ccc(O)c([C@@H](C)NC(=O)[C@@H]2CCc3c[nH+]cn3C2)c1 ZINC000844133157 651080924 /nfs/dbraw/zinc/08/09/24/651080924.db2.gz SIYBMKQWURVNNO-VXGBXAGGSA-N 1 2 315.373 2.037 20 10 DECDLO COc1ccc(N(C)CC[N@H+](C)[C@H](C)c2nnc(C)[nH]2)cc1 ZINC000844402965 651123377 /nfs/dbraw/zinc/12/33/77/651123377.db2.gz YGHAQDFILZSBMH-GFCCVEGCSA-N 1 2 303.410 2.251 20 10 DECDLO COc1ccc(N(C)CC[N@@H+](C)[C@H](C)c2nnc(C)[nH]2)cc1 ZINC000844402965 651123379 /nfs/dbraw/zinc/12/33/79/651123379.db2.gz YGHAQDFILZSBMH-GFCCVEGCSA-N 1 2 303.410 2.251 20 10 DECDLO Oc1cccc2c1[C@@H]([NH2+]Cc1nc([C@@H]3CCCO3)n[nH]1)CC2 ZINC000848557904 651470651 /nfs/dbraw/zinc/47/06/51/651470651.db2.gz NEXWBYBIMHZLHG-AAEUAGOBSA-N 1 2 300.362 2.139 20 10 DECDLO C[C@H]([NH2+][C@H]1C[C@H](O)C1)c1cc(Br)cc(F)c1O ZINC000850578240 651955420 /nfs/dbraw/zinc/95/54/20/651955420.db2.gz IEEZHZKOBNHZGX-XVYDVKMFSA-N 1 2 304.159 2.468 20 10 DECDLO Cc1cc(C(=O)N[C@H]2Cc3c[nH+]cn3C2)c(C)n1-c1ccccn1 ZINC000857888428 652196689 /nfs/dbraw/zinc/19/66/89/652196689.db2.gz UDDBERAPSPCQKZ-AWEZNQCLSA-N 1 2 321.384 2.040 20 10 DECDLO Oc1c(Br)cccc1C[NH2+]C[C@@H]1CC[C@@H](O)C1 ZINC000188845174 684364772 /nfs/dbraw/zinc/36/47/72/684364772.db2.gz OJDZNAOEQTWFMK-MWLCHTKSSA-N 1 2 300.196 2.405 20 10 DECDLO C[C@@H](C[S@](C)=O)[N@H+](C)Cc1cc(F)c(N(C)C)cc1F ZINC000862324337 686276639 /nfs/dbraw/zinc/27/66/39/686276639.db2.gz JYQPFYGNXQOKED-FVINQWEUSA-N 1 2 304.406 2.230 20 10 DECDLO C[C@@H](C[S@](C)=O)[N@@H+](C)Cc1cc(F)c(N(C)C)cc1F ZINC000862324337 686276641 /nfs/dbraw/zinc/27/66/41/686276641.db2.gz JYQPFYGNXQOKED-FVINQWEUSA-N 1 2 304.406 2.230 20 10 DECDLO CCOC(=O)/C=C/C[NH+]1CCN(c2ccc(OC)c(F)c2)CC1 ZINC000929823935 694036000 /nfs/dbraw/zinc/03/60/00/694036000.db2.gz VGNZPHZGVZWYEW-SNAWJCMRSA-N 1 2 322.380 2.076 20 10 DECDLO CC(C)C[C@@H](C(=O)NCCc1ccc(N)cc1)n1cc[nH+]c1 ZINC000876528516 689847479 /nfs/dbraw/zinc/84/74/79/689847479.db2.gz RVQLESLZMROBAA-INIZCTEOSA-N 1 2 300.406 2.411 20 10 DECDLO CCc1nn(C)c(OC)c1C[NH2+]Cc1ccc(F)c(F)c1O ZINC000877135202 690026889 /nfs/dbraw/zinc/02/68/89/690026889.db2.gz SUYXREUGFFBBNC-UHFFFAOYSA-N 1 2 311.332 2.265 20 10 DECDLO CCN(C)C(=O)[C@@H]([NH2+]Cc1ccc(F)c(F)c1O)C(C)C ZINC000877564068 690153554 /nfs/dbraw/zinc/15/35/54/690153554.db2.gz XEPLZHWLUSHYGF-ZDUSSCGKSA-N 1 2 300.349 2.263 20 10 DECDLO CC(C)(C)OC(=O)COCC[NH2+]Cc1cccc(Cl)c1O ZINC000877673476 690186301 /nfs/dbraw/zinc/18/63/01/690186301.db2.gz GNBZBPKESAQKFX-UHFFFAOYSA-N 1 2 315.797 2.494 20 10 DECDLO OC1CCN(c2ccc(CNc3cc[nH+]cc3F)cc2)CC1 ZINC000882633825 691331490 /nfs/dbraw/zinc/33/14/90/691331490.db2.gz CTSDOEPLTYSHTE-UHFFFAOYSA-N 1 2 301.365 2.216 20 10 DECDLO CC(C)[C@@H](C[NH2+][C@@H](C)c1c([O-])cccc1F)N1CC[NH+](C)CC1 ZINC000886500213 692094576 /nfs/dbraw/zinc/09/45/76/692094576.db2.gz LHMVSWZOSYMLMN-GOEBONIOSA-N 1 2 323.456 2.454 20 10 DECDLO Oc1cc(F)c(Br)cc1C[NH+]1CC(C2COC2)C1 ZINC001144299492 790849351 /nfs/dbraw/zinc/84/93/51/790849351.db2.gz YFQMHGYFZCLZRQ-UHFFFAOYSA-N 1 2 316.170 2.372 20 10 DECDLO Oc1c(F)cc(Br)cc1C[NH2+]CCn1ccnc1 ZINC000715795017 792511588 /nfs/dbraw/zinc/51/15/88/792511588.db2.gz FDCJFQYYKSKHNA-UHFFFAOYSA-N 1 2 314.158 2.280 20 10 DECDLO CC[C@H]1CC[C@@H]([NH2+][C@@H](Cc2ccc(O)c(O)c2)C(=O)OC)C1 ZINC001173259422 793651380 /nfs/dbraw/zinc/65/13/80/793651380.db2.gz DQUWTTOONPQMCR-YUTCNCBUSA-N 1 2 307.390 2.350 20 10 DECDLO COc1ccc(O)c(C[NH2+][C@H](C)c2nc(C(F)(F)F)n[nH]2)c1 ZINC001184001053 795978613 /nfs/dbraw/zinc/97/86/13/795978613.db2.gz ALYYNFKDDFIPIL-SSDOTTSWSA-N 1 2 316.283 2.389 20 10 DECDLO COC[C@H]1Cn2ccnc2C[N@H+](Cc2c(O)cccc2F)C1 ZINC001137834541 796143661 /nfs/dbraw/zinc/14/36/61/796143661.db2.gz KFBICSRAWCHLAS-GFCCVEGCSA-N 1 2 305.353 2.006 20 10 DECDLO COC[C@H]1Cn2ccnc2C[N@@H+](Cc2c(O)cccc2F)C1 ZINC001137834541 796143665 /nfs/dbraw/zinc/14/36/65/796143665.db2.gz KFBICSRAWCHLAS-GFCCVEGCSA-N 1 2 305.353 2.006 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CCC[C@@H](CCO)C1 ZINC001139129259 796329115 /nfs/dbraw/zinc/32/91/15/796329115.db2.gz SPNNXSFDOAFAMP-ZDUSSCGKSA-N 1 2 317.385 2.401 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CCC[C@@H](CCO)C1 ZINC001139129259 796329118 /nfs/dbraw/zinc/32/91/18/796329118.db2.gz SPNNXSFDOAFAMP-ZDUSSCGKSA-N 1 2 317.385 2.401 20 10 DECDLO COC(=O)CC[C@@H]1COCC[N@@H+]1Cc1ccc(N(C)C)c(C)c1 ZINC001139673339 796408165 /nfs/dbraw/zinc/40/81/65/796408165.db2.gz ADMGCWALAAWHMS-MRXNPFEDSA-N 1 2 320.433 2.215 20 10 DECDLO COC(=O)CC[C@@H]1COCC[N@H+]1Cc1ccc(N(C)C)c(C)c1 ZINC001139673339 796408166 /nfs/dbraw/zinc/40/81/66/796408166.db2.gz ADMGCWALAAWHMS-MRXNPFEDSA-N 1 2 320.433 2.215 20 10 DECDLO O=C(C1CCC1)N1CC[NH+](Cc2ccc(Cl)cc2O)CC1 ZINC001140466108 796526291 /nfs/dbraw/zinc/52/62/91/796526291.db2.gz XKAHAHZNFLKTOY-UHFFFAOYSA-N 1 2 308.809 2.490 20 10 DECDLO CC(=O)N1CC[N@@H+](Cc2ccc(N(C)C)cc2Cl)C[C@H]1C ZINC001140926709 796598103 /nfs/dbraw/zinc/59/81/03/796598103.db2.gz RJDBMLMHWIVRRB-GFCCVEGCSA-N 1 2 309.841 2.459 20 10 DECDLO CC(=O)N1CC[N@H+](Cc2ccc(N(C)C)cc2Cl)C[C@H]1C ZINC001140926709 796598108 /nfs/dbraw/zinc/59/81/08/796598108.db2.gz RJDBMLMHWIVRRB-GFCCVEGCSA-N 1 2 309.841 2.459 20 10 DECDLO CCOc1cccc(C[NH+]2CC(NC(=O)OC(C)(C)C)C2)c1O ZINC001203602235 800088513 /nfs/dbraw/zinc/08/85/13/800088513.db2.gz KLGJSNLENYBDOX-UHFFFAOYSA-N 1 2 322.405 2.500 20 10 DECDLO COc1ccc(C[NH+]2CC(N(C)C(=O)OC(C)(C)C)C2)c(O)c1 ZINC001203621583 800091840 /nfs/dbraw/zinc/09/18/40/800091840.db2.gz XXGPFIUVJCKTEM-UHFFFAOYSA-N 1 2 322.405 2.452 20 10 DECDLO CCOCc1ncn2c1C[N@H+](Cc1ccc(O)c(O)c1)CCC2 ZINC001203877855 800138512 /nfs/dbraw/zinc/13/85/12/800138512.db2.gz XSGMDTNTHQHDAM-UHFFFAOYSA-N 1 2 317.389 2.237 20 10 DECDLO CCOCc1ncn2c1C[N@@H+](Cc1ccc(O)c(O)c1)CCC2 ZINC001203877855 800138516 /nfs/dbraw/zinc/13/85/16/800138516.db2.gz XSGMDTNTHQHDAM-UHFFFAOYSA-N 1 2 317.389 2.237 20 10 DECDLO Oc1ccc(C[NH+]2CCN(c3cc(Cl)ccn3)CC2)cc1O ZINC001203880430 800139705 /nfs/dbraw/zinc/13/97/05/800139705.db2.gz AMVQPAZFOQVIQH-UHFFFAOYSA-N 1 2 319.792 2.468 20 10 DECDLO COC(=O)[C@H](Cc1ccccc1)[N@H+](C)Cc1ccc(O)c(O)c1 ZINC001203879104 800140072 /nfs/dbraw/zinc/14/00/72/800140072.db2.gz FIWVYLVBTPHQIY-HNNXBMFYSA-N 1 2 315.369 2.314 20 10 DECDLO COC(=O)[C@H](Cc1ccccc1)[N@@H+](C)Cc1ccc(O)c(O)c1 ZINC001203879104 800140080 /nfs/dbraw/zinc/14/00/80/800140080.db2.gz FIWVYLVBTPHQIY-HNNXBMFYSA-N 1 2 315.369 2.314 20 10 DECDLO CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](C1)[N@H+]2Cc1ccc(O)cc1O ZINC001204276983 800199188 /nfs/dbraw/zinc/19/91/88/800199188.db2.gz UYXLDNCRUYRGFD-BETUJISGSA-N 1 2 320.389 2.291 20 10 DECDLO CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](C1)[N@@H+]2Cc1ccc(O)cc1O ZINC001204276983 800199193 /nfs/dbraw/zinc/19/91/93/800199193.db2.gz UYXLDNCRUYRGFD-BETUJISGSA-N 1 2 320.389 2.291 20 10 DECDLO Oc1ccc(CN2CC[C@H]([NH+]3CCCC3)C(F)(F)C2)c(O)c1 ZINC001204281743 800200744 /nfs/dbraw/zinc/20/07/44/800200744.db2.gz HZHXZXYCNYGFAH-HNNXBMFYSA-N 1 2 312.360 2.403 20 10 DECDLO COc1ccc2c(c1)c1c(n2C)CC[N@@H+](CC(OC)OC)C1 ZINC001207253351 800717557 /nfs/dbraw/zinc/71/75/57/800717557.db2.gz SWOCHYIJDJJSPO-UHFFFAOYSA-N 1 2 304.390 2.164 20 10 DECDLO COc1ccc2c(c1)c1c(n2C)CC[N@H+](CC(OC)OC)C1 ZINC001207253351 800717562 /nfs/dbraw/zinc/71/75/62/800717562.db2.gz SWOCHYIJDJJSPO-UHFFFAOYSA-N 1 2 304.390 2.164 20 10 DECDLO CCOC(=O)[C@@H]1CCCC[N@@H+]1Cc1cc(OC)c(O)cc1O ZINC001231635360 801699883 /nfs/dbraw/zinc/69/98/83/801699883.db2.gz HJJKJKVUKPRLLW-LBPRGKRZSA-N 1 2 309.362 2.024 20 10 DECDLO CCOC(=O)[C@@H]1CCCC[N@H+]1Cc1cc(OC)c(O)cc1O ZINC001231635360 801699888 /nfs/dbraw/zinc/69/98/88/801699888.db2.gz HJJKJKVUKPRLLW-LBPRGKRZSA-N 1 2 309.362 2.024 20 10 DECDLO Cc1cnc(N2CC[NH+](Cc3cccc(Cl)c3O)CC2)nc1 ZINC001231913536 801750009 /nfs/dbraw/zinc/75/00/09/801750009.db2.gz LVVMPYLNCZKLRR-UHFFFAOYSA-N 1 2 318.808 2.466 20 10 DECDLO CN(C)c1ccc(C[N@@H+]2CCN(C3CCCC3)C(=O)C2)c(O)c1 ZINC001232839825 801969356 /nfs/dbraw/zinc/96/93/56/801969356.db2.gz WSFJLNJNOHURGS-UHFFFAOYSA-N 1 2 317.433 2.045 20 10 DECDLO CN(C)c1ccc(C[N@H+]2CCN(C3CCCC3)C(=O)C2)c(O)c1 ZINC001232839825 801969357 /nfs/dbraw/zinc/96/93/57/801969357.db2.gz WSFJLNJNOHURGS-UHFFFAOYSA-N 1 2 317.433 2.045 20 10 DECDLO OC[C@H]1CCC[N@H+](Cc2c(O)cc(Br)cc2F)C1 ZINC001233027367 802006402 /nfs/dbraw/zinc/00/64/02/802006402.db2.gz QLNCUSOSQZSVNC-VIFPVBQESA-N 1 2 318.186 2.498 20 10 DECDLO OC[C@H]1CCC[N@@H+](Cc2c(O)cc(Br)cc2F)C1 ZINC001233027367 802006410 /nfs/dbraw/zinc/00/64/10/802006410.db2.gz QLNCUSOSQZSVNC-VIFPVBQESA-N 1 2 318.186 2.498 20 10 DECDLO C[C@@]1(O)CC[N@H+](Cc2c(O)cc(Br)cc2F)C1 ZINC001233027555 802006787 /nfs/dbraw/zinc/00/67/87/802006787.db2.gz BUCHHTDOZWRJLK-GFCCVEGCSA-N 1 2 304.159 2.251 20 10 DECDLO C[C@@]1(O)CC[N@@H+](Cc2c(O)cc(Br)cc2F)C1 ZINC001233027555 802006799 /nfs/dbraw/zinc/00/67/99/802006799.db2.gz BUCHHTDOZWRJLK-GFCCVEGCSA-N 1 2 304.159 2.251 20 10 DECDLO Oc1c(C[N@@H+]2CC[C@@H](Oc3cnccn3)C2)ccc(F)c1F ZINC001233080223 802022189 /nfs/dbraw/zinc/02/21/89/802022189.db2.gz SSBZACSMMQYUDG-LLVKDONJSA-N 1 2 307.300 2.114 20 10 DECDLO Cc1cc(N2CC[NH+](Cc3c(O)ccc(F)c3F)CC2)ncn1 ZINC001233336569 802079226 /nfs/dbraw/zinc/07/92/26/802079226.db2.gz QFPZIJQUCJFCDH-UHFFFAOYSA-N 1 2 320.343 2.091 20 10 DECDLO Oc1ccc(F)c(F)c1C[N@H+]1CC[C@@H](Oc2cnccn2)C1 ZINC001233336712 802079552 /nfs/dbraw/zinc/07/95/52/802079552.db2.gz WRKBGJFNOLYIFS-SNVBAGLBSA-N 1 2 307.300 2.114 20 10 DECDLO COC(=O)[C@@]1(F)CC[N@H+](Cc2cccc(C(F)(F)F)c2O)C1 ZINC001233416086 802112408 /nfs/dbraw/zinc/11/24/08/802112408.db2.gz WARVGLPFFGTSRC-CYBMUJFWSA-N 1 2 321.270 2.498 20 10 DECDLO COC(=O)[C@@]1(F)CC[N@@H+](Cc2cccc(C(F)(F)F)c2O)C1 ZINC001233416086 802112413 /nfs/dbraw/zinc/11/24/13/802112413.db2.gz WARVGLPFFGTSRC-CYBMUJFWSA-N 1 2 321.270 2.498 20 10 DECDLO CCC(CC)(CO)C[NH2+][C@H](C)c1cccc(-c2nn[nH]n2)c1O ZINC001604020306 1070177629 /nfs/dbraw/zinc/17/76/29/1070177629.db2.gz WAEQSOYCDKMWBM-LLVKDONJSA-N 1 2 319.409 2.022 20 10 DECDLO CO[C@@H]1CCC[C@H]1C[NH2+][C@@H](C)c1cccc(-c2nn[nH]n2)c1O ZINC001591359489 1076733868 /nfs/dbraw/zinc/73/38/68/1076733868.db2.gz DBTUDPPCQTXZTQ-COPLHBTASA-N 1 2 317.393 2.038 20 10 DECDLO CC[C@@H]([NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1)C1(C(=O)[O-])CCC1 ZINC001609938283 1077953805 /nfs/dbraw/zinc/95/38/05/1077953805.db2.gz WUCXMOVSQCCXMJ-JKSUJKDBSA-N 1 2 319.449 2.376 20 10 DECDLO Cc1cc(=O)[nH]c(C(C)(C)[NH2+]Cc2cc(F)c(F)cc2O)n1 ZINC001658599457 1080212067 /nfs/dbraw/zinc/21/20/67/1080212067.db2.gz ZIIWYZFHMXPWLM-UHFFFAOYSA-N 1 2 309.316 2.499 20 10 DECDLO CCOC(=O)[C@H]1C[N@H+](Cc2cc(C(C)C)ccc2O)CCO1 ZINC001659047502 1080226527 /nfs/dbraw/zinc/22/65/27/1080226527.db2.gz FLQHQKMXTRBHJO-MRXNPFEDSA-N 1 2 307.390 2.280 20 10 DECDLO CCOC(=O)[C@H]1C[N@@H+](Cc2cc(C(C)C)ccc2O)CCO1 ZINC001659047502 1080226531 /nfs/dbraw/zinc/22/65/31/1080226531.db2.gz FLQHQKMXTRBHJO-MRXNPFEDSA-N 1 2 307.390 2.280 20 10 DECDLO Cc1cc(O)c(C[N@@H+]2CC[C@](F)(CO)C2)cc1Br ZINC001237677370 1080472518 /nfs/dbraw/zinc/47/25/18/1080472518.db2.gz MMLSTWFEKJYVIJ-CYBMUJFWSA-N 1 2 318.186 2.369 20 10 DECDLO Cc1cc(O)c(C[N@H+]2CC[C@](F)(CO)C2)cc1Br ZINC001237677370 1080472522 /nfs/dbraw/zinc/47/25/22/1080472522.db2.gz MMLSTWFEKJYVIJ-CYBMUJFWSA-N 1 2 318.186 2.369 20 10 DECDLO CN1CCO[C@]2(CCC[N@H+](Cc3cccc(Cl)c3O)C2)C1 ZINC001276379945 1083743218 /nfs/dbraw/zinc/74/32/18/1083743218.db2.gz CGLIFLRSQXHZTB-MRXNPFEDSA-N 1 2 310.825 2.342 20 10 DECDLO CN1CCO[C@]2(CCC[N@@H+](Cc3cccc(Cl)c3O)C2)C1 ZINC001276379945 1083743228 /nfs/dbraw/zinc/74/32/28/1083743228.db2.gz CGLIFLRSQXHZTB-MRXNPFEDSA-N 1 2 310.825 2.342 20 10 DECDLO OC[C@@H]1CN(Cc2ccccc2O)CC[N@@H+]1Cc1ccccc1 ZINC001203547304 1083999924 /nfs/dbraw/zinc/99/99/24/1083999924.db2.gz NSBKEVNULMOHLE-SFHVURJKSA-N 1 2 312.413 2.071 20 10 DECDLO OC[C@@H]1CN(Cc2ccccc2O)CC[N@H+]1Cc1ccccc1 ZINC001203547304 1083999932 /nfs/dbraw/zinc/99/99/32/1083999932.db2.gz NSBKEVNULMOHLE-SFHVURJKSA-N 1 2 312.413 2.071 20 10 DECDLO CC(C)(C)OC(=O)NCC1C[NH+](Cc2c(O)cccc2F)C1 ZINC001137832900 1086431193 /nfs/dbraw/zinc/43/11/93/1086431193.db2.gz LJRHSFPXCXHUEJ-UHFFFAOYSA-N 1 2 310.369 2.488 20 10 DECDLO CCn1cnnc1C[NH2+]Cc1c(O)cccc1Br ZINC000706829176 1086651753 /nfs/dbraw/zinc/65/17/53/1086651753.db2.gz PAYKSODZBCLJKV-UHFFFAOYSA-N 1 2 311.183 2.056 20 10 DECDLO CC[N@H+]1C[C@@H]2C[NH+](Cc3ccc(OC)c(Cl)c3[O-])C[C@@H]2C1 ZINC001236816999 1138437779 /nfs/dbraw/zinc/43/77/79/1138437779.db2.gz AWHXHTGRFOVEBR-BETUJISGSA-N 1 2 310.825 2.438 20 10 DECDLO CC[N@@H+]1C[C@@H]2C[NH+](Cc3ccc(OC)c(Cl)c3[O-])C[C@@H]2C1 ZINC001236816999 1138437785 /nfs/dbraw/zinc/43/77/85/1138437785.db2.gz AWHXHTGRFOVEBR-BETUJISGSA-N 1 2 310.825 2.438 20 10 DECDLO CC[NH+]1C[C@@H]2C[N@@H+](Cc3ccc(OC)c(Cl)c3[O-])C[C@@H]2C1 ZINC001236816999 1138437788 /nfs/dbraw/zinc/43/77/88/1138437788.db2.gz AWHXHTGRFOVEBR-BETUJISGSA-N 1 2 310.825 2.438 20 10 DECDLO CC[NH+]1C[C@@H]2C[N@H+](Cc3ccc(OC)c(Cl)c3[O-])C[C@@H]2C1 ZINC001236816999 1138437792 /nfs/dbraw/zinc/43/77/92/1138437792.db2.gz AWHXHTGRFOVEBR-BETUJISGSA-N 1 2 310.825 2.438 20 10 DECDLO CC[N@H+]1C[C@H]2CN(Cc3ccc(OC)c(Cl)c3O)C[C@H]2C1 ZINC001236816999 1138437794 /nfs/dbraw/zinc/43/77/94/1138437794.db2.gz AWHXHTGRFOVEBR-BETUJISGSA-N 1 2 310.825 2.438 20 10 DECDLO CC[N@@H+]1C[C@H]2CN(Cc3ccc(OC)c(Cl)c3O)C[C@H]2C1 ZINC001236816999 1138437795 /nfs/dbraw/zinc/43/77/95/1138437795.db2.gz AWHXHTGRFOVEBR-BETUJISGSA-N 1 2 310.825 2.438 20 10 DECDLO CCOC(=O)C[N@H+](C)Cc1ccc(N2CCC(OC)CC2)cc1 ZINC001324486618 1142086674 /nfs/dbraw/zinc/08/66/74/1142086674.db2.gz QUIGSKZVCUQLOL-UHFFFAOYSA-N 1 2 320.433 2.297 20 10 DECDLO CCOC(=O)C[N@@H+](C)Cc1ccc(N2CCC(OC)CC2)cc1 ZINC001324486618 1142086683 /nfs/dbraw/zinc/08/66/83/1142086683.db2.gz QUIGSKZVCUQLOL-UHFFFAOYSA-N 1 2 320.433 2.297 20 10 DECDLO CCN(CC)c1ccc(C[NH2+]Cc2nc(N(C)C)n[nH]2)cc1F ZINC001308558851 1147480142 /nfs/dbraw/zinc/48/01/42/1147480142.db2.gz YYTHOZUKMISORG-UHFFFAOYSA-N 1 2 320.416 2.146 20 10 DECDLO C[C@H]1[C@@H](CO)CC[N@@H+]1Cc1cc(Br)cc(F)c1O ZINC001308724548 1147483739 /nfs/dbraw/zinc/48/37/39/1147483739.db2.gz SYCRNSGKNOPDKV-DTWKUNHWSA-N 1 2 318.186 2.497 20 10 DECDLO C[C@H]1[C@@H](CO)CC[N@H+]1Cc1cc(Br)cc(F)c1O ZINC001308724548 1147483746 /nfs/dbraw/zinc/48/37/46/1147483746.db2.gz SYCRNSGKNOPDKV-DTWKUNHWSA-N 1 2 318.186 2.497 20 10 DECDLO CN(C)c1ccc2c(c1)OCCN2C(=O)c1ccc2[nH+]ccn2c1 ZINC000173196899 282296255 /nfs/dbraw/zinc/29/62/55/282296255.db2.gz BYPOWTHUFNSYDP-UHFFFAOYSA-N 1 2 322.368 2.440 20 10 DECDLO C[C@@H](Cn1cc[nH+]c1)NC(=O)N(C)Cc1ccc(N(C)C)cc1 ZINC000047029152 354303380 /nfs/dbraw/zinc/30/33/80/354303380.db2.gz UWWBEOQJDWJFKF-AWEZNQCLSA-N 1 2 315.421 2.179 20 10 DECDLO C[C@H]([NH2+]CCCN1CCOCC1)c1ccc(F)c(F)c1O ZINC000191180700 299293665 /nfs/dbraw/zinc/29/36/65/299293665.db2.gz MDAALESNANMGRA-NSHDSACASA-N 1 2 300.349 2.043 20 10 DECDLO COC(=O)[C@H]1C[C@H](OC)CC[N@@H+]1Cc1cc(Cl)ccc1O ZINC000370365383 533549204 /nfs/dbraw/zinc/54/92/04/533549204.db2.gz FOXYHWYKEXZLSB-CHWSQXEVSA-N 1 2 313.781 2.198 20 10 DECDLO COC(=O)[C@H]1C[C@H](OC)CC[N@H+]1Cc1cc(Cl)ccc1O ZINC000370365383 533549206 /nfs/dbraw/zinc/54/92/06/533549206.db2.gz FOXYHWYKEXZLSB-CHWSQXEVSA-N 1 2 313.781 2.198 20 10 DECDLO CS(=O)(=O)[C@@H]1CCC[N@H+](Cc2cccc(Cl)c2O)C1 ZINC000274132611 130209656 /nfs/dbraw/zinc/20/96/56/130209656.db2.gz PMDQZFFIRFZLQQ-LLVKDONJSA-N 1 2 303.811 2.055 20 10 DECDLO CS(=O)(=O)[C@@H]1CCC[N@@H+](Cc2cccc(Cl)c2O)C1 ZINC000274132611 130209658 /nfs/dbraw/zinc/20/96/58/130209658.db2.gz PMDQZFFIRFZLQQ-LLVKDONJSA-N 1 2 303.811 2.055 20 10 DECDLO Cc1cc(Cl)cc(C[N@@H+]2CCC[C@@H](S(C)(=O)=O)C2)c1O ZINC000274182278 130214138 /nfs/dbraw/zinc/21/41/38/130214138.db2.gz YGYMDPNUJXJQJC-CYBMUJFWSA-N 1 2 317.838 2.363 20 10 DECDLO Cc1cc(Cl)cc(C[N@H+]2CCC[C@@H](S(C)(=O)=O)C2)c1O ZINC000274182278 130214139 /nfs/dbraw/zinc/21/41/39/130214139.db2.gz YGYMDPNUJXJQJC-CYBMUJFWSA-N 1 2 317.838 2.363 20 10 DECDLO COCCc1noc(C[N@H+](C)Cc2cc(C)c(C)cc2O)n1 ZINC000122543183 402083586 /nfs/dbraw/zinc/08/35/86/402083586.db2.gz ATZVNHBOXJMVTC-UHFFFAOYSA-N 1 2 305.378 2.213 20 10 DECDLO COCCc1noc(C[N@@H+](C)Cc2cc(C)c(C)cc2O)n1 ZINC000122543183 402083589 /nfs/dbraw/zinc/08/35/89/402083589.db2.gz ATZVNHBOXJMVTC-UHFFFAOYSA-N 1 2 305.378 2.213 20 10 DECDLO COc1cc(Cl)cc(C[N@@H+]2CC(=O)N[C@H]3CCCC[C@@H]32)c1O ZINC000184685021 402291410 /nfs/dbraw/zinc/29/14/10/402291410.db2.gz LVCZKIPFIMDPPN-STQMWFEESA-N 1 2 324.808 2.297 20 10 DECDLO COc1cc(Cl)cc(C[N@H+]2CC(=O)N[C@H]3CCCC[C@@H]32)c1O ZINC000184685021 402291414 /nfs/dbraw/zinc/29/14/14/402291414.db2.gz LVCZKIPFIMDPPN-STQMWFEESA-N 1 2 324.808 2.297 20 10 DECDLO CCC[C@@H]1C(=O)NCC[N@H+]1Cc1cc(Cl)cc(OC)c1O ZINC000184700429 402293096 /nfs/dbraw/zinc/29/30/96/402293096.db2.gz XXTVSYAQPURVHM-GFCCVEGCSA-N 1 2 312.797 2.155 20 10 DECDLO CCC[C@@H]1C(=O)NCC[N@@H+]1Cc1cc(Cl)cc(OC)c1O ZINC000184700429 402293099 /nfs/dbraw/zinc/29/30/99/402293099.db2.gz XXTVSYAQPURVHM-GFCCVEGCSA-N 1 2 312.797 2.155 20 10 DECDLO CCNC(=O)N1CC[C@@H]([NH2+][C@@H](C)c2ccc(F)c(F)c2O)C1 ZINC000187795806 402511296 /nfs/dbraw/zinc/51/12/96/402511296.db2.gz GMGZNCRWMJYBJK-VHSXEESVSA-N 1 2 313.348 2.125 20 10 DECDLO COc1c(O)c(C[N@@H+]2CCOCC23CCC3)ccc1[N+](=O)[O-] ZINC000365793205 404721942 /nfs/dbraw/zinc/72/19/42/404721942.db2.gz FUPCPFCSXMTKRF-UHFFFAOYSA-N 1 2 308.334 2.064 20 10 DECDLO COc1c(O)c(C[N@H+]2CCOCC23CCC3)ccc1[N+](=O)[O-] ZINC000365793205 404721946 /nfs/dbraw/zinc/72/19/46/404721946.db2.gz FUPCPFCSXMTKRF-UHFFFAOYSA-N 1 2 308.334 2.064 20 10 DECDLO CS(=O)(=O)C[C@H]1CC[N@H+](Cc2c(O)ccc(Cl)c2F)C1 ZINC000366493234 404802588 /nfs/dbraw/zinc/80/25/88/404802588.db2.gz XQRKXFFCBFTODZ-VIFPVBQESA-N 1 2 321.801 2.051 20 10 DECDLO CS(=O)(=O)C[C@H]1CC[N@@H+](Cc2c(O)ccc(Cl)c2F)C1 ZINC000366493234 404802590 /nfs/dbraw/zinc/80/25/90/404802590.db2.gz XQRKXFFCBFTODZ-VIFPVBQESA-N 1 2 321.801 2.051 20 10 DECDLO C[C@H]([NH2+][C@H]1CCCN(CCCO)C1)c1ccc(F)c(F)c1O ZINC000297383298 227096253 /nfs/dbraw/zinc/09/62/53/227096253.db2.gz RFOBOAHNYPPJLL-RYUDHWBXSA-N 1 2 314.376 2.168 20 10 DECDLO C[C@@H]([NH2+]C[C@H]1COCCN1)c1ccc(Cl)c(Cl)c1O ZINC000530228239 335971321 /nfs/dbraw/zinc/97/13/21/335971321.db2.gz ZFIRQHSEUGJKDI-BDAKNGLRSA-N 1 2 305.205 2.338 20 10 DECDLO O=C([C@@H]1CC[N@@H+](Cc2cccc(Cl)c2O)C1)N1CCCC1 ZINC000377827475 534591360 /nfs/dbraw/zinc/59/13/60/534591360.db2.gz WZUYGDIGOWYTTQ-CYBMUJFWSA-N 1 2 308.809 2.490 20 10 DECDLO O=C([C@@H]1CC[N@H+](Cc2cccc(Cl)c2O)C1)N1CCCC1 ZINC000377827475 534591366 /nfs/dbraw/zinc/59/13/66/534591366.db2.gz WZUYGDIGOWYTTQ-CYBMUJFWSA-N 1 2 308.809 2.490 20 10 DECDLO COCCc1noc(C[N@H+](C)Cc2cccc(Cl)c2O)n1 ZINC000180376706 522038567 /nfs/dbraw/zinc/03/85/67/522038567.db2.gz MUWBNBRIEIOQPU-UHFFFAOYSA-N 1 2 311.769 2.250 20 10 DECDLO COCCc1noc(C[N@@H+](C)Cc2cccc(Cl)c2O)n1 ZINC000180376706 522038575 /nfs/dbraw/zinc/03/85/75/522038575.db2.gz MUWBNBRIEIOQPU-UHFFFAOYSA-N 1 2 311.769 2.250 20 10 DECDLO CCO[C@@H]1C[C@@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2O)[C@@]12CCCO2 ZINC000272721505 535410904 /nfs/dbraw/zinc/41/09/04/535410904.db2.gz XOVPTQVBOZDCID-OAGGEKHMSA-N 1 2 322.361 2.117 20 10 DECDLO COCCc1cc[nH+]c(NCc2cc([N+](=O)[O-])ccc2O)c1 ZINC000285190704 536831071 /nfs/dbraw/zinc/83/10/71/536831071.db2.gz NOUORRSMOPPWCX-UHFFFAOYSA-N 1 2 303.318 2.496 20 10 DECDLO COC(=O)C[C@@H]1COCC[N@@H+]1C/C=C/c1ccc(N(C)C)cc1 ZINC000835053628 649872289 /nfs/dbraw/zinc/87/22/89/649872289.db2.gz ONGGLPGNOZCIHG-LAQIPUCWSA-N 1 2 318.417 2.030 20 10 DECDLO COC(=O)C[C@@H]1COCC[N@H+]1C/C=C/c1ccc(N(C)C)cc1 ZINC000835053628 649872290 /nfs/dbraw/zinc/87/22/90/649872290.db2.gz ONGGLPGNOZCIHG-LAQIPUCWSA-N 1 2 318.417 2.030 20 10 DECDLO COc1ccc(O)c([C@@H](C)[NH2+]Cc2nc([C@H](C)OC)no2)c1 ZINC000182348300 625254203 /nfs/dbraw/zinc/25/42/03/625254203.db2.gz CTOSMNTUOJGHBM-ZJUUUORDSA-N 1 2 307.350 2.342 20 10 DECDLO CC(C)C(=O)N1CCC[N@H+](Cc2cc(F)cc(F)c2O)CC1 ZINC000893968126 636077732 /nfs/dbraw/zinc/07/77/32/636077732.db2.gz YEAULDRPNPBOJM-UHFFFAOYSA-N 1 2 312.360 2.361 20 10 DECDLO CC(C)C(=O)N1CCC[N@@H+](Cc2cc(F)cc(F)c2O)CC1 ZINC000893968126 636077735 /nfs/dbraw/zinc/07/77/35/636077735.db2.gz YEAULDRPNPBOJM-UHFFFAOYSA-N 1 2 312.360 2.361 20 10 DECDLO CNc1cc(NC[C@H]2CCN(c3ccc(OC)cc3)C2)[nH+]cn1 ZINC000894269903 636634497 /nfs/dbraw/zinc/63/44/97/636634497.db2.gz XCNPNQCVLOYUOS-CYBMUJFWSA-N 1 2 313.405 2.465 20 10 DECDLO CCN(CC)c1ccc(C[NH+]2CC(C3CS(=O)(=O)C3)C2)cc1 ZINC000895431501 638017041 /nfs/dbraw/zinc/01/70/41/638017041.db2.gz PEBQBKGJQWOOJL-UHFFFAOYSA-N 1 2 322.474 2.009 20 10 DECDLO CCc1cccc(C[NH2+][C@@H](CC2CCOCC2)C(=O)OC)c1O ZINC000895593340 638106632 /nfs/dbraw/zinc/10/66/32/638106632.db2.gz PYURXMNZIXZPAA-INIZCTEOSA-N 1 2 321.417 2.403 20 10 DECDLO COc1cc(Cl)cc(C[N@@H+]2CCCn3nncc3C2)c1O ZINC000895756383 638183623 /nfs/dbraw/zinc/18/36/23/638183623.db2.gz WALBJKFEALQCQF-UHFFFAOYSA-N 1 2 308.769 2.052 20 10 DECDLO COc1cc(Cl)cc(C[N@H+]2CCCn3nncc3C2)c1O ZINC000895756383 638183626 /nfs/dbraw/zinc/18/36/26/638183626.db2.gz WALBJKFEALQCQF-UHFFFAOYSA-N 1 2 308.769 2.052 20 10 DECDLO CN(C)c1cc(F)c(C[N@@H+]2CCNC(=O)CC23CCC3)cc1F ZINC000895926705 638270235 /nfs/dbraw/zinc/27/02/35/638270235.db2.gz CDNLNLHKOMZXGO-UHFFFAOYSA-N 1 2 323.387 2.275 20 10 DECDLO CN(C)c1cc(F)c(C[N@H+]2CCNC(=O)CC23CCC3)cc1F ZINC000895926705 638270238 /nfs/dbraw/zinc/27/02/38/638270238.db2.gz CDNLNLHKOMZXGO-UHFFFAOYSA-N 1 2 323.387 2.275 20 10 DECDLO CCO[C@H]1COCC[C@H]1[NH2+]Cc1cc(Cl)cc(F)c1O ZINC000761223927 640287553 /nfs/dbraw/zinc/28/75/53/640287553.db2.gz VGIWSPWIBQRIFL-OLZOCXBDSA-N 1 2 303.761 2.468 20 10 DECDLO CCn1cncc1C[NH+]1CCN(c2ccc(OC)c(F)c2)CC1 ZINC000841847682 650577807 /nfs/dbraw/zinc/57/78/07/650577807.db2.gz GWCGYEGRTDONJT-UHFFFAOYSA-N 1 2 318.396 2.373 20 10 DECDLO Oc1c(Cl)cccc1C[NH2+]Cc1cn(C[C@@H]2CCCO2)nn1 ZINC000898216283 641050187 /nfs/dbraw/zinc/05/01/87/641050187.db2.gz WTVRBNGMQRIYJT-ZDUSSCGKSA-N 1 2 322.796 2.106 20 10 DECDLO COC(=O)[C@H]1[C@@H](C[NH2+]Cc2cccc(Cl)c2O)C1(F)F ZINC000898218206 641050875 /nfs/dbraw/zinc/05/08/75/641050875.db2.gz AUEYVURVBZZABI-PSASIEDQSA-N 1 2 305.708 2.190 20 10 DECDLO COC(=O)[C@@H]1[C@@H](C[NH2+]Cc2cccc(Cl)c2O)C1(F)F ZINC000898218207 641051363 /nfs/dbraw/zinc/05/13/63/641051363.db2.gz AUEYVURVBZZABI-SCZZXKLOSA-N 1 2 305.708 2.190 20 10 DECDLO O=C(N1CCCC1)N1CC[NH+](Cc2cc(Cl)ccc2O)CC1 ZINC000768227610 641060203 /nfs/dbraw/zinc/06/02/03/641060203.db2.gz RXAJTRAUFLEOEF-UHFFFAOYSA-N 1 2 323.824 2.379 20 10 DECDLO CCOc1ccc(C[N@H+](C)Cc2nnc3ccccn32)c(O)c1 ZINC000769202396 641193043 /nfs/dbraw/zinc/19/30/43/641193043.db2.gz JPTCZRPNKRXXCW-UHFFFAOYSA-N 1 2 312.373 2.466 20 10 DECDLO CCOc1ccc(C[N@@H+](C)Cc2nnc3ccccn32)c(O)c1 ZINC000769202396 641193046 /nfs/dbraw/zinc/19/30/46/641193046.db2.gz JPTCZRPNKRXXCW-UHFFFAOYSA-N 1 2 312.373 2.466 20 10 DECDLO Oc1c(F)cc(Cl)cc1C[NH2+]CC1(N2CCOCC2)CC1 ZINC000775157584 642012360 /nfs/dbraw/zinc/01/23/60/642012360.db2.gz SURMREOULOGRJB-UHFFFAOYSA-N 1 2 314.788 2.139 20 10 DECDLO CCOc1cccc(C[N@@H+]2CCN(CC(C)C)C(=O)[C@@H]2C)c1O ZINC000779202590 642471929 /nfs/dbraw/zinc/47/19/29/642471929.db2.gz PGTUNPDIEIRPOE-AWEZNQCLSA-N 1 2 320.433 2.480 20 10 DECDLO CCOc1cccc(C[N@H+]2CCN(CC(C)C)C(=O)[C@@H]2C)c1O ZINC000779202590 642471931 /nfs/dbraw/zinc/47/19/31/642471931.db2.gz PGTUNPDIEIRPOE-AWEZNQCLSA-N 1 2 320.433 2.480 20 10 DECDLO Oc1ccccc1C[NH2+]Cc1ncn(Cc2cccc(F)c2)n1 ZINC000780590294 642647091 /nfs/dbraw/zinc/64/70/91/642647091.db2.gz LHYFRBHNQAAANG-UHFFFAOYSA-N 1 2 312.348 2.461 20 10 DECDLO Cc1cc(C)c(O)c(C[N@H+](C)Cc2ncnn2CC(F)F)c1 ZINC000782981425 642950627 /nfs/dbraw/zinc/95/06/27/642950627.db2.gz QVKFFBHSDJNFLM-UHFFFAOYSA-N 1 2 310.348 2.498 20 10 DECDLO Cc1cc(C)c(O)c(C[N@@H+](C)Cc2ncnn2CC(F)F)c1 ZINC000782981425 642950630 /nfs/dbraw/zinc/95/06/30/642950630.db2.gz QVKFFBHSDJNFLM-UHFFFAOYSA-N 1 2 310.348 2.498 20 10 DECDLO COCC[N@H+](Cc1ccnn1C)Cc1cccc(Cl)c1O ZINC000787332558 643483673 /nfs/dbraw/zinc/48/36/73/643483673.db2.gz QFDYHKVJCOZNCE-UHFFFAOYSA-N 1 2 309.797 2.428 20 10 DECDLO COCC[N@@H+](Cc1ccnn1C)Cc1cccc(Cl)c1O ZINC000787332558 643483683 /nfs/dbraw/zinc/48/36/83/643483683.db2.gz QFDYHKVJCOZNCE-UHFFFAOYSA-N 1 2 309.797 2.428 20 10 DECDLO CC(C)(C[NH2+]Cc1cc(Cl)cc(F)c1O)[C@@]1(O)CCOC1 ZINC000843427887 650973264 /nfs/dbraw/zinc/97/32/64/650973264.db2.gz BEDIOLCYVSEANO-OAHLLOKOSA-N 1 2 317.788 2.452 20 10 DECDLO CS(=O)(=O)CCCC[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000822494595 648219656 /nfs/dbraw/zinc/21/96/56/648219656.db2.gz RTASMWUSYCJMMY-UHFFFAOYSA-N 1 2 309.790 2.099 20 10 DECDLO CCOC(=O)C[N@@H+](Cc1ccccc1O)C[C@H]1CC[C@@H](C)O1 ZINC000823576808 648445333 /nfs/dbraw/zinc/44/53/33/648445333.db2.gz ZZFAINLDFDADNA-UKRRQHHQSA-N 1 2 307.390 2.325 20 10 DECDLO CCOC(=O)C[N@H+](Cc1ccccc1O)C[C@H]1CC[C@@H](C)O1 ZINC000823576808 648445336 /nfs/dbraw/zinc/44/53/36/648445336.db2.gz ZZFAINLDFDADNA-UKRRQHHQSA-N 1 2 307.390 2.325 20 10 DECDLO C[C@H]1CC[C@@H]([NH2+]Cc2cc(Cl)cc(F)c2O)CS1(=O)=O ZINC000827169968 648985912 /nfs/dbraw/zinc/98/59/12/648985912.db2.gz GZNUZIJDHUQHPM-GZMMTYOYSA-N 1 2 321.801 2.240 20 10 DECDLO CC[C@@H](C(=O)N[C@H](C)c1ccccc1O)[N@@H+]1CCO[C@@H](CC)C1 ZINC000827946684 649109638 /nfs/dbraw/zinc/10/96/38/649109638.db2.gz OLOCEEWFLPSXDB-YCPHGPKFSA-N 1 2 320.433 2.459 20 10 DECDLO CC[C@@H](C(=O)N[C@H](C)c1ccccc1O)[N@H+]1CCO[C@@H](CC)C1 ZINC000827946684 649109639 /nfs/dbraw/zinc/10/96/39/649109639.db2.gz OLOCEEWFLPSXDB-YCPHGPKFSA-N 1 2 320.433 2.459 20 10 DECDLO C[C@@H]([NH2+]CC[C@@]1(O)CCCOC1)c1cc(F)cc(F)c1O ZINC000846210646 651315420 /nfs/dbraw/zinc/31/54/20/651315420.db2.gz AOLIYYMSMRYYPH-BMIGLBTASA-N 1 2 301.333 2.253 20 10 DECDLO C[C@H]([NH2+][C@@H]1CCc2c(nnn2C)C1)c1cc(F)cc(F)c1O ZINC000848564006 651471528 /nfs/dbraw/zinc/47/15/28/651471528.db2.gz GRPMTEDDPRZREP-WCBMZHEXSA-N 1 2 308.332 2.007 20 10 DECDLO CCc1cccc(C[N@@H+]2CCO[C@@H](C(=O)OC(C)(C)C)C2)c1O ZINC000848887740 651546308 /nfs/dbraw/zinc/54/63/08/651546308.db2.gz CVUWMHBMQKOQNX-OAHLLOKOSA-N 1 2 321.417 2.497 20 10 DECDLO CCc1cccc(C[N@H+]2CCO[C@@H](C(=O)OC(C)(C)C)C2)c1O ZINC000848887740 651546311 /nfs/dbraw/zinc/54/63/11/651546311.db2.gz CVUWMHBMQKOQNX-OAHLLOKOSA-N 1 2 321.417 2.497 20 10 DECDLO COc1cc(C[NH+]2CCN(c3ccc(OC)cc3)CC2)sn1 ZINC000851713580 652213116 /nfs/dbraw/zinc/21/31/16/652213116.db2.gz GDMPKWCCSHIXIQ-UHFFFAOYSA-N 1 2 319.430 2.483 20 10 DECDLO CC[C@H]([NH2+][C@H](C)C(=O)N(C)OC)c1cccc(Cl)c1O ZINC000858587168 685563240 /nfs/dbraw/zinc/56/32/40/685563240.db2.gz JEXSFAGZOHGDTA-SKDRFNHKSA-N 1 2 300.786 2.495 20 10 DECDLO C[S@@](=O)CCC[NH2+]Cc1cccc(Br)c1O ZINC000116918455 684067056 /nfs/dbraw/zinc/06/70/56/684067056.db2.gz YDPLBEALWRAWLA-INIZCTEOSA-N 1 2 306.225 2.013 20 10 DECDLO Cn1c[nH+]cc1CCC(=O)NCc1c(O)ccc2c1CCCC2 ZINC000193597235 685044815 /nfs/dbraw/zinc/04/48/15/685044815.db2.gz LSLOINKPDIFZSU-UHFFFAOYSA-N 1 2 313.401 2.254 20 10 DECDLO CCN(CC)c1ccc(C[N@@H+]2C[C@@H](C)O[C@@H](CO)C2)cc1F ZINC000249436274 685179843 /nfs/dbraw/zinc/17/98/43/685179843.db2.gz SHCIHJPGXVOKKD-UKRRQHHQSA-N 1 2 310.413 2.254 20 10 DECDLO CCN(CC)c1ccc(C[N@H+]2C[C@@H](C)O[C@@H](CO)C2)cc1F ZINC000249436274 685179847 /nfs/dbraw/zinc/17/98/47/685179847.db2.gz SHCIHJPGXVOKKD-UKRRQHHQSA-N 1 2 310.413 2.254 20 10 DECDLO C[C@H]([NH2+]Cc1nnc(C2CCOCC2)[nH]1)c1ccc(F)cc1O ZINC000866440510 687574239 /nfs/dbraw/zinc/57/42/39/687574239.db2.gz GVSXOQBYZUWGKZ-JTQLQIEISA-N 1 2 320.368 2.394 20 10 DECDLO COCC(C)(C)[NH+]1CCN(Cc2ccc(F)c(F)c2O)CC1 ZINC000877597437 690162740 /nfs/dbraw/zinc/16/27/40/690162740.db2.gz MCEGZJYTJYXTHN-UHFFFAOYSA-N 1 2 314.376 2.213 20 10 DECDLO C[C@H]([NH2+][C@@H]1CC(=O)N(CC2CC2)C1)c1cc(F)cc(F)c1O ZINC000883395189 691496047 /nfs/dbraw/zinc/49/60/47/691496047.db2.gz PBQOPFJKXCNJIN-JOYOIKCWSA-N 1 2 310.344 2.332 20 10 DECDLO NC(=O)N=Nc1ccc(C(=O)NCc2ccn3cc[nH+]c3c2)cc1 ZINC001445956788 1184148478 /nfs/dbraw/zinc/14/84/78/1184148478.db2.gz ZGESMNSJLAPPKO-UHFFFAOYSA-N 1 2 322.328 2.427 20 10 DECDLO C[C@@H]1CC[N@H+](Cc2cc(Br)c(F)cc2O)C[C@@H]1O ZINC001144298332 790845589 /nfs/dbraw/zinc/84/55/89/790845589.db2.gz BRRDZLNXHJINSB-OQPBUACISA-N 1 2 318.186 2.497 20 10 DECDLO C[C@@H]1CC[N@@H+](Cc2cc(Br)c(F)cc2O)C[C@@H]1O ZINC001144298332 790845600 /nfs/dbraw/zinc/84/56/00/790845600.db2.gz BRRDZLNXHJINSB-OQPBUACISA-N 1 2 318.186 2.497 20 10 DECDLO COC[C@H](C[NH2+]Cc1cc(Br)cc(F)c1O)OC ZINC000715743858 792509807 /nfs/dbraw/zinc/50/98/07/792509807.db2.gz CHQZYNVSXXPJLD-JTQLQIEISA-N 1 2 322.174 2.045 20 10 DECDLO O=C(Cc1c[nH]c[nH+]1)NCc1cc(Cl)c2cccnc2c1O ZINC001176836687 794510573 /nfs/dbraw/zinc/51/05/73/794510573.db2.gz OCUBJXZAJXYMLP-UHFFFAOYSA-N 1 2 316.748 2.176 20 10 DECDLO COC(=O)N1CCC[N@H+](Cc2c(O)ccc(Cl)c2F)CC1 ZINC001116752378 794983786 /nfs/dbraw/zinc/98/37/86/794983786.db2.gz FZOVXXKSAZDJHE-UHFFFAOYSA-N 1 2 316.760 2.459 20 10 DECDLO COC(=O)N1CCC[N@@H+](Cc2c(O)ccc(Cl)c2F)CC1 ZINC001116752378 794983790 /nfs/dbraw/zinc/98/37/90/794983790.db2.gz FZOVXXKSAZDJHE-UHFFFAOYSA-N 1 2 316.760 2.459 20 10 DECDLO CN(C)c1cc(F)c(C[NH2+]Cc2cc(C(N)=O)co2)cc1F ZINC001118804269 795228603 /nfs/dbraw/zinc/22/86/03/795228603.db2.gz FCLABRFPNZLQGL-UHFFFAOYSA-N 1 2 309.316 2.013 20 10 DECDLO CCN(CC)c1ccc(C[NH+]2CC(N(C)C(C)=O)C2)c(OC)c1 ZINC001138390350 796210008 /nfs/dbraw/zinc/21/00/08/796210008.db2.gz SEJPBJQCDKXUOQ-UHFFFAOYSA-N 1 2 319.449 2.204 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CCC2(COC2)C1 ZINC001139125120 796326730 /nfs/dbraw/zinc/32/67/30/796326730.db2.gz MREHBWUSIPSQSD-UHFFFAOYSA-N 1 2 301.342 2.029 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CCC2(COC2)C1 ZINC001139125120 796326734 /nfs/dbraw/zinc/32/67/34/796326734.db2.gz MREHBWUSIPSQSD-UHFFFAOYSA-N 1 2 301.342 2.029 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CC[C@@](C)(O)[C@H](C)C1 ZINC001139126711 796327595 /nfs/dbraw/zinc/32/75/95/796327595.db2.gz NOILWTLGRKAKDA-KZULUSFZSA-N 1 2 317.385 2.400 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CC[C@@](C)(O)[C@H](C)C1 ZINC001139126711 796327602 /nfs/dbraw/zinc/32/76/02/796327602.db2.gz NOILWTLGRKAKDA-KZULUSFZSA-N 1 2 317.385 2.400 20 10 DECDLO CO[C@@H]1CCC[N@H+](Cc2c(O)ccc3c(C)cc(=O)oc32)C1 ZINC001139126714 796327895 /nfs/dbraw/zinc/32/78/95/796327895.db2.gz NQDVDMQSWLMXBW-GFCCVEGCSA-N 1 2 303.358 2.418 20 10 DECDLO CO[C@@H]1CCC[N@@H+](Cc2c(O)ccc3c(C)cc(=O)oc32)C1 ZINC001139126714 796327897 /nfs/dbraw/zinc/32/78/97/796327897.db2.gz NQDVDMQSWLMXBW-GFCCVEGCSA-N 1 2 303.358 2.418 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1[C@@H](C)CC[C@H]1CO ZINC001139126790 796328342 /nfs/dbraw/zinc/32/83/42/796328342.db2.gz QBSPRUGNLVYJAR-RYUDHWBXSA-N 1 2 303.358 2.152 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1[C@@H](C)CC[C@H]1CO ZINC001139126790 796328345 /nfs/dbraw/zinc/32/83/45/796328345.db2.gz QBSPRUGNLVYJAR-RYUDHWBXSA-N 1 2 303.358 2.152 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1C[C@@H]2CCO[C@@H]2C1 ZINC001139129676 796328614 /nfs/dbraw/zinc/32/86/14/796328614.db2.gz CGSLNODJRHMGCH-XHDPSFHLSA-N 1 2 301.342 2.028 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1C[C@@H]2CCO[C@@H]2C1 ZINC001139129676 796328618 /nfs/dbraw/zinc/32/86/18/796328618.db2.gz CGSLNODJRHMGCH-XHDPSFHLSA-N 1 2 301.342 2.028 20 10 DECDLO CC[N@H+](Cc1ccc(S(C)(=O)=O)nc1)Cc1ccccc1O ZINC001139636164 796405590 /nfs/dbraw/zinc/40/55/90/796405590.db2.gz GLSAXYYOJBIZFJ-UHFFFAOYSA-N 1 2 320.414 2.213 20 10 DECDLO CC[N@@H+](Cc1ccc(S(C)(=O)=O)nc1)Cc1ccccc1O ZINC001139636164 796405593 /nfs/dbraw/zinc/40/55/93/796405593.db2.gz GLSAXYYOJBIZFJ-UHFFFAOYSA-N 1 2 320.414 2.213 20 10 DECDLO OC[C@]1(C(F)(F)F)CC[N@H+](Cc2c(O)cc(F)cc2F)C1 ZINC001140583016 796541117 /nfs/dbraw/zinc/54/11/17/796541117.db2.gz TVRIVDKDHCOIFR-LBPRGKRZSA-N 1 2 311.250 2.417 20 10 DECDLO OC[C@]1(C(F)(F)F)CC[N@@H+](Cc2c(O)cc(F)cc2F)C1 ZINC001140583016 796541119 /nfs/dbraw/zinc/54/11/19/796541119.db2.gz TVRIVDKDHCOIFR-LBPRGKRZSA-N 1 2 311.250 2.417 20 10 DECDLO Oc1cc(F)cc(F)c1C[N@@H+]1CC[C@@H](Oc2ncccn2)C1 ZINC001140585236 796541865 /nfs/dbraw/zinc/54/18/65/796541865.db2.gz AOYZIUUFUWMUQV-LLVKDONJSA-N 1 2 307.300 2.114 20 10 DECDLO Oc1cc(F)cc(F)c1C[N@H+]1CC[C@@H](Oc2ncccn2)C1 ZINC001140585236 796541868 /nfs/dbraw/zinc/54/18/68/796541868.db2.gz AOYZIUUFUWMUQV-LLVKDONJSA-N 1 2 307.300 2.114 20 10 DECDLO CCOC(=O)NC1CC[NH+](Cc2c(O)cc(F)cc2F)CC1 ZINC001140585601 796541959 /nfs/dbraw/zinc/54/19/59/796541959.db2.gz PERFRSNTNRHSKQ-UHFFFAOYSA-N 1 2 314.332 2.381 20 10 DECDLO Cc1cnc(N2CC[NH+](Cc3cc(F)c(F)cc3O)CC2)nc1 ZINC001142531285 796748102 /nfs/dbraw/zinc/74/81/02/796748102.db2.gz SDRAWQVBGPKXFN-UHFFFAOYSA-N 1 2 320.343 2.091 20 10 DECDLO CCOC(=O)C1C[NH+](Cc2cc(Br)ccc2O)C1 ZINC001203642432 800098171 /nfs/dbraw/zinc/09/81/71/800098171.db2.gz HGHPQKRSSPVJSC-UHFFFAOYSA-N 1 2 314.179 2.150 20 10 DECDLO CN1CC2(CC1=O)CC[NH+](Cc1cccc(Cl)c1O)CC2 ZINC001231914567 801749706 /nfs/dbraw/zinc/74/97/06/801749706.db2.gz OEHIWDHBLAHNSO-UHFFFAOYSA-N 1 2 308.809 2.490 20 10 DECDLO COc1cc(O)c(C[N@H+]2C[C@@H](F)C[C@H](CO)C2)cc1Cl ZINC001232266072 801833148 /nfs/dbraw/zinc/83/31/48/801833148.db2.gz IJDKZZZFIMMIAZ-ONGXEEELSA-N 1 2 303.761 2.207 20 10 DECDLO CN(C)c1ccc(C[N@@H+]2CCc3nc(Cl)ncc3C2)c(O)c1 ZINC001232839831 801969773 /nfs/dbraw/zinc/96/97/73/801969773.db2.gz WWDSBULLARPNGA-UHFFFAOYSA-N 1 2 318.808 2.460 20 10 DECDLO CN(C)c1ccc(C[N@H+]2CCc3nc(Cl)ncc3C2)c(O)c1 ZINC001232839831 801969777 /nfs/dbraw/zinc/96/97/77/801969777.db2.gz WWDSBULLARPNGA-UHFFFAOYSA-N 1 2 318.808 2.460 20 10 DECDLO COc1ccc2c(c1)C[N@@H+](Cc1cc(O)c(O)c(O)c1)CC2 ZINC001233010889 802002559 /nfs/dbraw/zinc/00/25/59/802002559.db2.gz WPSGKKRYJDIZBS-UHFFFAOYSA-N 1 2 301.342 2.370 20 10 DECDLO COc1ccc2c(c1)C[N@H+](Cc1cc(O)c(O)c(O)c1)CC2 ZINC001233010889 802002566 /nfs/dbraw/zinc/00/25/66/802002566.db2.gz WPSGKKRYJDIZBS-UHFFFAOYSA-N 1 2 301.342 2.370 20 10 DECDLO C[C@@H]1C[C@@H](O)C[N@@H+]1Cc1c(O)cc(Br)cc1F ZINC001233027644 802005987 /nfs/dbraw/zinc/00/59/87/802005987.db2.gz VXJKICXFEGDGBV-VXNVDRBHSA-N 1 2 304.159 2.249 20 10 DECDLO C[C@@H]1C[C@@H](O)C[N@H+]1Cc1c(O)cc(Br)cc1F ZINC001233027644 802005994 /nfs/dbraw/zinc/00/59/94/802005994.db2.gz VXJKICXFEGDGBV-VXNVDRBHSA-N 1 2 304.159 2.249 20 10 DECDLO Cc1cncnc1O[C@@H]1CC[N@H+](Cc2ccc(F)c(F)c2O)C1 ZINC001233079683 802022615 /nfs/dbraw/zinc/02/26/15/802022615.db2.gz KDJSAVZNZZLMAD-GFCCVEGCSA-N 1 2 321.327 2.422 20 10 DECDLO O=C1OC[C@H]2C[N@@H+](Cc3cccc(C(F)(F)F)c3O)CCN12 ZINC001233418314 802112549 /nfs/dbraw/zinc/11/25/49/802112549.db2.gz BFAPLSLCEVTWHI-SNVBAGLBSA-N 1 2 316.279 2.047 20 10 DECDLO CC(C)(C)[C@H](Cn1cc[nH+]c1)NC(=O)Cc1ccc(N)cc1 ZINC000315918968 802491049 /nfs/dbraw/zinc/49/10/49/802491049.db2.gz SZMMLJIWKIUWEZ-HNNXBMFYSA-N 1 2 300.406 2.239 20 10 DECDLO C[C@H](C[NH2+][C@@H](C)c1cccc(-c2nn[nH]n2)c1O)c1ccncc1 ZINC001603551787 1069986362 /nfs/dbraw/zinc/98/63/62/1069986362.db2.gz GGXWVCHBZXVJJV-NEPJUHHUSA-N 1 2 324.388 2.422 20 10 DECDLO CCC(CC)[C@H](O)C[NH2+][C@H](C)c1cccc(-c2nn[nH]n2)c1O ZINC001604023735 1070179474 /nfs/dbraw/zinc/17/94/74/1070179474.db2.gz ZXKLKHYXQDHEQJ-QMTHXVAHSA-N 1 2 319.409 2.020 20 10 DECDLO Cc1cc(C[NH2+][C@H](C)c2cccc(-c3nn[nH]n3)c2O)cc(C)n1 ZINC001605660835 1070801521 /nfs/dbraw/zinc/80/15/21/1070801521.db2.gz IZTXHPXGYZUTFQ-GFCCVEGCSA-N 1 2 324.388 2.435 20 10 DECDLO Cc1ncccc1CC[NH2+][C@H](C)c1cccc(-c2nn[nH]n2)c1O ZINC001606098488 1071041523 /nfs/dbraw/zinc/04/15/23/1071041523.db2.gz YEHDJLUIDHJELI-GFCCVEGCSA-N 1 2 324.388 2.169 20 10 DECDLO C[C@]1(O)CC[N@H+](Cc2cc(Br)cc(F)c2O)C1 ZINC001235058000 1079006416 /nfs/dbraw/zinc/00/64/16/1079006416.db2.gz GVILYBIHTQDOKA-LBPRGKRZSA-N 1 2 304.159 2.251 20 10 DECDLO C[C@]1(O)CC[N@@H+](Cc2cc(Br)cc(F)c2O)C1 ZINC001235058000 1079006424 /nfs/dbraw/zinc/00/64/24/1079006424.db2.gz GVILYBIHTQDOKA-LBPRGKRZSA-N 1 2 304.159 2.251 20 10 DECDLO C[C@H]([NH2+][C@@H](CO)CC(C)(C)C)c1cccc(-c2nn[nH]n2)c1O ZINC001589953885 1076534420 /nfs/dbraw/zinc/53/44/20/1076534420.db2.gz WTLXHVOTMOKNKT-WDEREUQCSA-N 1 2 319.409 2.020 20 10 DECDLO C[C@H]([NH2+]C[C@H]1CCC[C@@H](C)O1)c1cccc(-c2nn[nH]n2)c1O ZINC001590244327 1076597403 /nfs/dbraw/zinc/59/74/03/1076597403.db2.gz TWANHOJGNSUIMK-GRYCIOLGSA-N 1 2 317.393 2.181 20 10 DECDLO CC[C@H](C)[C@H](C[NH2+][C@H](C)c1cccc(-c2nn[nH]n2)c1O)OC ZINC001590401747 1076621680 /nfs/dbraw/zinc/62/16/80/1076621680.db2.gz XAAGWLUGFVXTKC-WDMOLILDSA-N 1 2 319.409 2.284 20 10 DECDLO COCCCCC[NH2+][C@@H](C)c1cccc(-c2nn[nH]n2)c1O ZINC001591410657 1076742349 /nfs/dbraw/zinc/74/23/49/1076742349.db2.gz FXNCJDGXGBECIQ-NSHDSACASA-N 1 2 305.382 2.040 20 10 DECDLO CN(C)c1ccc(C[NH2+][C@@H](C(N)=O)c2ccc(F)cc2)cc1F ZINC001662156966 1080574924 /nfs/dbraw/zinc/57/49/24/1080574924.db2.gz UNJJLLJNERWDSF-MRXNPFEDSA-N 1 2 319.355 2.347 20 10 DECDLO OCC1CC[NH+](Cc2cc(F)cc(Br)c2O)CC1 ZINC001235293623 1084375343 /nfs/dbraw/zinc/37/53/43/1084375343.db2.gz JYAOKZSZDWICAV-UHFFFAOYSA-N 1 2 318.186 2.498 20 10 DECDLO C[N@H+]1C[C@@H]2C[C@H]1CN2Cc1cc(F)cc(Br)c1O ZINC001235303589 1084381506 /nfs/dbraw/zinc/38/15/06/1084381506.db2.gz OPNOUFKACFTEFP-QWRGUYRKSA-N 1 2 315.186 2.182 20 10 DECDLO OCc1ncn2c1C[N@H+](Cc1ccc3ccccc3c1O)CC2 ZINC001235508618 1084451785 /nfs/dbraw/zinc/45/17/85/1084451785.db2.gz WQGWUTMYIAKGEN-UHFFFAOYSA-N 1 2 309.369 2.250 20 10 DECDLO OCc1ncn2c1C[N@@H+](Cc1ccc3ccccc3c1O)CC2 ZINC001235508618 1084451789 /nfs/dbraw/zinc/45/17/89/1084451789.db2.gz WQGWUTMYIAKGEN-UHFFFAOYSA-N 1 2 309.369 2.250 20 10 DECDLO Oc1cccc(F)c1C[N@@H+]1C[C@@H]2COC[C@H](C1)N2C1CCCC1 ZINC001276358779 1089239043 /nfs/dbraw/zinc/23/90/43/1089239043.db2.gz ASVRBVYPVKJIEM-GASCZTMLSA-N 1 2 320.408 2.359 20 10 DECDLO Oc1cccc(F)c1C[N@H+]1C[C@@H]2COC[C@H](C1)N2C1CCCC1 ZINC001276358779 1089239057 /nfs/dbraw/zinc/23/90/57/1089239057.db2.gz ASVRBVYPVKJIEM-GASCZTMLSA-N 1 2 320.408 2.359 20 10 DECDLO CC(C)NC(=O)N1CCC12C[NH+](Cc1cc(Cl)ccc1O)C2 ZINC001275276656 1091647831 /nfs/dbraw/zinc/64/78/31/1091647831.db2.gz NXMSQPHSDNSYNP-UHFFFAOYSA-N 1 2 323.824 2.424 20 10 DECDLO C[N@H+](Cc1cnccn1)Cc1cc(O)c(Br)cc1O ZINC001236770109 1138422844 /nfs/dbraw/zinc/42/28/44/1138422844.db2.gz DVNZOUNBCRTXME-UHFFFAOYSA-N 1 2 324.178 2.282 20 10 DECDLO C[N@@H+](Cc1cnccn1)Cc1cc(O)c(Br)cc1O ZINC001236770109 1138422854 /nfs/dbraw/zinc/42/28/54/1138422854.db2.gz DVNZOUNBCRTXME-UHFFFAOYSA-N 1 2 324.178 2.282 20 10 DECDLO COC(=O)[C@]1(F)CC[N@H+](Cc2c(O)cc(OC)cc2Cl)C1 ZINC001236798020 1138432149 /nfs/dbraw/zinc/43/21/49/1138432149.db2.gz KKUDGMTXIVRAPP-AWEZNQCLSA-N 1 2 317.744 2.141 20 10 DECDLO COC(=O)[C@]1(F)CC[N@@H+](Cc2c(O)cc(OC)cc2Cl)C1 ZINC001236798020 1138432157 /nfs/dbraw/zinc/43/21/57/1138432157.db2.gz KKUDGMTXIVRAPP-AWEZNQCLSA-N 1 2 317.744 2.141 20 10 DECDLO NC(=O)[C@H]1CCCC[N@@H+]1Cc1c(O)cccc1OC(F)(F)F ZINC001237111986 1138506400 /nfs/dbraw/zinc/50/64/00/1138506400.db2.gz XHUCRNRZRRCEID-SNVBAGLBSA-N 1 2 318.295 2.131 20 10 DECDLO NC(=O)[C@H]1CCCC[N@H+]1Cc1c(O)cccc1OC(F)(F)F ZINC001237111986 1138506406 /nfs/dbraw/zinc/50/64/06/1138506406.db2.gz XHUCRNRZRRCEID-SNVBAGLBSA-N 1 2 318.295 2.131 20 10 DECDLO C[N@H+](C1CN(Cc2cc(F)cc(Cl)c2O)C1)[C@H]1CCOC1 ZINC001237799164 1138790668 /nfs/dbraw/zinc/79/06/68/1138790668.db2.gz OQCOIWCPEDJLMS-LBPRGKRZSA-N 1 2 314.788 2.090 20 10 DECDLO C[N@@H+](C1CN(Cc2cc(F)cc(Cl)c2O)C1)[C@H]1CCOC1 ZINC001237799164 1138790679 /nfs/dbraw/zinc/79/06/79/1138790679.db2.gz OQCOIWCPEDJLMS-LBPRGKRZSA-N 1 2 314.788 2.090 20 10 DECDLO CN(C)C(=O)[C@@H]1CCC[N@H+](Cc2cc(F)cc(Cl)c2O)C1 ZINC001237811553 1138799774 /nfs/dbraw/zinc/79/97/74/1138799774.db2.gz ANVVSILVEIFQOW-SNVBAGLBSA-N 1 2 314.788 2.485 20 10 DECDLO CN(C)C(=O)[C@@H]1CCC[N@@H+](Cc2cc(F)cc(Cl)c2O)C1 ZINC001237811553 1138799782 /nfs/dbraw/zinc/79/97/82/1138799782.db2.gz ANVVSILVEIFQOW-SNVBAGLBSA-N 1 2 314.788 2.485 20 10 DECDLO CC[N@@H+](Cc1cnn(C)c1)Cc1cc(F)cc(C(C)=O)c1O ZINC000079409058 185169452 /nfs/dbraw/zinc/16/94/52/185169452.db2.gz QJIXEHVLXMZVEV-UHFFFAOYSA-N 1 2 305.353 2.490 20 10 DECDLO COc1cccc(C[N@@H+]2CCNC(=O)[C@H]2c2ccccc2)c1O ZINC000092675814 185332882 /nfs/dbraw/zinc/33/28/82/185332882.db2.gz WNDKEDYNHZSFIP-MRXNPFEDSA-N 1 2 312.369 2.074 20 10 DECDLO COc1cccc(C[N@H+]2CCNC(=O)[C@H]2c2ccccc2)c1O ZINC000092675814 185332883 /nfs/dbraw/zinc/33/28/83/185332883.db2.gz WNDKEDYNHZSFIP-MRXNPFEDSA-N 1 2 312.369 2.074 20 10 DECDLO COC(=O)C[N@H+](Cc1cc(Cl)ccc1O)C[C@@H](C)OC ZINC000182335086 291080610 /nfs/dbraw/zinc/08/06/10/291080610.db2.gz PQSDDQCYRBCJLB-SNVBAGLBSA-N 1 2 301.770 2.056 20 10 DECDLO COC(=O)C[N@@H+](Cc1cc(Cl)ccc1O)C[C@@H](C)OC ZINC000182335086 291080612 /nfs/dbraw/zinc/08/06/12/291080612.db2.gz PQSDDQCYRBCJLB-SNVBAGLBSA-N 1 2 301.770 2.056 20 10 DECDLO C[N@H+](Cc1cc(Cl)cc(Cl)c1O)CC(C)(CO)CO ZINC000093502722 193259965 /nfs/dbraw/zinc/25/99/65/193259965.db2.gz YFTJTBOJNYEZSD-UHFFFAOYSA-N 1 2 308.205 2.122 20 10 DECDLO C[N@@H+](Cc1cc(Cl)cc(Cl)c1O)CC(C)(CO)CO ZINC000093502722 193259967 /nfs/dbraw/zinc/25/99/67/193259967.db2.gz YFTJTBOJNYEZSD-UHFFFAOYSA-N 1 2 308.205 2.122 20 10 DECDLO COC[C@]1(C(=O)OC)CC[N@H+](Cc2cccc(Cl)c2O)C1 ZINC000294923319 533218340 /nfs/dbraw/zinc/21/83/40/533218340.db2.gz BBXXFILBSXKKSX-HNNXBMFYSA-N 1 2 313.781 2.057 20 10 DECDLO COC[C@]1(C(=O)OC)CC[N@@H+](Cc2cccc(Cl)c2O)C1 ZINC000294923319 533218345 /nfs/dbraw/zinc/21/83/45/533218345.db2.gz BBXXFILBSXKKSX-HNNXBMFYSA-N 1 2 313.781 2.057 20 10 DECDLO CCC[N@H+](CC(=O)OC)Cc1cc(Cl)cc(OC)c1O ZINC000184670299 402290461 /nfs/dbraw/zinc/29/04/61/402290461.db2.gz UBWCLZNIWOCFSW-UHFFFAOYSA-N 1 2 301.770 2.439 20 10 DECDLO CCC[N@@H+](CC(=O)OC)Cc1cc(Cl)cc(OC)c1O ZINC000184670299 402290463 /nfs/dbraw/zinc/29/04/63/402290463.db2.gz UBWCLZNIWOCFSW-UHFFFAOYSA-N 1 2 301.770 2.439 20 10 DECDLO COCCCN(C)CC[NH2+][C@@H](C)c1ccc(F)c(F)c1O ZINC000187735260 402510246 /nfs/dbraw/zinc/51/02/46/402510246.db2.gz ODTNZCCMJVSJJX-NSHDSACASA-N 1 2 302.365 2.289 20 10 DECDLO C[C@@H]1C[N@H+](Cc2c(O)ccc(Cl)c2F)CC[S@@](=O)C1 ZINC000365446204 404662960 /nfs/dbraw/zinc/66/29/60/404662960.db2.gz HKFIVWIKUXAVBY-AYLIAGHASA-N 1 2 305.802 2.385 20 10 DECDLO C[C@@H]1C[N@@H+](Cc2c(O)ccc(Cl)c2F)CC[S@@](=O)C1 ZINC000365446204 404662964 /nfs/dbraw/zinc/66/29/64/404662964.db2.gz HKFIVWIKUXAVBY-AYLIAGHASA-N 1 2 305.802 2.385 20 10 DECDLO NC(=O)[C@@H]1c2ccccc2CC[N@H+]1Cc1cc(F)ccc1O ZINC000361053062 404895319 /nfs/dbraw/zinc/89/53/19/404895319.db2.gz PLKAESIYYVLRFG-INIZCTEOSA-N 1 2 300.333 2.116 20 10 DECDLO NC(=O)[C@@H]1c2ccccc2CC[N@@H+]1Cc1cc(F)ccc1O ZINC000361053062 404895325 /nfs/dbraw/zinc/89/53/25/404895325.db2.gz PLKAESIYYVLRFG-INIZCTEOSA-N 1 2 300.333 2.116 20 10 DECDLO C[N@@H+]1CCC[C@H](N2CC[NH+](Cc3cccc(Cl)c3[O-])CC2)C1 ZINC000367718473 405134124 /nfs/dbraw/zinc/13/41/24/405134124.db2.gz HEGNJMMMRSDSQJ-HNNXBMFYSA-N 1 2 323.868 2.257 20 10 DECDLO C[N@H+]1CCC[C@H](N2CC[NH+](Cc3cccc(Cl)c3[O-])CC2)C1 ZINC000367718473 405134129 /nfs/dbraw/zinc/13/41/29/405134129.db2.gz HEGNJMMMRSDSQJ-HNNXBMFYSA-N 1 2 323.868 2.257 20 10 DECDLO O=S1(=O)C[C@@H]([NH2+]Cc2cc(F)ccc2O)c2ccccc21 ZINC000378490711 227217054 /nfs/dbraw/zinc/21/70/54/227217054.db2.gz CWQLZYUGSGHTGA-CYBMUJFWSA-N 1 2 307.346 2.150 20 10 DECDLO C[C@@H]([NH2+]C[C@@H]1CCCCN1CCO)c1cc(F)cc(F)c1O ZINC000834849820 649854154 /nfs/dbraw/zinc/85/41/54/649854154.db2.gz GBRIJZSUSPTXQB-YPMHNXCESA-N 1 2 314.376 2.168 20 10 DECDLO CO[C@@H]1COCC[C@@H]1C[NH2+][C@H](C)c1cc(F)cc(F)c1O ZINC000834881002 649857154 /nfs/dbraw/zinc/85/71/54/649857154.db2.gz XVUXIUHDTOINOK-GPCCPHFNSA-N 1 2 301.333 2.373 20 10 DECDLO Cn1cc[nH+]c1CCC(=O)NCCCSc1nccs1 ZINC001348844017 1151201305 /nfs/dbraw/zinc/20/13/05/1151201305.db2.gz TZMKAOWNOGTBAU-UHFFFAOYSA-N 1 2 310.448 2.108 20 10 DECDLO COC[C@H]([NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1O)[C@@H]1CCCO1 ZINC000278628678 293165632 /nfs/dbraw/zinc/16/56/32/293165632.db2.gz CPNRHXBRFABDBS-DGFSRKRXSA-N 1 2 310.350 2.145 20 10 DECDLO CCC(CC)[C@@H](C(=O)NCc1ccccc1O)[NH+]1CCOCC1 ZINC000266522872 521598889 /nfs/dbraw/zinc/59/88/89/521598889.db2.gz JARCGMZLRMSYGV-KRWDZBQOSA-N 1 2 320.433 2.145 20 10 DECDLO Cn1cc(N2CC[NH+](Cc3c(O)ccc(Cl)c3F)CC2)cn1 ZINC000191359759 534740039 /nfs/dbraw/zinc/74/00/39/534740039.db2.gz CVDLDALSUMZXFJ-UHFFFAOYSA-N 1 2 324.787 2.240 20 10 DECDLO COc1ccc(O)c(C[N@@H+]2CCNC(=O)[C@@H]2c2ccccc2)c1 ZINC000179921377 524743462 /nfs/dbraw/zinc/74/34/62/524743462.db2.gz QUCRJYNIYQVJDQ-KRWDZBQOSA-N 1 2 312.369 2.074 20 10 DECDLO COc1ccc(O)c(C[N@H+]2CCNC(=O)[C@@H]2c2ccccc2)c1 ZINC000179921377 524743468 /nfs/dbraw/zinc/74/34/68/524743468.db2.gz QUCRJYNIYQVJDQ-KRWDZBQOSA-N 1 2 312.369 2.074 20 10 DECDLO Cc1noc(C)c1C[NH+]1CCN(Cc2cc(F)ccc2O)CC1 ZINC000179941448 526503546 /nfs/dbraw/zinc/50/35/46/526503546.db2.gz CVWIVPASNZCOAR-UHFFFAOYSA-N 1 2 319.380 2.454 20 10 DECDLO CCN(CC)c1ccc(CNC(=O)NCc2[nH+]ccn2C)cc1 ZINC000264215656 528304476 /nfs/dbraw/zinc/30/44/76/528304476.db2.gz SRZRONLPMBDKLC-UHFFFAOYSA-N 1 2 315.421 2.266 20 10 DECDLO COC(=O)[C@H]1C[C@@H](C)CC[N@@H+]1Cc1ccc(OC)c(OC)c1O ZINC000893677662 635756900 /nfs/dbraw/zinc/75/69/00/635756900.db2.gz XDKNCSJHBSCHRQ-WCQYABFASA-N 1 2 323.389 2.183 20 10 DECDLO COC(=O)[C@H]1C[C@@H](C)CC[N@H+]1Cc1ccc(OC)c(OC)c1O ZINC000893677662 635756906 /nfs/dbraw/zinc/75/69/06/635756906.db2.gz XDKNCSJHBSCHRQ-WCQYABFASA-N 1 2 323.389 2.183 20 10 DECDLO COC(=O)c1c(C[NH2+]Cc2cc[nH]n2)c2cc(F)ccc2n1C ZINC000894164342 636337000 /nfs/dbraw/zinc/33/70/00/636337000.db2.gz GQXGXHMSJYSENR-UHFFFAOYSA-N 1 2 316.336 2.117 20 10 DECDLO CN(C)C(=O)O[C@H]1CCC[N@H+](Cc2cc(F)cc(F)c2O)C1 ZINC000894878233 637283489 /nfs/dbraw/zinc/28/34/89/637283489.db2.gz VFBHKCDIGNLKJD-LBPRGKRZSA-N 1 2 314.332 2.333 20 10 DECDLO CN(C)C(=O)O[C@H]1CCC[N@@H+](Cc2cc(F)cc(F)c2O)C1 ZINC000894878233 637283491 /nfs/dbraw/zinc/28/34/91/637283491.db2.gz VFBHKCDIGNLKJD-LBPRGKRZSA-N 1 2 314.332 2.333 20 10 DECDLO Oc1c(F)cc(Cl)cc1C[NH2+]C[C@H]1C[C@@H]2COC[C@@H]2O1 ZINC000896857513 638733183 /nfs/dbraw/zinc/73/31/83/638733183.db2.gz PMVLGVMLTIRSBN-XWIASGKRSA-N 1 2 301.745 2.078 20 10 DECDLO C[C@@H]([NH2+][C@H](CO)C1CCOCC1)c1cc(F)cc(F)c1O ZINC000757656542 639864472 /nfs/dbraw/zinc/86/44/72/639864472.db2.gz BAIQEZUWWVPVFQ-YMTOWFKASA-N 1 2 301.333 2.109 20 10 DECDLO CN(C)c1ccc(C[N@@H+]2CCO[C@H](c3ccnn3C)C2)cc1F ZINC000897558653 640795786 /nfs/dbraw/zinc/79/57/86/640795786.db2.gz LFZRWLRCSNTPSJ-KRWDZBQOSA-N 1 2 318.396 2.199 20 10 DECDLO CN(C)c1ccc(C[N@H+]2CCO[C@H](c3ccnn3C)C2)cc1F ZINC000897558653 640795789 /nfs/dbraw/zinc/79/57/89/640795789.db2.gz LFZRWLRCSNTPSJ-KRWDZBQOSA-N 1 2 318.396 2.199 20 10 DECDLO Cn1nc2c(c1C[NH2+]Cc1cccc(Cl)c1O)COCC2 ZINC000898215010 641049306 /nfs/dbraw/zinc/04/93/06/641049306.db2.gz IXSRMIHFQXWQMC-UHFFFAOYSA-N 1 2 307.781 2.142 20 10 DECDLO COC(=O)c1ccc(C[NH2+]Cc2cccc(Cl)c2O)n1C ZINC000898218391 641051420 /nfs/dbraw/zinc/05/14/20/641051420.db2.gz GCRBTYAINLOAHB-UHFFFAOYSA-N 1 2 308.765 2.461 20 10 DECDLO CCc1cnc(C[N@H+](C)Cc2cc3c(cc2O)OC[C@H]3O)s1 ZINC000768464894 641084463 /nfs/dbraw/zinc/08/44/63/641084463.db2.gz XBURAIKQAWXCDC-CQSZACIVSA-N 1 2 320.414 2.469 20 10 DECDLO CCc1cnc(C[N@@H+](C)Cc2cc3c(cc2O)OC[C@H]3O)s1 ZINC000768464894 641084467 /nfs/dbraw/zinc/08/44/67/641084467.db2.gz XBURAIKQAWXCDC-CQSZACIVSA-N 1 2 320.414 2.469 20 10 DECDLO COC(=O)C[C@@]1([NH2+]Cc2cccc(Cl)c2O)CCCOC1 ZINC000770681321 641407776 /nfs/dbraw/zinc/40/77/76/641407776.db2.gz VZUHXHXNNPZELG-HNNXBMFYSA-N 1 2 313.781 2.248 20 10 DECDLO CC[S@](=O)CC[NH2+]Cc1cccc(Br)c1O ZINC000124136386 641500456 /nfs/dbraw/zinc/50/04/56/641500456.db2.gz YQFCNVNMWBAQSY-MRXNPFEDSA-N 1 2 306.225 2.013 20 10 DECDLO C[C@H](NC(=O)[C@H]1CCn2cc[nH+]c2C1)c1ccc(N(C)C)cc1 ZINC000775405818 642040420 /nfs/dbraw/zinc/04/04/20/642040420.db2.gz VKERCJRXKGAKFT-ZFWWWQNUSA-N 1 2 312.417 2.389 20 10 DECDLO COCC[N@H+](CCC(=O)OC)Cc1cccc(Cl)c1O ZINC000775700276 642081052 /nfs/dbraw/zinc/08/10/52/642081052.db2.gz MUNAVNVOFZVVGT-UHFFFAOYSA-N 1 2 301.770 2.057 20 10 DECDLO COCC[N@@H+](CCC(=O)OC)Cc1cccc(Cl)c1O ZINC000775700276 642081056 /nfs/dbraw/zinc/08/10/56/642081056.db2.gz MUNAVNVOFZVVGT-UHFFFAOYSA-N 1 2 301.770 2.057 20 10 DECDLO CC(C)C[C@@H]1C(=O)NCC[N@H+]1Cc1ccc(N(C)C)c(F)c1 ZINC000783729408 643043686 /nfs/dbraw/zinc/04/36/86/643043686.db2.gz YGVGDTZYIUANFA-MRXNPFEDSA-N 1 2 307.413 2.238 20 10 DECDLO CC(C)C[C@@H]1C(=O)NCC[N@@H+]1Cc1ccc(N(C)C)c(F)c1 ZINC000783729408 643043693 /nfs/dbraw/zinc/04/36/93/643043693.db2.gz YGVGDTZYIUANFA-MRXNPFEDSA-N 1 2 307.413 2.238 20 10 DECDLO C[C@H](NC(=O)[C@H]1CCc2[nH+]ccn2C1)c1ccc(N(C)C)cc1 ZINC000787299545 643478675 /nfs/dbraw/zinc/47/86/75/643478675.db2.gz IZMNPVAVHAFVDO-ZFWWWQNUSA-N 1 2 312.417 2.389 20 10 DECDLO [O-]c1c(Cl)cccc1C[NH2+][C@H]1C[NH2+]CC2(CCOCC2)C1 ZINC000903971324 643530834 /nfs/dbraw/zinc/53/08/34/643530834.db2.gz AEXAVHODCYUBKU-CYBMUJFWSA-N 1 2 310.825 2.294 20 10 DECDLO CN(C)c1ccc(CN(C)C(=O)C(C)(C)c2c[nH+]c[nH]2)cc1 ZINC000788265525 643583989 /nfs/dbraw/zinc/58/39/89/643583989.db2.gz HVGDWDMLKNCLDH-UHFFFAOYSA-N 1 2 300.406 2.412 20 10 DECDLO C[C@H](NC(=O)CCc1c[nH+]cn1C)c1ccc(N(C)C)cc1 ZINC000793856781 644314589 /nfs/dbraw/zinc/31/45/89/644314589.db2.gz QUXAQERRPJAWAM-ZDUSSCGKSA-N 1 2 300.406 2.296 20 10 DECDLO COc1c(O)c(C[N@@H+]2CCOC[C@@H]2C2CCC2)ccc1[N+](=O)[O-] ZINC000843429280 650973840 /nfs/dbraw/zinc/97/38/40/650973840.db2.gz UTPJYOZRMQACSM-CQSZACIVSA-N 1 2 322.361 2.310 20 10 DECDLO COc1c(O)c(C[N@H+]2CCOC[C@@H]2C2CCC2)ccc1[N+](=O)[O-] ZINC000843429280 650973844 /nfs/dbraw/zinc/97/38/44/650973844.db2.gz UTPJYOZRMQACSM-CQSZACIVSA-N 1 2 322.361 2.310 20 10 DECDLO Cc1cc(Br)c(O)c(C[N@@H+]2CC[C@@](F)(CO)C2)c1 ZINC000802660203 645540968 /nfs/dbraw/zinc/54/09/68/645540968.db2.gz DVTJBQKMYKTOQL-ZDUSSCGKSA-N 1 2 318.186 2.369 20 10 DECDLO Cc1cc(Br)c(O)c(C[N@H+]2CC[C@@](F)(CO)C2)c1 ZINC000802660203 645540974 /nfs/dbraw/zinc/54/09/74/645540974.db2.gz DVTJBQKMYKTOQL-ZDUSSCGKSA-N 1 2 318.186 2.369 20 10 DECDLO CCOCC[NH+]1CCN(Cc2cc(Cl)c(F)cc2O)CC1 ZINC000816484097 647140613 /nfs/dbraw/zinc/14/06/13/647140613.db2.gz PPDNTTVXZRJBME-UHFFFAOYSA-N 1 2 316.804 2.339 20 10 DECDLO NC(=O)[C@H]1CCC[C@H]([NH2+]Cc2cc(Cl)c(F)cc2O)C1 ZINC000816553543 647151702 /nfs/dbraw/zinc/15/17/02/647151702.db2.gz ZBBRFAQJFQYOAD-WPRPVWTQSA-N 1 2 300.761 2.318 20 10 DECDLO C[C@@H]([NH2+]Cc1cc(Cl)c(F)cc1O)c1nnnn1C1CC1 ZINC000816591549 647156270 /nfs/dbraw/zinc/15/62/70/647156270.db2.gz HXZRRTCVOBUDDA-SSDOTTSWSA-N 1 2 311.748 2.357 20 10 DECDLO COC(=O)c1ccc([O-])c([C@H](C)[NH2+][C@@H](C[NH3+])C2CCCC2)c1 ZINC000817983099 647399571 /nfs/dbraw/zinc/39/95/71/647399571.db2.gz YAVCWYLYSYCOMX-NHYWBVRUSA-N 1 2 306.406 2.347 20 10 DECDLO O=C(C[C@@H](n1cc[nH+]c1)C(F)(F)F)NCc1ccccc1O ZINC000821055329 647979958 /nfs/dbraw/zinc/97/99/58/647979958.db2.gz LRVZUOUCANGWTL-GFCCVEGCSA-N 1 2 313.279 2.399 20 10 DECDLO Nc1ccc(CC(=O)N2CC[NH+](Cc3cccs3)CC2)cc1 ZINC000237892049 648442403 /nfs/dbraw/zinc/44/24/03/648442403.db2.gz SZSASKYUARMDDO-UHFFFAOYSA-N 1 2 315.442 2.217 20 10 DECDLO C[C@@H]1OCC[C@H]1[N@H+](CCO)Cc1cc(Cl)cc(F)c1O ZINC000825129879 648708400 /nfs/dbraw/zinc/70/84/00/648708400.db2.gz HGZYEUBXJYUSIT-TVQRCGJNSA-N 1 2 303.761 2.156 20 10 DECDLO C[C@@H]1OCC[C@H]1[N@@H+](CCO)Cc1cc(Cl)cc(F)c1O ZINC000825129879 648708404 /nfs/dbraw/zinc/70/84/04/648708404.db2.gz HGZYEUBXJYUSIT-TVQRCGJNSA-N 1 2 303.761 2.156 20 10 DECDLO COc1ccc(O)c([C@@H](C)NC(=O)[C@H]2CCc3c[nH+]cn3C2)c1 ZINC000844133154 651081101 /nfs/dbraw/zinc/08/11/01/651081101.db2.gz SIYBMKQWURVNNO-NEPJUHHUSA-N 1 2 315.373 2.037 20 10 DECDLO COc1ccc(O)c([C@H](C)NC(=O)[C@@H]2CCc3c[nH+]cn3C2)c1 ZINC000844133155 651081204 /nfs/dbraw/zinc/08/12/04/651081204.db2.gz SIYBMKQWURVNNO-NWDGAFQWSA-N 1 2 315.373 2.037 20 10 DECDLO CCc1nnc(C[N@H+](C)CCN(C)c2ccc(OC)cc2)o1 ZINC000844399120 651122917 /nfs/dbraw/zinc/12/29/17/651122917.db2.gz GSXPPKRTURXKEV-UHFFFAOYSA-N 1 2 304.394 2.209 20 10 DECDLO CCc1nnc(C[N@@H+](C)CCN(C)c2ccc(OC)cc2)o1 ZINC000844399120 651122918 /nfs/dbraw/zinc/12/29/18/651122918.db2.gz GSXPPKRTURXKEV-UHFFFAOYSA-N 1 2 304.394 2.209 20 10 DECDLO COc1ccc(N(C)CC[N@H+](C)Cc2ncc(C)cn2)cc1 ZINC000844402075 651123436 /nfs/dbraw/zinc/12/34/36/651123436.db2.gz UFXSJUXGBJBSGK-UHFFFAOYSA-N 1 2 300.406 2.362 20 10 DECDLO COc1ccc(N(C)CC[N@@H+](C)Cc2ncc(C)cn2)cc1 ZINC000844402075 651123437 /nfs/dbraw/zinc/12/34/37/651123437.db2.gz UFXSJUXGBJBSGK-UHFFFAOYSA-N 1 2 300.406 2.362 20 10 DECDLO COc1ccc(N(C)CC[N@H+](C)[C@@H](C)c2nnc(C)[nH]2)cc1 ZINC000844402966 651123497 /nfs/dbraw/zinc/12/34/97/651123497.db2.gz YGHAQDFILZSBMH-LBPRGKRZSA-N 1 2 303.410 2.251 20 10 DECDLO COc1ccc(N(C)CC[N@@H+](C)[C@@H](C)c2nnc(C)[nH]2)cc1 ZINC000844402966 651123499 /nfs/dbraw/zinc/12/34/99/651123499.db2.gz YGHAQDFILZSBMH-LBPRGKRZSA-N 1 2 303.410 2.251 20 10 DECDLO CCN1C[C@H](C[NH2+]Cc2cc(Cl)cc(F)c2O)CC1=O ZINC000846097842 651307614 /nfs/dbraw/zinc/30/76/14/651307614.db2.gz WRLFLZUQIMUETC-VIFPVBQESA-N 1 2 300.761 2.143 20 10 DECDLO COCc1n[nH]c(C[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3F)n1 ZINC000850514566 651942960 /nfs/dbraw/zinc/94/29/60/651942960.db2.gz NNYBTKSAAPAVNU-WPRPVWTQSA-N 1 2 306.341 2.134 20 10 DECDLO CCn1ncc(C[NH2+]Cc2c(O)cccc2Br)n1 ZINC000858207410 652279428 /nfs/dbraw/zinc/27/94/28/652279428.db2.gz WJZXBRNOAIKRNQ-UHFFFAOYSA-N 1 2 311.183 2.056 20 10 DECDLO COc1cc(O)c(C[N@@H+]2CCO[C@@](C)(C(F)F)C2)cc1OC ZINC000853634584 652581829 /nfs/dbraw/zinc/58/18/29/652581829.db2.gz MUBWNHHNDLAAMN-OAHLLOKOSA-N 1 2 317.332 2.265 20 10 DECDLO COc1cc(O)c(C[N@H+]2CCO[C@@](C)(C(F)F)C2)cc1OC ZINC000853634584 652581831 /nfs/dbraw/zinc/58/18/31/652581831.db2.gz MUBWNHHNDLAAMN-OAHLLOKOSA-N 1 2 317.332 2.265 20 10 DECDLO C[C@@H]([NH3+])[C@@H]1CN(Cc2cc(Cl)cc(Cl)c2O)CCO1 ZINC000132560516 684210239 /nfs/dbraw/zinc/21/02/39/684210239.db2.gz RIYKDKADOPLCHY-PELKAZGASA-N 1 2 305.205 2.247 20 10 DECDLO OC[C@]1(F)CC[N@H+](Cc2c(O)cccc2Br)C1 ZINC000862357922 686280724 /nfs/dbraw/zinc/28/07/24/686280724.db2.gz MWALHPSTAOOMAL-LBPRGKRZSA-N 1 2 304.159 2.061 20 10 DECDLO OC[C@]1(F)CC[N@@H+](Cc2c(O)cccc2Br)C1 ZINC000862357922 686280730 /nfs/dbraw/zinc/28/07/30/686280730.db2.gz MWALHPSTAOOMAL-LBPRGKRZSA-N 1 2 304.159 2.061 20 10 DECDLO O=C([C@@H]1CC[N@@H+](Cc2ccc(F)c(F)c2O)C1)N1CCCC1 ZINC000877529797 690142434 /nfs/dbraw/zinc/14/24/34/690142434.db2.gz MZCGVTQECYZTRW-GFCCVEGCSA-N 1 2 310.344 2.115 20 10 DECDLO O=C([C@@H]1CC[N@H+](Cc2ccc(F)c(F)c2O)C1)N1CCCC1 ZINC000877529797 690142438 /nfs/dbraw/zinc/14/24/38/690142438.db2.gz MZCGVTQECYZTRW-GFCCVEGCSA-N 1 2 310.344 2.115 20 10 DECDLO OC[C@H]1CSCC[N@@H+]1Cc1ccc(Br)cc1O ZINC000877780697 690226311 /nfs/dbraw/zinc/22/63/11/690226311.db2.gz ZJRDDPSLMDKYNA-NSHDSACASA-N 1 2 318.236 2.064 20 10 DECDLO OC[C@H]1CSCC[N@H+]1Cc1ccc(Br)cc1O ZINC000877780697 690226313 /nfs/dbraw/zinc/22/63/13/690226313.db2.gz ZJRDDPSLMDKYNA-NSHDSACASA-N 1 2 318.236 2.064 20 10 DECDLO OC[C@H]([NH2+]Cc1cc(Br)cc(F)c1O)C1CC1 ZINC000883001363 691407271 /nfs/dbraw/zinc/40/72/71/691407271.db2.gz BVKNCOVDODDLJI-NSHDSACASA-N 1 2 304.159 2.154 20 10 DECDLO COCc1n[nH]c(C[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3C)n1 ZINC001333327661 1150034360 /nfs/dbraw/zinc/03/43/60/1150034360.db2.gz OKZYQZDLJOJYKU-QWRGUYRKSA-N 1 2 302.378 2.303 20 10 DECDLO CN(Cc1cc(Br)c(F)cc1O)[C@H]1CC[N@@H+](C)C1 ZINC001144299688 790849223 /nfs/dbraw/zinc/84/92/23/790849223.db2.gz GEKPYXDFBGZCGU-JTQLQIEISA-N 1 2 317.202 2.430 20 10 DECDLO CN(Cc1cc(Br)c(F)cc1O)[C@H]1CC[N@H+](C)C1 ZINC001144299688 790849210 /nfs/dbraw/zinc/84/92/10/790849210.db2.gz GEKPYXDFBGZCGU-JTQLQIEISA-N 1 2 317.202 2.430 20 10 DECDLO O=C(Nc1ccc(-n2cc[nH+]c2)cc1)c1cc(O)c(O)c(O)c1 ZINC001148582192 791777346 /nfs/dbraw/zinc/77/73/46/791777346.db2.gz ZQKGWHVLSNRZQF-UHFFFAOYSA-N 1 2 311.297 2.241 20 10 DECDLO COc1ccc(C[NH+]2CC(O)(c3ccccc3)C2)c(O)c1OC ZINC001119970450 795381213 /nfs/dbraw/zinc/38/12/13/795381213.db2.gz ZLBSWSQZWFQQSG-UHFFFAOYSA-N 1 2 315.369 2.113 20 10 DECDLO CCOC(=O)C1=C(O)CC[N@H+](Cc2ccc(N(C)C)c(C)c2)C1 ZINC001139669630 796071416 /nfs/dbraw/zinc/07/14/16/796071416.db2.gz DYKSIAHYAXCXCL-OAHLLOKOSA-N 1 2 318.417 2.015 20 10 DECDLO CCOC(=O)C1=C(O)CC[N@@H+](Cc2ccc(N(C)C)c(C)c2)C1 ZINC001139669630 796071425 /nfs/dbraw/zinc/07/14/25/796071425.db2.gz DYKSIAHYAXCXCL-OAHLLOKOSA-N 1 2 318.417 2.015 20 10 DECDLO COC(=O)c1cnc2c(c1)C[N@@H+](Cc1cccc(F)c1O)CC2 ZINC001138132926 796169230 /nfs/dbraw/zinc/16/92/30/796169230.db2.gz WQAVLCHVUWBPIS-UHFFFAOYSA-N 1 2 316.332 2.271 20 10 DECDLO COC(=O)c1cnc2c(c1)C[N@H+](Cc1cccc(F)c1O)CC2 ZINC001138132926 796169235 /nfs/dbraw/zinc/16/92/35/796169235.db2.gz WQAVLCHVUWBPIS-UHFFFAOYSA-N 1 2 316.332 2.271 20 10 DECDLO COC(=O)C[C@H]1C[N@H+](Cc2c(C)n(C)c3ccccc32)CCO1 ZINC001138258699 796189387 /nfs/dbraw/zinc/18/93/87/796189387.db2.gz YSSQSTPUZSSCIM-AWEZNQCLSA-N 1 2 316.401 2.251 20 10 DECDLO COC(=O)C[C@H]1C[N@@H+](Cc2c(C)n(C)c3ccccc32)CCO1 ZINC001138258699 796189389 /nfs/dbraw/zinc/18/93/89/796189389.db2.gz YSSQSTPUZSSCIM-AWEZNQCLSA-N 1 2 316.401 2.251 20 10 DECDLO CN1CCCc2cc(CN3CC([N@@H+]4CC[C@H](F)C4)C3)ccc21 ZINC001138356966 796204632 /nfs/dbraw/zinc/20/46/32/796204632.db2.gz WLDVEKPQCOWFBJ-INIZCTEOSA-N 1 2 303.425 2.297 20 10 DECDLO CN1CCCc2cc(CN3CC([N@H+]4CC[C@H](F)C4)C3)ccc21 ZINC001138356966 796204636 /nfs/dbraw/zinc/20/46/36/796204636.db2.gz WLDVEKPQCOWFBJ-INIZCTEOSA-N 1 2 303.425 2.297 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CC[C@H](O)[C@@H](C)C1 ZINC001139127362 796328178 /nfs/dbraw/zinc/32/81/78/796328178.db2.gz UGFVGNPYFUQELW-FZMZJTMJSA-N 1 2 303.358 2.010 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CC[C@H](O)[C@@H](C)C1 ZINC001139127362 796328185 /nfs/dbraw/zinc/32/81/85/796328185.db2.gz UGFVGNPYFUQELW-FZMZJTMJSA-N 1 2 303.358 2.010 20 10 DECDLO C[C@H]1CN(C2C[NH+](Cc3cc(Cl)ccc3O)C2)C[C@H](C)O1 ZINC001203665600 796559683 /nfs/dbraw/zinc/55/96/83/796559683.db2.gz PAKKJVDPJMKHKG-RYUDHWBXSA-N 1 2 310.825 2.339 20 10 DECDLO CN(C(=O)OC(C)(C)C)C1C[NH+](Cc2cc(O)ccc2O)C1 ZINC001141155610 796641140 /nfs/dbraw/zinc/64/11/40/796641140.db2.gz AZJIHNQDBDDGMX-UHFFFAOYSA-N 1 2 308.378 2.149 20 10 DECDLO Oc1ccc(O)c(CN2CC[C@@H]([NH+]3CCCC3)C(F)(F)C2)c1 ZINC001141162775 796643278 /nfs/dbraw/zinc/64/32/78/796643278.db2.gz CYHPKFMCGQHTSS-OAHLLOKOSA-N 1 2 312.360 2.403 20 10 DECDLO CC(C)(C)OC(=O)NC1(C)C[NH+](Cc2ccc(O)cc2O)C1 ZINC001204279218 800200588 /nfs/dbraw/zinc/20/05/88/800200588.db2.gz SVUFHECRZBRIHE-UHFFFAOYSA-N 1 2 308.378 2.197 20 10 DECDLO OCC[NH2+]C1CCN(Cc2cc(Cl)cc(Cl)c2O)CC1 ZINC000686278269 800559966 /nfs/dbraw/zinc/55/99/66/800559966.db2.gz LGVDAYRSTPTAER-UHFFFAOYSA-N 1 2 319.232 2.245 20 10 DECDLO CN(C)c1cc(F)c(C[N@@H+]2CCC[C@@H]2C2OCCO2)cc1F ZINC001207793283 800835937 /nfs/dbraw/zinc/83/59/37/800835937.db2.gz GQWUTQUNOKAWBY-CQSZACIVSA-N 1 2 312.360 2.368 20 10 DECDLO CN(C)c1cc(F)c(C[N@H+]2CCC[C@@H]2C2OCCO2)cc1F ZINC001207793283 800835943 /nfs/dbraw/zinc/83/59/43/800835943.db2.gz GQWUTQUNOKAWBY-CQSZACIVSA-N 1 2 312.360 2.368 20 10 DECDLO COc1cc(C[N@@H+]2CCC[C@H]2c2nc(C)no2)c(O)cc1O ZINC001231637385 801701284 /nfs/dbraw/zinc/70/12/84/801701284.db2.gz LPPWQAWNJSNIAA-NSHDSACASA-N 1 2 305.334 2.135 20 10 DECDLO COc1cc(C[N@H+]2CCC[C@H]2c2nc(C)no2)c(O)cc1O ZINC001231637385 801701289 /nfs/dbraw/zinc/70/12/89/801701289.db2.gz LPPWQAWNJSNIAA-NSHDSACASA-N 1 2 305.334 2.135 20 10 DECDLO COC(=O)[C@]1(F)CC[N@@H+](Cc2cc(Cl)c(OC)cc2O)C1 ZINC001232263921 801834365 /nfs/dbraw/zinc/83/43/65/801834365.db2.gz BOTPWVRFRNFDHA-AWEZNQCLSA-N 1 2 317.744 2.141 20 10 DECDLO CC[N@H+](Cc1cc(Cl)c(OC)cc1O)[C@@H](C)C(=O)OC ZINC001232271151 801834773 /nfs/dbraw/zinc/83/47/73/801834773.db2.gz OFJKZIZAGFPJAL-VIFPVBQESA-N 1 2 301.770 2.438 20 10 DECDLO CC[N@@H+](Cc1cc(Cl)c(OC)cc1O)[C@@H](C)C(=O)OC ZINC001232271151 801834780 /nfs/dbraw/zinc/83/47/80/801834780.db2.gz OFJKZIZAGFPJAL-VIFPVBQESA-N 1 2 301.770 2.438 20 10 DECDLO COC(=O)c1c(CN2CCn3c[nH+]cc3C2)c2ccccc2n1C ZINC001232405383 801872983 /nfs/dbraw/zinc/87/29/83/801872983.db2.gz JMQSIMLAUZARFS-UHFFFAOYSA-N 1 2 324.384 2.177 20 10 DECDLO C[N@@H+]1C[C@@H]2C[C@H]1CN2Cc1c(O)cc(Br)cc1F ZINC001233030380 802009049 /nfs/dbraw/zinc/00/90/49/802009049.db2.gz RBHDFDSCSOKOAQ-UWVGGRQHSA-N 1 2 315.186 2.182 20 10 DECDLO C[N@H+]1C[C@@H]2C[C@H]1CN2Cc1c(O)cc(Br)cc1F ZINC001233030380 802009057 /nfs/dbraw/zinc/00/90/57/802009057.db2.gz RBHDFDSCSOKOAQ-UWVGGRQHSA-N 1 2 315.186 2.182 20 10 DECDLO O=C(NC1CC[NH+](Cc2c(O)ccc(F)c2F)CC1)C1CC1 ZINC001233334759 802079478 /nfs/dbraw/zinc/07/94/78/802079478.db2.gz SGFFDCOZHASVPX-UHFFFAOYSA-N 1 2 310.344 2.161 20 10 DECDLO Oc1cc(O)c(C[N@@H+]2CCc3cnc(C4CC4)nc3C2)cc1O ZINC001233487498 802128920 /nfs/dbraw/zinc/12/89/20/802128920.db2.gz GEVTVHJKOQRNLF-UHFFFAOYSA-N 1 2 313.357 2.029 20 10 DECDLO Oc1cc(O)c(C[N@H+]2CCc3cnc(C4CC4)nc3C2)cc1O ZINC001233487498 802128925 /nfs/dbraw/zinc/12/89/25/802128925.db2.gz GEVTVHJKOQRNLF-UHFFFAOYSA-N 1 2 313.357 2.029 20 10 DECDLO CN(C)c1ccc([C@@H]([NH3+])C[NH2+]Cc2cccc(C(=O)[O-])c2)cc1 ZINC001598314590 991300454 /nfs/dbraw/zinc/30/04/54/991300454.db2.gz ZCDUCPHZCUFVBY-KRWDZBQOSA-N 1 2 313.401 2.240 20 10 DECDLO CC(C)C[C@@H]([NH3+])C[N@H+](CC(=O)[O-])Cc1cc(Cl)ccc1O ZINC001591161460 991915052 /nfs/dbraw/zinc/91/50/52/991915052.db2.gz KDCCAJKWMVOTAL-CYBMUJFWSA-N 1 2 314.813 2.306 20 10 DECDLO CC(C)C[C@@H]([NH3+])C[N@@H+](CC(=O)[O-])Cc1cc(Cl)ccc1O ZINC001591161460 991915058 /nfs/dbraw/zinc/91/50/58/991915058.db2.gz KDCCAJKWMVOTAL-CYBMUJFWSA-N 1 2 314.813 2.306 20 10 DECDLO C[C@@H]1[C@H](CC(=O)[O-])CC[C@@H]1[NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1 ZINC001594182459 998700964 /nfs/dbraw/zinc/70/09/64/998700964.db2.gz BEKOXEHTHWGNIJ-QCPWZWHMSA-N 1 2 319.449 2.231 20 10 DECDLO CC(C)SCC[NH2+][C@@H](C)c1cccc(-c2nn[nH]n2)c1O ZINC001603376712 1069958080 /nfs/dbraw/zinc/95/80/80/1069958080.db2.gz DQCNKYWKCYRQOM-JTQLQIEISA-N 1 2 307.423 2.365 20 10 DECDLO C[C@H]([NH2+]C[C@]1(C)CC1(F)F)c1cccc(-c2nn[nH]n2)c1O ZINC001603656699 1070022237 /nfs/dbraw/zinc/02/22/37/1070022237.db2.gz IAORIHZVNXKSNG-SDBXPKJASA-N 1 2 309.320 2.268 20 10 DECDLO CCCCOCCC[NH2+][C@@H](C)c1cccc(-c2nn[nH]n2)c1O ZINC001604188209 1070271680 /nfs/dbraw/zinc/27/16/80/1070271680.db2.gz KYOALHRDIXLNDP-LBPRGKRZSA-N 1 2 319.409 2.430 20 10 DECDLO CO[C@@H]1C[C@@H]([NH2+][C@@H](C)c2cccc(-c3nn[nH]n3)c2O)C1(C)C ZINC001605025399 1070579412 /nfs/dbraw/zinc/57/94/12/1070579412.db2.gz UXADRESSZBXFKE-ZWKOPEQDSA-N 1 2 317.393 2.036 20 10 DECDLO Cc1c[nH+]c2cc(C(=O)NCCc3ccc(O)c(O)c3)ccn12 ZINC001631510694 1078366463 /nfs/dbraw/zinc/36/64/63/1078366463.db2.gz WSKFSEUCRXRSEG-UHFFFAOYSA-N 1 2 311.341 2.026 20 10 DECDLO O=C(Cc1ccc(O)c(O)c1)NCc1ccccc1-n1cc[nH+]c1 ZINC001631864995 1078373770 /nfs/dbraw/zinc/37/37/70/1078373770.db2.gz CCFCNALIWZILDR-UHFFFAOYSA-N 1 2 323.352 2.142 20 10 DECDLO Cc1cn2cc(NC(=O)c3c(F)ccc(O)c3O)ccc2[nH+]1 ZINC001638268254 1078555366 /nfs/dbraw/zinc/55/53/66/1078555366.db2.gz WNDIWOKEVYKGPE-UHFFFAOYSA-N 1 2 301.277 2.445 20 10 DECDLO CCn1c(C2SC=CC2=O)nnc1N1CC[NH+](C2CC2)CC1 ZINC001520730140 1069172735 /nfs/dbraw/zinc/17/27/35/1069172735.db2.gz AIKRHWZKBZGCNL-UHFFFAOYSA-N 1 2 319.434 2.017 20 10 DECDLO C[C@H]([NH2+][C@@H](C)C1CCOCC1)c1cccc(-c2nn[nH]n2)c1O ZINC001589950313 1076531978 /nfs/dbraw/zinc/53/19/78/1076531978.db2.gz RBPWLYNMWKCTGI-QWRGUYRKSA-N 1 2 317.393 2.038 20 10 DECDLO CC[C@H]([NH2+][C@@H](C)CSC)c1cccc(-c2nn[nH]n2)c1O ZINC001590461345 1076630567 /nfs/dbraw/zinc/63/05/67/1076630567.db2.gz BEYCZQQLOOLVFX-CABZTGNLSA-N 1 2 307.423 2.365 20 10 DECDLO CC[C@H]([NH2+]C[C@H](C)CCOC)c1cccc(-c2nn[nH]n2)c1O ZINC001590464873 1076632516 /nfs/dbraw/zinc/63/25/16/1076632516.db2.gz QSDGRFKTFZEDSG-RISCZKNCSA-N 1 2 319.409 2.286 20 10 DECDLO CC[C@@H]1COCCN1CC[NH2+]Cc1cc(Cl)cc(F)c1O ZINC001657938006 1080191286 /nfs/dbraw/zinc/19/12/86/1080191286.db2.gz RQQKTIJJBUTVJZ-CYBMUJFWSA-N 1 2 316.804 2.385 20 10 DECDLO C[C@]1(O)COCC[N@H+](Cc2c(O)ccc(Cl)c2Cl)C1 ZINC001237078889 1080442350 /nfs/dbraw/zinc/44/23/50/1080442350.db2.gz ZRGJCSRGVOSUFX-CYBMUJFWSA-N 1 2 306.189 2.282 20 10 DECDLO C[C@]1(O)COCC[N@@H+](Cc2c(O)ccc(Cl)c2Cl)C1 ZINC001237078889 1080442355 /nfs/dbraw/zinc/44/23/55/1080442355.db2.gz ZRGJCSRGVOSUFX-CYBMUJFWSA-N 1 2 306.189 2.282 20 10 DECDLO C[N@@H+]1C[C@H]2CN(Cc3cc(Cl)c(Cl)cc3O)C[C@@H](C1)O2 ZINC001276804667 1083621162 /nfs/dbraw/zinc/62/11/62/1083621162.db2.gz JUJDGHABBNHIJD-PHIMTYICSA-N 1 2 317.216 2.214 20 10 DECDLO C[NH+]1CC2(CN(Cc3cc(F)cc(Br)c3O)C2)C1 ZINC001235306452 1084379869 /nfs/dbraw/zinc/37/98/69/1084379869.db2.gz FVTCFZFJWMQPQS-UHFFFAOYSA-N 1 2 315.186 2.041 20 10 DECDLO Oc1cccc(Cl)c1C[NH+]1CC2(CCN2Cc2cn[nH]c2)C1 ZINC001275217358 1091621139 /nfs/dbraw/zinc/62/11/39/1091621139.db2.gz JYHMINCEQLCTPA-UHFFFAOYSA-N 1 2 318.808 2.229 20 10 DECDLO COc1cc(O)c(C[N@@H+]2CCN(C(C)=O)[C@H](C)C2)c(Cl)c1 ZINC001236809671 1138435794 /nfs/dbraw/zinc/43/57/94/1138435794.db2.gz XFNKKDDBHRPYEJ-SNVBAGLBSA-N 1 2 312.797 2.107 20 10 DECDLO COc1cc(O)c(C[N@H+]2CCN(C(C)=O)[C@H](C)C2)c(Cl)c1 ZINC001236809671 1138435803 /nfs/dbraw/zinc/43/58/03/1138435803.db2.gz XFNKKDDBHRPYEJ-SNVBAGLBSA-N 1 2 312.797 2.107 20 10 DECDLO CC[N@H+](Cc1ccc(N2CCOCC2)cc1Cl)C1CN(C)C1 ZINC001236930035 1138460022 /nfs/dbraw/zinc/46/00/22/1138460022.db2.gz LBNGUZPIXZIFEZ-UHFFFAOYSA-N 1 2 323.868 2.313 20 10 DECDLO CC[N@@H+](Cc1ccc(N2CCOCC2)cc1Cl)C1CN(C)C1 ZINC001236930035 1138460026 /nfs/dbraw/zinc/46/00/26/1138460026.db2.gz LBNGUZPIXZIFEZ-UHFFFAOYSA-N 1 2 323.868 2.313 20 10 DECDLO Oc1ccc(F)c(Cl)c1C[NH+]1CCN(c2cccnn2)CC1 ZINC001237122940 1138508629 /nfs/dbraw/zinc/50/86/29/1138508629.db2.gz AGQABTXQRQUSRU-UHFFFAOYSA-N 1 2 322.771 2.297 20 10 DECDLO O=C1CC[N@@H+](Cc2cc(F)cc(Cl)c2O)C[C@@H]2CCCN12 ZINC001237803936 1138794550 /nfs/dbraw/zinc/79/45/50/1138794550.db2.gz WOBBSNQRFGJGJL-LBPRGKRZSA-N 1 2 312.772 2.381 20 10 DECDLO O=C1CC[N@H+](Cc2cc(F)cc(Cl)c2O)C[C@@H]2CCCN12 ZINC001237803936 1138794561 /nfs/dbraw/zinc/79/45/61/1138794561.db2.gz WOBBSNQRFGJGJL-LBPRGKRZSA-N 1 2 312.772 2.381 20 10 DECDLO C[N@H+](Cc1cc(F)cc(Cl)c1O)C1CCS(=O)(=O)CC1 ZINC001237806978 1138795675 /nfs/dbraw/zinc/79/56/75/1138795675.db2.gz XSOOGDFSRPFSBF-UHFFFAOYSA-N 1 2 321.801 2.194 20 10 DECDLO C[N@@H+](Cc1cc(F)cc(Cl)c1O)C1CCS(=O)(=O)CC1 ZINC001237806978 1138795677 /nfs/dbraw/zinc/79/56/77/1138795677.db2.gz XSOOGDFSRPFSBF-UHFFFAOYSA-N 1 2 321.801 2.194 20 10 DECDLO COC(=O)C1C[NH+](Cc2cc(C)c(Br)cc2O)C1 ZINC001250120543 1142084158 /nfs/dbraw/zinc/08/41/58/1142084158.db2.gz HVIUYNIBNSIEEF-UHFFFAOYSA-N 1 2 314.179 2.068 20 10 DECDLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)NCc1ccc2cccnc2c1O ZINC001299726292 1144215076 /nfs/dbraw/zinc/21/50/76/1144215076.db2.gz RJARIEYBVRIUKJ-NSHDSACASA-N 1 2 310.357 2.159 20 10 DECDLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)NCc1ccc2cccnc2c1O ZINC001299726292 1144215078 /nfs/dbraw/zinc/21/50/78/1144215078.db2.gz RJARIEYBVRIUKJ-NSHDSACASA-N 1 2 310.357 2.159 20 10 DECDLO CCCn1c[nH+]cc1CN(C)c1ccc(OCC(=O)OC)cc1 ZINC001308685451 1147482724 /nfs/dbraw/zinc/48/27/24/1147482724.db2.gz WWJFZWDGQZXVSV-UHFFFAOYSA-N 1 2 317.389 2.481 20 10 DECDLO Cn1cc(N2CC[C@H]([NH2+]Cc3cc(Cl)cc(F)c3O)C2)cn1 ZINC001324924210 1147858569 /nfs/dbraw/zinc/85/85/69/1147858569.db2.gz LYXOJGMRBANSGJ-LBPRGKRZSA-N 1 2 324.787 2.287 20 10 DECDLO O=C(/C=C/c1ccc(O)c(O)c1)N1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000272385237 130026326 /nfs/dbraw/zinc/02/63/26/130026326.db2.gz GCPLKWJQHYGKID-BPJJOFIESA-N 1 2 313.357 2.240 20 10 DECDLO CCCOc1ccc(C[NH+]2CC(NC(=O)C3CCC3)C2)c(O)c1 ZINC000297479401 132017941 /nfs/dbraw/zinc/01/79/41/132017941.db2.gz UBMIBSJVLCLELW-UHFFFAOYSA-N 1 2 318.417 2.282 20 10 DECDLO COc1ccc(N2CC[NH+](Cc3cc(C)on3)CC2)cc1F ZINC000084866885 401911088 /nfs/dbraw/zinc/91/10/88/401911088.db2.gz FVSXXDTURZUPEK-UHFFFAOYSA-N 1 2 305.353 2.453 20 10 DECDLO O=C1NCCN1C1CC[NH+](Cc2cccc(Cl)c2O)CC1 ZINC000183389690 402762741 /nfs/dbraw/zinc/76/27/41/402762741.db2.gz YPSAPSJEMGOJSZ-UHFFFAOYSA-N 1 2 309.797 2.035 20 10 DECDLO OC[C@H]1CCCN(c2cc(NCc3ccccc3O)[nH+]cn2)C1 ZINC000271627443 402881822 /nfs/dbraw/zinc/88/18/22/402881822.db2.gz NHEIRUGZZCPQHI-ZDUSSCGKSA-N 1 2 314.389 2.003 20 10 DECDLO OC[C@H]1CCCN(c2cc(NCc3ccccc3O)nc[nH+]2)C1 ZINC000271627443 402881824 /nfs/dbraw/zinc/88/18/24/402881824.db2.gz NHEIRUGZZCPQHI-ZDUSSCGKSA-N 1 2 314.389 2.003 20 10 DECDLO COc1c(O)c(C[N@@H+]2C[C@@H](C)O[C@@H](C3CC3)C2)ccc1[N+](=O)[O-] ZINC000280492813 403005725 /nfs/dbraw/zinc/00/57/25/403005725.db2.gz FLQSGZOLOAIEJC-QMTHXVAHSA-N 1 2 322.361 2.308 20 10 DECDLO COc1c(O)c(C[N@H+]2C[C@@H](C)O[C@@H](C3CC3)C2)ccc1[N+](=O)[O-] ZINC000280492813 403005726 /nfs/dbraw/zinc/00/57/26/403005726.db2.gz FLQSGZOLOAIEJC-QMTHXVAHSA-N 1 2 322.361 2.308 20 10 DECDLO Cc1ccoc1C[N@@H+](C)CC(=O)NCc1ccc(N(C)C)cc1 ZINC000292081415 403285567 /nfs/dbraw/zinc/28/55/67/403285567.db2.gz DLGKIOVIJMLFAM-UHFFFAOYSA-N 1 2 315.417 2.402 20 10 DECDLO Cc1ccoc1C[N@H+](C)CC(=O)NCc1ccc(N(C)C)cc1 ZINC000292081415 403285570 /nfs/dbraw/zinc/28/55/70/403285570.db2.gz DLGKIOVIJMLFAM-UHFFFAOYSA-N 1 2 315.417 2.402 20 10 DECDLO CCOC(=O)[C@H](F)C1C[NH+](Cc2cccc(Cl)c2O)C1 ZINC000294076403 403642242 /nfs/dbraw/zinc/64/22/42/403642242.db2.gz YSVWDCVRNWAVAC-GFCCVEGCSA-N 1 2 301.745 2.379 20 10 DECDLO Oc1cc(F)c(Cl)cc1C[NH+]1CCN(c2ncccn2)CC1 ZINC000295029926 403741077 /nfs/dbraw/zinc/74/10/77/403741077.db2.gz XMFMOYXYKMIETO-UHFFFAOYSA-N 1 2 322.771 2.297 20 10 DECDLO OC[C@]1(F)CCC[N@H+](Cc2cc(Br)ccc2O)C1 ZINC000289849289 404004633 /nfs/dbraw/zinc/00/46/33/404004633.db2.gz PWSFVDWZFKNLGR-ZDUSSCGKSA-N 1 2 318.186 2.451 20 10 DECDLO OC[C@]1(F)CCC[N@@H+](Cc2cc(Br)ccc2O)C1 ZINC000289849289 404004639 /nfs/dbraw/zinc/00/46/39/404004639.db2.gz PWSFVDWZFKNLGR-ZDUSSCGKSA-N 1 2 318.186 2.451 20 10 DECDLO Oc1ccccc1C[N@@H+](Cc1cnns1)C[C@H]1CCCO1 ZINC000290094090 404037969 /nfs/dbraw/zinc/03/79/69/404037969.db2.gz RMSMWZGWSWTOEE-CYBMUJFWSA-N 1 2 305.403 2.425 20 10 DECDLO Oc1ccccc1C[N@H+](Cc1cnns1)C[C@H]1CCCO1 ZINC000290094090 404037975 /nfs/dbraw/zinc/03/79/75/404037975.db2.gz RMSMWZGWSWTOEE-CYBMUJFWSA-N 1 2 305.403 2.425 20 10 DECDLO Oc1ccccc1C[N@@H+](Cc1cnns1)C[C@@H]1CCCO1 ZINC000290094095 404038259 /nfs/dbraw/zinc/03/82/59/404038259.db2.gz RMSMWZGWSWTOEE-ZDUSSCGKSA-N 1 2 305.403 2.425 20 10 DECDLO Oc1ccccc1C[N@H+](Cc1cnns1)C[C@@H]1CCCO1 ZINC000290094095 404038269 /nfs/dbraw/zinc/03/82/69/404038269.db2.gz RMSMWZGWSWTOEE-ZDUSSCGKSA-N 1 2 305.403 2.425 20 10 DECDLO CCOCc1nc([C@@H](C)[NH2+]Cc2cc(OC)ccc2O)no1 ZINC000290922761 404359978 /nfs/dbraw/zinc/35/99/78/404359978.db2.gz NZCQOURCXCHLKF-SNVBAGLBSA-N 1 2 307.350 2.171 20 10 DECDLO CCOCc1nc([C@@H](C)[NH2+]Cc2ccc3c(c2)CCO3)no1 ZINC000291018248 404371755 /nfs/dbraw/zinc/37/17/55/404371755.db2.gz XOQIOSZLCNQYRZ-LLVKDONJSA-N 1 2 303.362 2.392 20 10 DECDLO COc1cc(O)c(C[N@H+](C)Cc2nncn2C(C)C)cc1OC ZINC000291864127 404555437 /nfs/dbraw/zinc/55/54/37/404555437.db2.gz JEKBRKMZLCIMRS-UHFFFAOYSA-N 1 2 320.393 2.214 20 10 DECDLO COc1cc(O)c(C[N@@H+](C)Cc2nncn2C(C)C)cc1OC ZINC000291864127 404555446 /nfs/dbraw/zinc/55/54/46/404555446.db2.gz JEKBRKMZLCIMRS-UHFFFAOYSA-N 1 2 320.393 2.214 20 10 DECDLO CC[C@H]([NH2+]CCNC(=O)c1ccn[nH]1)c1cccc(Cl)c1O ZINC000287743138 288041476 /nfs/dbraw/zinc/04/14/76/288041476.db2.gz PUSKWEXEFHVJBV-LBPRGKRZSA-N 1 2 322.796 2.239 20 10 DECDLO C[C@@H](CS(C)(=O)=O)[N@H+](C)C/C=C\c1ccc(N(C)C)cc1 ZINC000835027180 649868695 /nfs/dbraw/zinc/86/86/95/649868695.db2.gz CYEJQMVMLZCUKW-AFNCTOJWSA-N 1 2 310.463 2.131 20 10 DECDLO C[C@@H](CS(C)(=O)=O)[N@@H+](C)C/C=C\c1ccc(N(C)C)cc1 ZINC000835027180 649868698 /nfs/dbraw/zinc/86/86/98/649868698.db2.gz CYEJQMVMLZCUKW-AFNCTOJWSA-N 1 2 310.463 2.131 20 10 DECDLO CC(C)[C@H](C(=O)Nc1ccc(N)cc1)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000236809668 519810024 /nfs/dbraw/zinc/81/00/24/519810024.db2.gz VVTAOQQDEBYPQH-DVOMOZLQSA-N 1 2 305.422 2.341 20 10 DECDLO CC(C)[C@H](C(=O)Nc1ccc(N)cc1)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000236809668 519810025 /nfs/dbraw/zinc/81/00/25/519810025.db2.gz VVTAOQQDEBYPQH-DVOMOZLQSA-N 1 2 305.422 2.341 20 10 DECDLO CN(C)c1ccc(C[NH2+][C@@H]2CS(=O)(=O)c3ccccc32)cc1 ZINC000267944238 522210889 /nfs/dbraw/zinc/21/08/89/522210889.db2.gz RCALBALBDRSNES-MRXNPFEDSA-N 1 2 316.426 2.371 20 10 DECDLO O=C1[C@H]([NH2+]Cc2cc(Cl)cc(F)c2O)C[C@@H]2CCCCN12 ZINC000835072800 649875540 /nfs/dbraw/zinc/87/55/40/649875540.db2.gz JZNOBTVXGZCVHW-WCQYABFASA-N 1 2 312.772 2.428 20 10 DECDLO C[C@@H](C(=O)NCc1cccc(Cl)c1O)[NH+]1CCSCC1 ZINC000890759595 623197635 /nfs/dbraw/zinc/19/76/35/623197635.db2.gz DJEPVMFEWPKFOX-JTQLQIEISA-N 1 2 314.838 2.099 20 10 DECDLO Oc1c(F)cc(Br)cc1C[NH+]1CCC(O)CC1 ZINC000893902183 636058927 /nfs/dbraw/zinc/05/89/27/636058927.db2.gz URDNFIMAJUTRNW-UHFFFAOYSA-N 1 2 304.159 2.251 20 10 DECDLO COc1cc(C)cc(C[N@@H+](C)Cc2nc([C@H](C)OC)no2)c1O ZINC000754736868 639466919 /nfs/dbraw/zinc/46/69/19/639466919.db2.gz OMFKBBOMYXOHAQ-NSHDSACASA-N 1 2 321.377 2.432 20 10 DECDLO COc1cc(C)cc(C[N@H+](C)Cc2nc([C@H](C)OC)no2)c1O ZINC000754736868 639466923 /nfs/dbraw/zinc/46/69/23/639466923.db2.gz OMFKBBOMYXOHAQ-NSHDSACASA-N 1 2 321.377 2.432 20 10 DECDLO OCC[C@@H]([NH2+]Cc1cc(Cl)cc(F)c1O)C1CCOCC1 ZINC000764678929 640676008 /nfs/dbraw/zinc/67/60/08/640676008.db2.gz OZHGVIALCVJTPB-CQSZACIVSA-N 1 2 317.788 2.452 20 10 DECDLO CC[C@@H](C[N@H+](CC(=O)OC)Cc1cc(Cl)ccc1O)OC ZINC000842152850 650660575 /nfs/dbraw/zinc/66/05/75/650660575.db2.gz IXQHCNAYCQJMAC-ZDUSSCGKSA-N 1 2 315.797 2.446 20 10 DECDLO CC[C@@H](C[N@@H+](CC(=O)OC)Cc1cc(Cl)ccc1O)OC ZINC000842152850 650660578 /nfs/dbraw/zinc/66/05/78/650660578.db2.gz IXQHCNAYCQJMAC-ZDUSSCGKSA-N 1 2 315.797 2.446 20 10 DECDLO OCCNc1nc(NCc2ccccc2O)[nH+]c2ccccc21 ZINC000774523675 641914906 /nfs/dbraw/zinc/91/49/06/641914906.db2.gz JBSATDITZHJZOC-UHFFFAOYSA-N 1 2 310.357 2.352 20 10 DECDLO C[C@H](NC(=O)c1cc([C@@H]2CCC[N@@H+]2C)n[nH]1)c1ccccc1O ZINC000899182332 641974745 /nfs/dbraw/zinc/97/47/45/641974745.db2.gz XUEQZJZDFQDCQJ-NHYWBVRUSA-N 1 2 314.389 2.373 20 10 DECDLO C[C@H](NC(=O)c1cc([C@@H]2CCC[N@H+]2C)n[nH]1)c1ccccc1O ZINC000899182332 641974748 /nfs/dbraw/zinc/97/47/48/641974748.db2.gz XUEQZJZDFQDCQJ-NHYWBVRUSA-N 1 2 314.389 2.373 20 10 DECDLO CCn1cc(C[N@@H+](C)Cc2ccc([N+](=O)[O-])c(OC)c2O)cn1 ZINC000774885066 641977052 /nfs/dbraw/zinc/97/70/52/641977052.db2.gz OSAQPPVJPKDORO-UHFFFAOYSA-N 1 2 320.349 2.157 20 10 DECDLO COc1c(O)c(C[N@H+](C)Cc2cccn2C)ccc1[N+](=O)[O-] ZINC000774904139 641979189 /nfs/dbraw/zinc/97/91/89/641979189.db2.gz PSKOIPXDZPKUBO-UHFFFAOYSA-N 1 2 305.334 2.280 20 10 DECDLO COc1c(O)c(C[N@@H+](C)Cc2cccn2C)ccc1[N+](=O)[O-] ZINC000774904139 641979193 /nfs/dbraw/zinc/97/91/93/641979193.db2.gz PSKOIPXDZPKUBO-UHFFFAOYSA-N 1 2 305.334 2.280 20 10 DECDLO CC[C@@H](CN1CCOCC1)[NH2+][C@@H](C)c1cc(F)cc(F)c1O ZINC000903342816 643320010 /nfs/dbraw/zinc/32/00/10/643320010.db2.gz KXBXDSIGWGCUTF-AAEUAGOBSA-N 1 2 314.376 2.432 20 10 DECDLO C[C@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)c1nnnn1C1CC1 ZINC000791008839 643919442 /nfs/dbraw/zinc/91/94/42/643919442.db2.gz JQDXRMOBNZXGOP-JTQLQIEISA-N 1 2 304.373 2.064 20 10 DECDLO CS(=O)(=O)[C@@H]1CCC[N@H+](Cc2cccc(Cl)c2O)CC1 ZINC000800535053 645284881 /nfs/dbraw/zinc/28/48/81/645284881.db2.gz YLZHYRQKHJHQAT-GFCCVEGCSA-N 1 2 317.838 2.445 20 10 DECDLO CS(=O)(=O)[C@@H]1CCC[N@@H+](Cc2cccc(Cl)c2O)CC1 ZINC000800535053 645284884 /nfs/dbraw/zinc/28/48/84/645284884.db2.gz YLZHYRQKHJHQAT-GFCCVEGCSA-N 1 2 317.838 2.445 20 10 DECDLO CC(C)S(=O)(=O)CC[NH2+][C@@H](C)c1cc(F)cc(F)c1O ZINC000808726778 646132856 /nfs/dbraw/zinc/13/28/56/646132856.db2.gz NKIDVPJFEWXGIR-VIFPVBQESA-N 1 2 307.362 2.144 20 10 DECDLO CN(C)c1[nH+]cc(/C=C2/c3cccc4c3N(CCC4)C2=O)n1C ZINC000817345259 647272694 /nfs/dbraw/zinc/27/26/94/647272694.db2.gz FSLZNOVYZYTPFF-GDNBJRDFSA-N 1 2 308.385 2.320 20 10 DECDLO OCCN1CCCC[C@H]1C[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000824583496 648616337 /nfs/dbraw/zinc/61/63/37/648616337.db2.gz NJAODZAGHYHSPI-LBPRGKRZSA-N 1 2 316.804 2.121 20 10 DECDLO CO[C@H]1COCC[C@H]1C[NH2+]Cc1cc(Cl)cc(F)c1O ZINC000824710236 648640276 /nfs/dbraw/zinc/64/02/76/648640276.db2.gz WCWIQMWLNZVJEP-ZANVPECISA-N 1 2 303.761 2.326 20 10 DECDLO COc1cc(C[N@@H+]2CC(=O)NCC2(C)C)c(O)c(C(C)(C)C)c1 ZINC000825780791 648811598 /nfs/dbraw/zinc/81/15/98/648811598.db2.gz ZHOLQGWIWQGCAY-UHFFFAOYSA-N 1 2 320.433 2.409 20 10 DECDLO COc1cc(C[N@H+]2CC(=O)NCC2(C)C)c(O)c(C(C)(C)C)c1 ZINC000825780791 648811599 /nfs/dbraw/zinc/81/15/99/648811599.db2.gz ZHOLQGWIWQGCAY-UHFFFAOYSA-N 1 2 320.433 2.409 20 10 DECDLO CO[C@@H](C[NH2+]Cc1cc(Cl)cc(F)c1O)[C@H]1CCOC1 ZINC000826821670 648931685 /nfs/dbraw/zinc/93/16/85/648931685.db2.gz AXTOLIMKZSJPSC-ZANVPECISA-N 1 2 303.761 2.326 20 10 DECDLO CO[C@]1(CO)CCC[N@H+](Cc2c(O)ccc(Cl)c2F)C1 ZINC000826951690 648951861 /nfs/dbraw/zinc/95/18/61/648951861.db2.gz BIPIBXCYTOCIFJ-CQSZACIVSA-N 1 2 303.761 2.158 20 10 DECDLO CO[C@]1(CO)CCC[N@@H+](Cc2c(O)ccc(Cl)c2F)C1 ZINC000826951690 648951863 /nfs/dbraw/zinc/95/18/63/648951863.db2.gz BIPIBXCYTOCIFJ-CQSZACIVSA-N 1 2 303.761 2.158 20 10 DECDLO CN(C)c1ccc(C[NH2+]Cc2nc([C@H]3CCCO3)n[nH]2)cc1 ZINC000848562453 651471018 /nfs/dbraw/zinc/47/10/18/651471018.db2.gz JXUHOCSMBGEVAC-CQSZACIVSA-N 1 2 301.394 2.012 20 10 DECDLO CCOC(=O)[C@H]([NH2+]Cc1cccc(CC)c1O)[C@@H]1CCCOC1 ZINC000848906970 651554604 /nfs/dbraw/zinc/55/46/04/651554604.db2.gz YWFYDLPHCAOPTF-HZPDHXFCSA-N 1 2 321.417 2.403 20 10 DECDLO COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@H]2C[C@@H](C)n3ncnc32)c1 ZINC000850499336 651940824 /nfs/dbraw/zinc/94/08/24/651940824.db2.gz NOTDQDPVBPYPOI-NRUUGDAUSA-N 1 2 316.361 2.127 20 10 DECDLO Cc1cc(C(=O)N[C@@H]2Cc3c[nH+]cn3C2)c(C)n1-c1ccccn1 ZINC000857888429 652197126 /nfs/dbraw/zinc/19/71/26/652197126.db2.gz UDDBERAPSPCQKZ-CQSZACIVSA-N 1 2 321.384 2.040 20 10 DECDLO CC[C@@H](C(=O)NCc1c(O)cccc1F)[N@@H+]1CCO[C@@H](CC)C1 ZINC000928709021 693831345 /nfs/dbraw/zinc/83/13/45/693831345.db2.gz VTJWUJNJQFZWBD-WFASDCNBSA-N 1 2 324.396 2.037 20 10 DECDLO CC[C@@H](C(=O)NCc1c(O)cccc1F)[N@H+]1CCO[C@@H](CC)C1 ZINC000928709021 693831350 /nfs/dbraw/zinc/83/13/50/693831350.db2.gz VTJWUJNJQFZWBD-WFASDCNBSA-N 1 2 324.396 2.037 20 10 DECDLO Oc1c(C[N@@H+]2CC[C@H](Nc3ncccn3)C2)ccc(F)c1F ZINC000877603030 690164966 /nfs/dbraw/zinc/16/49/66/690164966.db2.gz CGGABHUYUKZELT-NSHDSACASA-N 1 2 306.316 2.147 20 10 DECDLO Oc1c(C[N@H+]2CC[C@H](Nc3ncccn3)C2)ccc(F)c1F ZINC000877603030 690164969 /nfs/dbraw/zinc/16/49/69/690164969.db2.gz CGGABHUYUKZELT-NSHDSACASA-N 1 2 306.316 2.147 20 10 DECDLO COc1ccc(N2CC[NH+](Cc3conc3C)CC2)c(OC)c1 ZINC000877708261 690198506 /nfs/dbraw/zinc/19/85/06/690198506.db2.gz GVAOOPSYQNDTIL-UHFFFAOYSA-N 1 2 317.389 2.322 20 10 DECDLO CCOC(=O)c1cc(C[NH2+]Cc2ccc(F)c(F)c2O)on1 ZINC000877711544 690199843 /nfs/dbraw/zinc/19/98/43/690199843.db2.gz NJDYSFHLZQOYOE-UHFFFAOYSA-N 1 2 312.272 2.125 20 10 DECDLO CC(C)CN1CCO[C@H](C[NH2+]Cc2cc(F)cc(F)c2O)C1 ZINC000882880259 691377671 /nfs/dbraw/zinc/37/76/71/691377671.db2.gz KGWNOMIKDINVPS-CQSZACIVSA-N 1 2 314.376 2.117 20 10 DECDLO C[C@H]([NH2+]Cc1ccc(N2CCC(O)CC2)cc1)c1ncco1 ZINC000886272554 692042043 /nfs/dbraw/zinc/04/20/43/692042043.db2.gz TZPNHCVOXGMCIK-ZDUSSCGKSA-N 1 2 301.390 2.487 20 10 DECDLO C[N@@H+]1CC[C@@H]1CNC(=O)NCc1cc(Cl)cc(Cl)c1O ZINC000925421370 693270417 /nfs/dbraw/zinc/27/04/17/693270417.db2.gz DLRGSEBXSYKJFJ-SNVBAGLBSA-N 1 2 318.204 2.202 20 10 DECDLO C[N@H+]1CC[C@@H]1CNC(=O)NCc1cc(Cl)cc(Cl)c1O ZINC000925421370 693270419 /nfs/dbraw/zinc/27/04/19/693270419.db2.gz DLRGSEBXSYKJFJ-SNVBAGLBSA-N 1 2 318.204 2.202 20 10 DECDLO CN(C(=O)OC(C)(C)C)[C@H]1CC[N@@H+]1Cc1c(O)cc(O)cc1O ZINC001144515472 790942388 /nfs/dbraw/zinc/94/23/88/790942388.db2.gz PVIHJGLHRSTQAO-CQSZACIVSA-N 1 2 324.377 2.202 20 10 DECDLO CN(C(=O)OC(C)(C)C)[C@H]1CC[N@H+]1Cc1c(O)cc(O)cc1O ZINC001144515472 790942390 /nfs/dbraw/zinc/94/23/90/790942390.db2.gz PVIHJGLHRSTQAO-CQSZACIVSA-N 1 2 324.377 2.202 20 10 DECDLO CC[S@](=O)CC[NH2+]Cc1cc(Br)cc(F)c1O ZINC000715790967 792511179 /nfs/dbraw/zinc/51/11/79/792511179.db2.gz DLTPQMCDUTYTKD-KRWDZBQOSA-N 1 2 324.215 2.152 20 10 DECDLO O=C(c1cccs1)N1CC[NH+](Cc2ccc(O)cc2O)CC1 ZINC001204280015 795373348 /nfs/dbraw/zinc/37/33/48/795373348.db2.gz IZAXRGZDEHMCJC-UHFFFAOYSA-N 1 2 318.398 2.117 20 10 DECDLO Oc1cccc(F)c1C[NH+]1CCN(c2ccc(Cl)nn2)CC1 ZINC001137839785 796145031 /nfs/dbraw/zinc/14/50/31/796145031.db2.gz JPYIWFCOIOMLNE-UHFFFAOYSA-N 1 2 322.771 2.297 20 10 DECDLO Oc1ccc(F)cc1CN1CC[NH+](CCc2ccncc2)CC1 ZINC001140055650 796471261 /nfs/dbraw/zinc/47/12/61/796471261.db2.gz NZABFCWASMJZNM-UHFFFAOYSA-N 1 2 315.392 2.287 20 10 DECDLO Oc1ccc(F)cc1C[NH+]1CCN(CCc2ccncc2)CC1 ZINC001140055650 796471267 /nfs/dbraw/zinc/47/12/67/796471267.db2.gz NZABFCWASMJZNM-UHFFFAOYSA-N 1 2 315.392 2.287 20 10 DECDLO C[C@@]1(O)CC[N@H+](Cc2c(O)cccc2Br)C[C@@H]1F ZINC001140098419 796477464 /nfs/dbraw/zinc/47/74/64/796477464.db2.gz BGQHQSCPTXVWGQ-QWHCGFSZSA-N 1 2 318.186 2.450 20 10 DECDLO C[C@@]1(O)CC[N@@H+](Cc2c(O)cccc2Br)C[C@@H]1F ZINC001140098419 796477466 /nfs/dbraw/zinc/47/74/66/796477466.db2.gz BGQHQSCPTXVWGQ-QWHCGFSZSA-N 1 2 318.186 2.450 20 10 DECDLO C[C@@H]1C[N@@H+](Cc2ccc(N3CCOCC3)cc2F)C[C@H](C)O1 ZINC001140662332 796551865 /nfs/dbraw/zinc/55/18/65/796551865.db2.gz ONZJFWGAFIEJRE-OKILXGFUSA-N 1 2 308.397 2.272 20 10 DECDLO C[C@@H]1C[N@H+](Cc2ccc(N3CCOCC3)cc2F)C[C@H](C)O1 ZINC001140662332 796551868 /nfs/dbraw/zinc/55/18/68/796551868.db2.gz ONZJFWGAFIEJRE-OKILXGFUSA-N 1 2 308.397 2.272 20 10 DECDLO O=C(N1CCCC1)C12CC(C1)C[N@H+]2Cc1cc(F)c(F)cc1O ZINC001142517426 796747187 /nfs/dbraw/zinc/74/71/87/796747187.db2.gz MSWWUJCVGZQCKF-UHFFFAOYSA-N 1 2 322.355 2.257 20 10 DECDLO O=C(N1CCCC1)C12CC(C1)C[N@@H+]2Cc1cc(F)c(F)cc1O ZINC001142517426 796747190 /nfs/dbraw/zinc/74/71/90/796747190.db2.gz MSWWUJCVGZQCKF-UHFFFAOYSA-N 1 2 322.355 2.257 20 10 DECDLO CC(C)C(=O)NCCC[NH2+]Cc1cc(Cl)cc(F)c1O ZINC001201449977 798759808 /nfs/dbraw/zinc/75/98/08/798759808.db2.gz PFZXXQDUTYENME-UHFFFAOYSA-N 1 2 302.777 2.437 20 10 DECDLO OC[C@@H]1CCn2nccc2C[N@@H+]1Cc1cc(Cl)ccc1O ZINC001203664692 800102236 /nfs/dbraw/zinc/10/22/36/800102236.db2.gz QEIWMZGRRFLQDB-AWEZNQCLSA-N 1 2 307.781 2.009 20 10 DECDLO OC[C@@H]1CCn2nccc2C[N@H+]1Cc1cc(Cl)ccc1O ZINC001203664692 800102238 /nfs/dbraw/zinc/10/22/38/800102238.db2.gz QEIWMZGRRFLQDB-AWEZNQCLSA-N 1 2 307.781 2.009 20 10 DECDLO Oc1cc(O)c(C[NH+]2CCN(CC(F)F)CC2)cc1Cl ZINC001232262237 801831586 /nfs/dbraw/zinc/83/15/86/801831586.db2.gz CSOCGHHYHFUXMH-UHFFFAOYSA-N 1 2 306.740 2.134 20 10 DECDLO COc1cccc(C[N@H+](C)Cc2cc(O)c(O)c(O)c2)c1OC ZINC001233015734 802003528 /nfs/dbraw/zinc/00/35/28/802003528.db2.gz ZPWASQGPUAYLDA-UHFFFAOYSA-N 1 2 319.357 2.453 20 10 DECDLO COc1cccc(C[N@@H+](C)Cc2cc(O)c(O)c(O)c2)c1OC ZINC001233015734 802003537 /nfs/dbraw/zinc/00/35/37/802003537.db2.gz ZPWASQGPUAYLDA-UHFFFAOYSA-N 1 2 319.357 2.453 20 10 DECDLO COc1cccc2c1C[N@H+](Cc1cc(O)c(O)c(O)c1)CC2 ZINC001233010342 802003555 /nfs/dbraw/zinc/00/35/55/802003555.db2.gz PCJAQIYDCZFCSL-UHFFFAOYSA-N 1 2 301.342 2.370 20 10 DECDLO COc1cccc2c1C[N@@H+](Cc1cc(O)c(O)c(O)c1)CC2 ZINC001233010342 802003563 /nfs/dbraw/zinc/00/35/63/802003563.db2.gz PCJAQIYDCZFCSL-UHFFFAOYSA-N 1 2 301.342 2.370 20 10 DECDLO CC(C)C(=O)N[C@@H]1CCC[N@H+](Cc2c(O)ccc(F)c2F)C1 ZINC001233336454 802079609 /nfs/dbraw/zinc/07/96/09/802079609.db2.gz MEYFGYZXVCLZRE-LLVKDONJSA-N 1 2 312.360 2.407 20 10 DECDLO CC(C)C(=O)N[C@@H]1CCC[N@@H+](Cc2c(O)ccc(F)c2F)C1 ZINC001233336454 802079614 /nfs/dbraw/zinc/07/96/14/802079614.db2.gz MEYFGYZXVCLZRE-LLVKDONJSA-N 1 2 312.360 2.407 20 10 DECDLO Cc1ccnc(O[C@@H]2CC[N@@H+](Cc3c(O)ccc(F)c3F)C2)n1 ZINC001233336389 802079785 /nfs/dbraw/zinc/07/97/85/802079785.db2.gz KBJPEAKOZBWVQW-LLVKDONJSA-N 1 2 321.327 2.422 20 10 DECDLO COCC[NH+]1CCN(Cc2cccc(C(F)(F)F)c2O)CC1 ZINC001233416446 802111279 /nfs/dbraw/zinc/11/12/79/802111279.db2.gz IINCQLBTFORQEH-UHFFFAOYSA-N 1 2 318.339 2.175 20 10 DECDLO CCN1C[C@@H](C)[N@H+](Cc2ccc(C(F)(F)F)cc2O)CC1=O ZINC001233455480 802121584 /nfs/dbraw/zinc/12/15/84/802121584.db2.gz MKOJGJDQPYCIGU-SNVBAGLBSA-N 1 2 316.323 2.464 20 10 DECDLO Oc1c(F)cc(Cl)cc1C[NH2+]C[C@H](O)C1CCOCC1 ZINC001461218424 1058614272 /nfs/dbraw/zinc/61/42/72/1058614272.db2.gz QVZZTVAZGASHSM-ZDUSSCGKSA-N 1 2 303.761 2.062 20 10 DECDLO NC(=O)[C@H]([NH2+]Cc1cc(F)c(F)cc1O)c1ccc(F)cc1 ZINC001621229685 1078171591 /nfs/dbraw/zinc/17/15/91/1078171591.db2.gz KHMHZMRAJDVAMI-CQSZACIVSA-N 1 2 310.275 2.126 20 10 DECDLO C[C@@]1(CO)CC[N@H+](Cc2cc(F)cc(Br)c2O)C1 ZINC001235295695 1079011316 /nfs/dbraw/zinc/01/13/16/1079011316.db2.gz DTMQMQWFJOAHIU-CYBMUJFWSA-N 1 2 318.186 2.498 20 10 DECDLO C[C@@]1(CO)CC[N@@H+](Cc2cc(F)cc(Br)c2O)C1 ZINC001235295695 1079011321 /nfs/dbraw/zinc/01/13/21/1079011321.db2.gz DTMQMQWFJOAHIU-CYBMUJFWSA-N 1 2 318.186 2.498 20 10 DECDLO Oc1cc(Cl)ccc1C[NH2+]Cc1nc(C(F)(F)F)n[nH]1 ZINC001561058641 1075150497 /nfs/dbraw/zinc/15/04/97/1075150497.db2.gz XCFYSEMLFWEQMP-UHFFFAOYSA-N 1 2 306.675 2.472 20 10 DECDLO C[C@@H]([NH2+][C@@H](C)c1cccc(-c2nn[nH]n2)c1O)[C@H]1CCCOC1 ZINC001589949973 1076532801 /nfs/dbraw/zinc/53/28/01/1076532801.db2.gz PDXMTHXRNWOBBM-WOPDTQHZSA-N 1 2 317.393 2.038 20 10 DECDLO CC[C@@H]([NH2+]C[C@H](OC)C1CC1)c1cccc(-c2nn[nH]n2)c1O ZINC001590462465 1076631429 /nfs/dbraw/zinc/63/14/29/1076631429.db2.gz CQKUVAIOZJBCSB-KGLIPLIRSA-N 1 2 317.393 2.038 20 10 DECDLO CC[C@H]([NH2+]C[C@@H]1CCC=CO1)c1cccc(-c2nn[nH]n2)c1O ZINC001590466719 1076633178 /nfs/dbraw/zinc/63/31/78/1076633178.db2.gz MDUCYDDXIMWTJC-FZMZJTMJSA-N 1 2 315.377 2.306 20 10 DECDLO CC[C@@H]([NH2+]CCCOC(C)C)c1cccc(-c2nn[nH]n2)c1O ZINC001590467605 1076634371 /nfs/dbraw/zinc/63/43/71/1076634371.db2.gz RDGQGBQJNRLXEF-CQSZACIVSA-N 1 2 319.409 2.428 20 10 DECDLO CC[C@@H]([NH2+]CCC(C)(C)OC)c1cccc(-c2nn[nH]n2)c1O ZINC001590469025 1076635167 /nfs/dbraw/zinc/63/51/67/1076635167.db2.gz XFWUTADXMOZEGQ-CYBMUJFWSA-N 1 2 319.409 2.428 20 10 DECDLO C[N@H+](Cc1cc(-c2nn[nH]n2)cs1)Cc1cccc(F)c1O ZINC001591130867 1076710573 /nfs/dbraw/zinc/71/05/73/1076710573.db2.gz OKHGFCWJKCTTCT-UHFFFAOYSA-N 1 2 319.365 2.405 20 10 DECDLO C[N@@H+](Cc1cc(-c2nn[nH]n2)cs1)Cc1cccc(F)c1O ZINC001591130867 1076710574 /nfs/dbraw/zinc/71/05/74/1076710574.db2.gz OKHGFCWJKCTTCT-UHFFFAOYSA-N 1 2 319.365 2.405 20 10 DECDLO NC(=O)c1csc(C[NH2+]Cc2cc(Cl)c(F)cc2O)n1 ZINC001652841150 1079900784 /nfs/dbraw/zinc/90/07/84/1079900784.db2.gz IKZHCRFCTNFVMW-UHFFFAOYSA-N 1 2 315.757 2.030 20 10 DECDLO C[C@H](NC(=O)NCc1ccc[nH+]c1N)c1ccc(N(C)C)cc1 ZINC001671851940 1081543454 /nfs/dbraw/zinc/54/34/54/1081543454.db2.gz NDWTXCITHJGBRQ-LBPRGKRZSA-N 1 2 313.405 2.290 20 10 DECDLO Oc1c(F)cccc1C[NH+]1CC2(CN(Cc3ccc[nH]3)C2)C1 ZINC001276537931 1083484190 /nfs/dbraw/zinc/48/41/90/1083484190.db2.gz QPRQBKIMGWTQPM-UHFFFAOYSA-N 1 2 301.365 2.177 20 10 DECDLO COc1ccc(N2CC3(CC[N@@H+]3Cc3cc(C)nn3C)C2)cc1 ZINC001276927113 1083683994 /nfs/dbraw/zinc/68/39/94/1083683994.db2.gz LXMVZEQJWNEXQF-UHFFFAOYSA-N 1 2 312.417 2.202 20 10 DECDLO COc1ccc(N2CC3(CC[N@H+]3Cc3cc(C)nn3C)C2)cc1 ZINC001276927113 1083683997 /nfs/dbraw/zinc/68/39/97/1083683997.db2.gz LXMVZEQJWNEXQF-UHFFFAOYSA-N 1 2 312.417 2.202 20 10 DECDLO C[C@H]1C[N@H+](Cc2cc(F)cc(Br)c2O)C[C@@H]1O ZINC001235296580 1084376613 /nfs/dbraw/zinc/37/66/13/1084376613.db2.gz LHWAPWYOJBQQHG-CPCISQLKSA-N 1 2 304.159 2.106 20 10 DECDLO C[C@H]1C[N@@H+](Cc2cc(F)cc(Br)c2O)C[C@@H]1O ZINC001235296580 1084376625 /nfs/dbraw/zinc/37/66/25/1084376625.db2.gz LHWAPWYOJBQQHG-CPCISQLKSA-N 1 2 304.159 2.106 20 10 DECDLO COC(=O)C[C@@H]1C[N@H+](Cc2ccc(C(C)(C)C)cc2O)CCO1 ZINC001235681509 1084496131 /nfs/dbraw/zinc/49/61/31/1084496131.db2.gz AJYXUGSVHJOXHR-OAHLLOKOSA-N 1 2 321.417 2.454 20 10 DECDLO COC(=O)C[C@@H]1C[N@@H+](Cc2ccc(C(C)(C)C)cc2O)CCO1 ZINC001235681509 1084496136 /nfs/dbraw/zinc/49/61/36/1084496136.db2.gz AJYXUGSVHJOXHR-OAHLLOKOSA-N 1 2 321.417 2.454 20 10 DECDLO CC(C)NC(=O)N1C[C@H]2C[C@@H](C1)[N@H+]2Cc1ccc(Cl)cc1O ZINC001275270731 1091646744 /nfs/dbraw/zinc/64/67/44/1091646744.db2.gz HBLKPJHMPUOFDA-OKILXGFUSA-N 1 2 323.824 2.422 20 10 DECDLO CC(C)NC(=O)N1C[C@H]2C[C@@H](C1)[N@@H+]2Cc1ccc(Cl)cc1O ZINC001275270731 1091646754 /nfs/dbraw/zinc/64/67/54/1091646754.db2.gz HBLKPJHMPUOFDA-OKILXGFUSA-N 1 2 323.824 2.422 20 10 DECDLO CC[NH+]1C[C@@H]2C[NH+](Cc3ccc(OC)c(Cl)c3[O-])C[C@H]2C1 ZINC001236817001 1138436320 /nfs/dbraw/zinc/43/63/20/1138436320.db2.gz AWHXHTGRFOVEBR-CHWSQXEVSA-N 1 2 310.825 2.438 20 10 DECDLO CC[NH+]1C[C@@H]2CN(Cc3ccc(OC)c(Cl)c3O)C[C@H]2C1 ZINC001236817001 1138436325 /nfs/dbraw/zinc/43/63/25/1138436325.db2.gz AWHXHTGRFOVEBR-CHWSQXEVSA-N 1 2 310.825 2.438 20 10 DECDLO CC(=O)N[C@@H]1CC[N@H+](Cc2c(O)ccc(Cl)c2Cl)C1 ZINC001237085309 1138499825 /nfs/dbraw/zinc/49/98/25/1138499825.db2.gz XSKVRYWEOHFSAE-SECBINFHSA-N 1 2 303.189 2.409 20 10 DECDLO CC(=O)N[C@@H]1CC[N@@H+](Cc2c(O)ccc(Cl)c2Cl)C1 ZINC001237085309 1138499827 /nfs/dbraw/zinc/49/98/27/1138499827.db2.gz XSKVRYWEOHFSAE-SECBINFHSA-N 1 2 303.189 2.409 20 10 DECDLO CCOC(=O)C1=C(O)CC[N@H+](Cc2ccc(C(C)C)cc2O)C1 ZINC001237044961 1138488290 /nfs/dbraw/zinc/48/82/90/1138488290.db2.gz GEOKOHWFNOAUEY-OAHLLOKOSA-N 1 2 319.401 2.470 20 10 DECDLO CCOC(=O)C1=C(O)CC[N@@H+](Cc2ccc(C(C)C)cc2O)C1 ZINC001237044961 1138488298 /nfs/dbraw/zinc/48/82/98/1138488298.db2.gz GEOKOHWFNOAUEY-OAHLLOKOSA-N 1 2 319.401 2.470 20 10 DECDLO CCOC(=O)[C@@H]1C[N@H+](Cc2ccc(C(C)C)cc2O)CCC1=O ZINC001237044961 1138488301 /nfs/dbraw/zinc/48/83/01/1138488301.db2.gz GEOKOHWFNOAUEY-OAHLLOKOSA-N 1 2 319.401 2.470 20 10 DECDLO CCOC(=O)[C@@H]1C[N@@H+](Cc2ccc(C(C)C)cc2O)CCC1=O ZINC001237044961 1138488310 /nfs/dbraw/zinc/48/83/10/1138488310.db2.gz GEOKOHWFNOAUEY-OAHLLOKOSA-N 1 2 319.401 2.470 20 10 DECDLO O=C1C[N@H+](Cc2cc(-c3ccc(F)cc3)ccc2O)CCN1 ZINC001237641115 1138731641 /nfs/dbraw/zinc/73/16/41/1138731641.db2.gz MBJKBRASTMCKIP-UHFFFAOYSA-N 1 2 300.333 2.130 20 10 DECDLO O=C1C[N@@H+](Cc2cc(-c3ccc(F)cc3)ccc2O)CCN1 ZINC001237641115 1138731650 /nfs/dbraw/zinc/73/16/50/1138731650.db2.gz MBJKBRASTMCKIP-UHFFFAOYSA-N 1 2 300.333 2.130 20 10 DECDLO CCOC(=O)[C@@H]1CCCC[N@@H+]1Cc1cc(OC)cc(OC)c1O ZINC001237675971 1138749863 /nfs/dbraw/zinc/74/98/63/1138749863.db2.gz IJQXUNIYVZYILE-AWEZNQCLSA-N 1 2 323.389 2.327 20 10 DECDLO CCOC(=O)[C@@H]1CCCC[N@H+]1Cc1cc(OC)cc(OC)c1O ZINC001237675971 1138749887 /nfs/dbraw/zinc/74/98/87/1138749887.db2.gz IJQXUNIYVZYILE-AWEZNQCLSA-N 1 2 323.389 2.327 20 10 DECDLO COC[C@@H]1C[N@H+](Cc2cc(F)cc(C)c2O)Cc2ncn(C)c21 ZINC001238060803 1138819397 /nfs/dbraw/zinc/81/93/97/1138819397.db2.gz JFJMCNBJKXFCHY-ZDUSSCGKSA-N 1 2 319.380 2.319 20 10 DECDLO COC[C@@H]1C[N@@H+](Cc2cc(F)cc(C)c2O)Cc2ncn(C)c21 ZINC001238060803 1138819399 /nfs/dbraw/zinc/81/93/99/1138819399.db2.gz JFJMCNBJKXFCHY-ZDUSSCGKSA-N 1 2 319.380 2.319 20 10 DECDLO CCN(CC)c1ccc(CN(C)C(=O)C[C@H]([NH3+])C(F)F)cc1 ZINC001341641872 1143646996 /nfs/dbraw/zinc/64/69/96/1143646996.db2.gz AHYMWHZGKUNEKB-AWEZNQCLSA-N 1 2 313.392 2.474 20 10 DECDLO C[C@H]1CN(C(=O)C=Cc2c[nH]c[nH+]2)c2ccccc2N(C)C1=O ZINC000492900958 249168571 /nfs/dbraw/zinc/16/85/71/249168571.db2.gz OFZONXSTWCBQCZ-GUOLPTJISA-N 1 2 310.357 2.069 20 10 DECDLO CCN(CCC[NH+](C)C)Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000289393022 131383067 /nfs/dbraw/zinc/38/30/67/131383067.db2.gz FHVUXDLXPFMXLZ-UHFFFAOYSA-N 1 2 311.382 2.083 20 10 DECDLO Cc1ccc(C(=O)N2CCCC[C@@H]2c2[nH]cc[nH+]2)c(O)c1O ZINC000177677587 292051919 /nfs/dbraw/zinc/05/19/19/292051919.db2.gz KXGKKZGEXQHGJS-GFCCVEGCSA-N 1 2 301.346 2.497 20 10 DECDLO CC(=O)c1cc(Cl)cc(C[NH+]2CCC(CC(N)=O)CC2)c1O ZINC000129068284 401798404 /nfs/dbraw/zinc/79/84/04/401798404.db2.gz GDHAQIMMBCSVQT-UHFFFAOYSA-N 1 2 324.808 2.336 20 10 DECDLO CC(=O)c1cc(Cl)cc(C[N@@H+](C)[C@H](C)C[S@](C)=O)c1O ZINC000126220384 402269980 /nfs/dbraw/zinc/26/99/80/402269980.db2.gz MBRGQBUNEYFKDP-GSDQLPOLSA-N 1 2 317.838 2.447 20 10 DECDLO CC(=O)c1cc(Cl)cc(C[N@H+](C)[C@H](C)C[S@](C)=O)c1O ZINC000126220384 402269982 /nfs/dbraw/zinc/26/99/82/402269982.db2.gz MBRGQBUNEYFKDP-GSDQLPOLSA-N 1 2 317.838 2.447 20 10 DECDLO C[C@H]([NH2+]CC(F)(F)CO)c1cc(Br)ccc1O ZINC000184694046 402292014 /nfs/dbraw/zinc/29/20/14/402292014.db2.gz DMEIVXUFQHSPSG-ZETCQYMHSA-N 1 2 310.138 2.433 20 10 DECDLO COc1c(O)c(C[N@@H+]2CCO[C@@H]3CCC[C@@H]32)ccc1[N+](=O)[O-] ZINC000278247139 402862440 /nfs/dbraw/zinc/86/24/40/402862440.db2.gz OTKOAGVQTVOMQI-WCQYABFASA-N 1 2 308.334 2.062 20 10 DECDLO COc1c(O)c(C[N@H+]2CCO[C@@H]3CCC[C@@H]32)ccc1[N+](=O)[O-] ZINC000278247139 402862441 /nfs/dbraw/zinc/86/24/41/402862441.db2.gz OTKOAGVQTVOMQI-WCQYABFASA-N 1 2 308.334 2.062 20 10 DECDLO CS(=O)(=O)CC[N@H+](Cc1c(O)cccc1Cl)C1CC1 ZINC000271202666 403278119 /nfs/dbraw/zinc/27/81/19/403278119.db2.gz YCGOHVXKZXKZLA-UHFFFAOYSA-N 1 2 303.811 2.055 20 10 DECDLO CS(=O)(=O)CC[N@@H+](Cc1c(O)cccc1Cl)C1CC1 ZINC000271202666 403278121 /nfs/dbraw/zinc/27/81/21/403278121.db2.gz YCGOHVXKZXKZLA-UHFFFAOYSA-N 1 2 303.811 2.055 20 10 DECDLO CCN(CC)c1ccc(C[NH2+][C@H](C(N)=O)c2ccccn2)cc1 ZINC000295110339 403763606 /nfs/dbraw/zinc/76/36/06/403763606.db2.gz LOTAZBABVBKLJN-KRWDZBQOSA-N 1 2 312.417 2.244 20 10 DECDLO COC(=O)[C@]1(F)CC[N@H+](Cc2cc(Cl)c(F)cc2O)C1 ZINC000294377494 403717674 /nfs/dbraw/zinc/71/76/74/403717674.db2.gz UQJSBRGWWDBCJM-ZDUSSCGKSA-N 1 2 305.708 2.272 20 10 DECDLO COC(=O)[C@]1(F)CC[N@@H+](Cc2cc(Cl)c(F)cc2O)C1 ZINC000294377494 403717678 /nfs/dbraw/zinc/71/76/78/403717678.db2.gz UQJSBRGWWDBCJM-ZDUSSCGKSA-N 1 2 305.708 2.272 20 10 DECDLO CC(=O)N1CCC[N@H+](Cc2cc(Cl)c(F)cc2O)CC1 ZINC000294991013 403739364 /nfs/dbraw/zinc/73/93/64/403739364.db2.gz UCHOYCWPWIPYBS-UHFFFAOYSA-N 1 2 300.761 2.239 20 10 DECDLO CC(=O)N1CCC[N@@H+](Cc2cc(Cl)c(F)cc2O)CC1 ZINC000294991013 403739378 /nfs/dbraw/zinc/73/93/78/403739378.db2.gz UCHOYCWPWIPYBS-UHFFFAOYSA-N 1 2 300.761 2.239 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@@H+]2CCO[C@]3(CCO[C@H]3C)C2)c1O ZINC000365562497 404691565 /nfs/dbraw/zinc/69/15/65/404691565.db2.gz YJJVVLVIRSAJLC-YVEFUNNKSA-N 1 2 323.364 2.114 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@H+]2CCO[C@]3(CCO[C@H]3C)C2)c1O ZINC000365562497 404691567 /nfs/dbraw/zinc/69/15/67/404691567.db2.gz YJJVVLVIRSAJLC-YVEFUNNKSA-N 1 2 323.364 2.114 20 10 DECDLO Cc1ccc(C(=O)N2CCC[C@@H](c3[nH+]ccn3C)C2)c(O)c1O ZINC000373117769 227103760 /nfs/dbraw/zinc/10/37/60/227103760.db2.gz KEZMOFJZOAVPLX-GFCCVEGCSA-N 1 2 315.373 2.160 20 10 DECDLO COC(=O)c1ccc(O)c([C@@H](C)[NH2+]Cc2nn(C)cc2Cl)c1 ZINC000834883889 649857113 /nfs/dbraw/zinc/85/71/13/649857113.db2.gz UPAPHNYKKSCJRQ-SECBINFHSA-N 1 2 323.780 2.417 20 10 DECDLO Cn1cc2c(n1)CCC[C@H]2[NH2+]Cc1cc([N+](=O)[O-])ccc1O ZINC000280046319 294325811 /nfs/dbraw/zinc/32/58/11/294325811.db2.gz JIHCVRCYCSQSEU-CYBMUJFWSA-N 1 2 302.334 2.201 20 10 DECDLO C[C@H]([NH2+]C[C@@H]1COCCN1)c1ccc(Cl)c(Cl)c1O ZINC000530228240 335971311 /nfs/dbraw/zinc/97/13/11/335971311.db2.gz ZFIRQHSEUGJKDI-DTWKUNHWSA-N 1 2 305.205 2.338 20 10 DECDLO C[C@H](CC(=O)N1CCOc2cc(N(C)C)ccc21)n1cc[nH+]c1 ZINC000516476514 338013356 /nfs/dbraw/zinc/01/33/56/338013356.db2.gz RUSYOXJPOFARPP-CYBMUJFWSA-N 1 2 314.389 2.326 20 10 DECDLO Cc1ccc(O)c(C[N@@H+]2CCNC(=O)[C@@H]2c2cccs2)c1 ZINC000377243495 534194282 /nfs/dbraw/zinc/19/42/82/534194282.db2.gz JMWCQMTYYRJROG-HNNXBMFYSA-N 1 2 302.399 2.435 20 10 DECDLO Cc1ccc(O)c(C[N@H+]2CCNC(=O)[C@@H]2c2cccs2)c1 ZINC000377243495 534194286 /nfs/dbraw/zinc/19/42/86/534194286.db2.gz JMWCQMTYYRJROG-HNNXBMFYSA-N 1 2 302.399 2.435 20 10 DECDLO CC[N@@H+](Cc1cc(F)cc(C(C)=O)c1O)C[C@@H](O)C(F)(F)F ZINC000189525606 521291864 /nfs/dbraw/zinc/29/18/64/521291864.db2.gz JWTUFBZLUNPDOM-GFCCVEGCSA-N 1 2 323.286 2.479 20 10 DECDLO CC[N@H+](Cc1cc(F)cc(C(C)=O)c1O)C[C@@H](O)C(F)(F)F ZINC000189525606 521291881 /nfs/dbraw/zinc/29/18/81/521291881.db2.gz JWTUFBZLUNPDOM-GFCCVEGCSA-N 1 2 323.286 2.479 20 10 DECDLO CCS(=O)(=O)C[C@@H](C)[N@H+](C)Cc1cccc(Cl)c1O ZINC000180255801 521647223 /nfs/dbraw/zinc/64/72/23/521647223.db2.gz IPMOLWDRFWKRTE-SNVBAGLBSA-N 1 2 305.827 2.301 20 10 DECDLO CCS(=O)(=O)C[C@@H](C)[N@@H+](C)Cc1cccc(Cl)c1O ZINC000180255801 521647226 /nfs/dbraw/zinc/64/72/26/521647226.db2.gz IPMOLWDRFWKRTE-SNVBAGLBSA-N 1 2 305.827 2.301 20 10 DECDLO Cc1cc(Br)cc(C[N@@H+]2C[C@@H](F)C[C@H]2CO)c1O ZINC000364842768 526156722 /nfs/dbraw/zinc/15/67/22/526156722.db2.gz JWNMJYYEDVAUCH-RYUDHWBXSA-N 1 2 318.186 2.368 20 10 DECDLO Cc1cc(Br)cc(C[N@H+]2C[C@@H](F)C[C@H]2CO)c1O ZINC000364842768 526156730 /nfs/dbraw/zinc/15/67/30/526156730.db2.gz JWNMJYYEDVAUCH-RYUDHWBXSA-N 1 2 318.186 2.368 20 10 DECDLO CC[C@@H](CNCc1ccc(OC)c(OC)c1O)[NH+]1CCCC1 ZINC000892556033 625145812 /nfs/dbraw/zinc/14/58/12/625145812.db2.gz ZLISCFISVHSDMB-AWEZNQCLSA-N 1 2 308.422 2.373 20 10 DECDLO Cc1cc(N(C)C)ccc1C[NH+]1CC(OC(=O)NC(C)C)C1 ZINC000840952512 650394545 /nfs/dbraw/zinc/39/45/45/650394545.db2.gz CDTUDFHNHRRINT-UHFFFAOYSA-N 1 2 305.422 2.380 20 10 DECDLO O=C1NC2(CO1)CC[NH+](Cc1cc(Cl)cc(F)c1O)CC2 ZINC000753586837 639318226 /nfs/dbraw/zinc/31/82/26/639318226.db2.gz JYLJFQULIGMJRB-UHFFFAOYSA-N 1 2 314.744 2.259 20 10 DECDLO CCn1c[nH+]c2c1CCN(Cc1cc(OC)c(OC)cc1O)C2 ZINC000897334193 639499196 /nfs/dbraw/zinc/49/91/96/639499196.db2.gz NNQKWKOVJDHYTN-UHFFFAOYSA-N 1 2 317.389 2.184 20 10 DECDLO COCCN1CC[C@H]([NH2+][C@H](C)c2cc(F)cc(F)c2O)C1 ZINC000756549755 639673015 /nfs/dbraw/zinc/67/30/15/639673015.db2.gz HFNDBIREWZUFAJ-PWSUYJOCSA-N 1 2 300.349 2.042 20 10 DECDLO CS[C@H](CO)[C@H](C)[NH2+]Cc1cccc(Br)c1O ZINC000219044778 639912934 /nfs/dbraw/zinc/91/29/34/639912934.db2.gz NRWIMIVVOWICAJ-GZMMTYOYSA-N 1 2 320.252 2.357 20 10 DECDLO C[C@H]([NH2+]Cc1nnc2n1CCCC2)c1cc(F)cc(F)c1O ZINC000760869966 640237588 /nfs/dbraw/zinc/23/75/88/640237588.db2.gz NTKRMSVRHPDJTH-VIFPVBQESA-N 1 2 308.332 2.449 20 10 DECDLO CCO[C@@H]1COCC[C@H]1[NH2+]Cc1cc(Cl)cc(F)c1O ZINC000761223926 640287769 /nfs/dbraw/zinc/28/77/69/640287769.db2.gz VGIWSPWIBQRIFL-CHWSQXEVSA-N 1 2 303.761 2.468 20 10 DECDLO O=C(/C=C/c1ccc(O)c(O)c1)N1CCC[C@H](n2cc[nH+]c2)C1 ZINC000779513849 642506904 /nfs/dbraw/zinc/50/69/04/642506904.db2.gz YJMSOVCSKCHDRT-YVZNUBBCSA-N 1 2 313.357 2.171 20 10 DECDLO COc1cccc(C[N@H+](CCO)Cc2cccnc2Cl)c1O ZINC000793364966 644240997 /nfs/dbraw/zinc/24/09/97/644240997.db2.gz CYFSDGGGRIPSTO-UHFFFAOYSA-N 1 2 322.792 2.444 20 10 DECDLO COc1cccc(C[N@@H+](CCO)Cc2cccnc2Cl)c1O ZINC000793364966 644241002 /nfs/dbraw/zinc/24/10/02/644241002.db2.gz CYFSDGGGRIPSTO-UHFFFAOYSA-N 1 2 322.792 2.444 20 10 DECDLO COc1cccc(O)c1C[NH2+][C@@H]1CS(=O)(=O)c2ccccc21 ZINC000809754570 646277226 /nfs/dbraw/zinc/27/72/26/646277226.db2.gz FSDJRXZVOAKFDW-CYBMUJFWSA-N 1 2 319.382 2.019 20 10 DECDLO COCC[N@H+](CC(=O)OC)Cc1ccc2ccccc2c1O ZINC000816512096 647144317 /nfs/dbraw/zinc/14/43/17/647144317.db2.gz XMEFHVMFFVOPLQ-UHFFFAOYSA-N 1 2 303.358 2.167 20 10 DECDLO COCC[N@@H+](CC(=O)OC)Cc1ccc2ccccc2c1O ZINC000816512096 647144320 /nfs/dbraw/zinc/14/43/20/647144320.db2.gz XMEFHVMFFVOPLQ-UHFFFAOYSA-N 1 2 303.358 2.167 20 10 DECDLO COc1ccc(N2CC[NH+](Cc3conc3C)CC2)cc1F ZINC000816519930 647146122 /nfs/dbraw/zinc/14/61/22/647146122.db2.gz AMUFNJDGNXMXKZ-UHFFFAOYSA-N 1 2 305.353 2.453 20 10 DECDLO CC[C@H]([NH2+][C@H]1CCC(=O)N(C)C1=O)c1cccc(Cl)c1O ZINC000818362304 647458300 /nfs/dbraw/zinc/45/83/00/647458300.db2.gz UUGYTOVRYNCMTD-RYUDHWBXSA-N 1 2 310.781 2.234 20 10 DECDLO OCCCN1CCC[C@H]([NH2+]Cc2cc(Cl)cc(F)c2O)C1 ZINC000824583509 648616965 /nfs/dbraw/zinc/61/69/65/648616965.db2.gz NTPCMOKSVPIWMM-ZDUSSCGKSA-N 1 2 316.804 2.121 20 10 DECDLO Oc1cc(Br)ccc1C[N@H+]1CCC2(C1)OCCO2 ZINC000824702398 648638604 /nfs/dbraw/zinc/63/86/04/648638604.db2.gz PIXUFNSPSVDFFY-UHFFFAOYSA-N 1 2 314.179 2.104 20 10 DECDLO O=[S@@](CC[NH2+]Cc1cccc(Cl)c1O)CC(F)(F)F ZINC000826868658 648940433 /nfs/dbraw/zinc/94/04/33/648940433.db2.gz UVWYINFOOSLSPS-IBGZPJMESA-N 1 2 315.744 2.446 20 10 DECDLO O=C(NCc1cc(Cl)ccc1O)[C@H]1CCn2c[nH+]cc2C1 ZINC000846477927 651332799 /nfs/dbraw/zinc/33/27/99/651332799.db2.gz XSOKYDKUUFDLGT-JTQLQIEISA-N 1 2 305.765 2.121 20 10 DECDLO C[C@H]([NH2+]Cc1nc(C(N)=O)cs1)c1ccc(N(C)C)cc1 ZINC000850541495 651948912 /nfs/dbraw/zinc/94/89/12/651948912.db2.gz WRRLMZWRTVVEJR-JTQLQIEISA-N 1 2 304.419 2.159 20 10 DECDLO Oc1cc2c(cc1CN1CC[NH+]([C@@H]3CCOC3)CC1)CCCC2 ZINC000853552489 652567153 /nfs/dbraw/zinc/56/71/53/652567153.db2.gz GULYJAYMSBPPRQ-GOSISDBHSA-N 1 2 316.445 2.178 20 10 DECDLO Oc1c(Br)cccc1C[NH2+]C[C@H]1CC[C@H](O)C1 ZINC000188845152 684364642 /nfs/dbraw/zinc/36/46/42/684364642.db2.gz OJDZNAOEQTWFMK-ONGXEEELSA-N 1 2 300.196 2.405 20 10 DECDLO C[C@H](C[S@@](C)=O)[N@H+](C)Cc1cc(F)c(N(C)C)cc1F ZINC000862324336 686276379 /nfs/dbraw/zinc/27/63/79/686276379.db2.gz JYQPFYGNXQOKED-CFMSYZGJSA-N 1 2 304.406 2.230 20 10 DECDLO C[C@H](C[S@@](C)=O)[N@@H+](C)Cc1cc(F)c(N(C)C)cc1F ZINC000862324336 686276386 /nfs/dbraw/zinc/27/63/86/686276386.db2.gz JYQPFYGNXQOKED-CFMSYZGJSA-N 1 2 304.406 2.230 20 10 DECDLO CC[C@@H](C(=O)N1Cc2cccc(O)c2C1)[N@@H+]1CCO[C@@H](CC)C1 ZINC000871205512 688749168 /nfs/dbraw/zinc/74/91/68/688749168.db2.gz USADANOAZUGIQH-HOCLYGCPSA-N 1 2 318.417 2.124 20 10 DECDLO CC[C@@H](C(=O)N1Cc2cccc(O)c2C1)[N@H+]1CCO[C@@H](CC)C1 ZINC000871205512 688749170 /nfs/dbraw/zinc/74/91/70/688749170.db2.gz USADANOAZUGIQH-HOCLYGCPSA-N 1 2 318.417 2.124 20 10 DECDLO OC1CCN(c2ccc(C[NH2+]Cc3ccon3)cc2F)CC1 ZINC000873022288 689143234 /nfs/dbraw/zinc/14/32/34/689143234.db2.gz SUBYQOHSLXBUML-UHFFFAOYSA-N 1 2 305.353 2.065 20 10 DECDLO Fc1cc(C[NH2+]Cc2ccon2)cc(F)c1N1CCOCC1 ZINC000873131719 689165823 /nfs/dbraw/zinc/16/58/23/689165823.db2.gz XYWWPXLGDNUZDL-UHFFFAOYSA-N 1 2 309.316 2.079 20 10 DECDLO COCC[N@H+](CC(=O)OC(C)(C)C)Cc1c(C)cccc1O ZINC000876658959 689892485 /nfs/dbraw/zinc/89/24/85/689892485.db2.gz KFXXXPWXGWHWFF-UHFFFAOYSA-N 1 2 309.406 2.491 20 10 DECDLO COCC[N@@H+](CC(=O)OC(C)(C)C)Cc1c(C)cccc1O ZINC000876658959 689892488 /nfs/dbraw/zinc/89/24/88/689892488.db2.gz KFXXXPWXGWHWFF-UHFFFAOYSA-N 1 2 309.406 2.491 20 10 DECDLO COCC[N@H+]1[C@H](C)CN(Cc2ccc(F)c(F)c2O)C[C@@H]1C ZINC000877606345 690165795 /nfs/dbraw/zinc/16/57/95/690165795.db2.gz XYJPPKIBMPFCRX-TXEJJXNPSA-N 1 2 314.376 2.211 20 10 DECDLO COCC[N@@H+]1[C@H](C)CN(Cc2ccc(F)c(F)c2O)C[C@@H]1C ZINC000877606345 690165799 /nfs/dbraw/zinc/16/57/99/690165799.db2.gz XYJPPKIBMPFCRX-TXEJJXNPSA-N 1 2 314.376 2.211 20 10 DECDLO CNC(=O)C[N@H+](Cc1ccccc1)Cc1c(O)cccc1OC ZINC000877771828 690220910 /nfs/dbraw/zinc/22/09/10/690220910.db2.gz DNJBVKDLHHLKDF-UHFFFAOYSA-N 1 2 314.385 2.149 20 10 DECDLO CNC(=O)C[N@@H+](Cc1ccccc1)Cc1c(O)cccc1OC ZINC000877771828 690220914 /nfs/dbraw/zinc/22/09/14/690220914.db2.gz DNJBVKDLHHLKDF-UHFFFAOYSA-N 1 2 314.385 2.149 20 10 DECDLO CCNc1cc(CNC(=O)NCc2c(O)cccc2F)cc[nH+]1 ZINC001347913771 1151106164 /nfs/dbraw/zinc/10/61/64/1151106164.db2.gz IBXWAYBCWTYACF-UHFFFAOYSA-N 1 2 318.352 2.358 20 10 DECDLO COc1c[nH+]c(NCCc2cc(O)c(O)cc2O)c2[nH]ccc21 ZINC001168006328 779274697 /nfs/dbraw/zinc/27/46/97/779274697.db2.gz LRRODGSKWRPTNL-UHFFFAOYSA-N 1 2 315.329 2.343 20 10 DECDLO OC[C@H]1CCC[N@H+](Cc2cc(Br)c(F)cc2O)C1 ZINC001144299222 790847902 /nfs/dbraw/zinc/84/79/02/790847902.db2.gz SAVUVZCMZDEEMN-VIFPVBQESA-N 1 2 318.186 2.498 20 10 DECDLO OC[C@H]1CCC[N@@H+](Cc2cc(Br)c(F)cc2O)C1 ZINC001144299222 790847914 /nfs/dbraw/zinc/84/79/14/790847914.db2.gz SAVUVZCMZDEEMN-VIFPVBQESA-N 1 2 318.186 2.498 20 10 DECDLO C[C@H]1C[N@H+](Cc2cc(Br)c(F)cc2O)C[C@H]1O ZINC001144299324 790848607 /nfs/dbraw/zinc/84/86/07/790848607.db2.gz WFTBRFXWGZGFBW-JVXZTZIISA-N 1 2 304.159 2.106 20 10 DECDLO Oc1ccc(F)cc1C[NH2+]Cc1n[nH]cc1Br ZINC000718213979 784483537 /nfs/dbraw/zinc/48/35/37/784483537.db2.gz MIQJJUWZWUPJNI-UHFFFAOYSA-N 1 2 300.131 2.307 20 10 DECDLO O=C(C1CC1)[C@H]1C[N@H+](Cc2ccc(N3CCCC3)cc2)CCO1 ZINC001117641945 795092373 /nfs/dbraw/zinc/09/23/73/795092373.db2.gz PRTTZBZERRHTPT-GOSISDBHSA-N 1 2 314.429 2.467 20 10 DECDLO O=C(C1CC1)[C@H]1C[N@@H+](Cc2ccc(N3CCCC3)cc2)CCO1 ZINC001117641945 795092379 /nfs/dbraw/zinc/09/23/79/795092379.db2.gz PRTTZBZERRHTPT-GOSISDBHSA-N 1 2 314.429 2.467 20 10 DECDLO NC(=[NH2+])N(C(=O)/C=C/c1ccc(O)c(O)c1)c1ccccc1F ZINC001179689755 795154119 /nfs/dbraw/zinc/15/41/19/795154119.db2.gz YELKRNFCAGNGGM-SOFGYWHQSA-N 1 2 315.304 2.177 20 10 DECDLO COc1c(O)c(C[NH2+]Cc2c(O)cccc2F)ccc1[N+](=O)[O-] ZINC001183920357 795962414 /nfs/dbraw/zinc/96/24/14/795962414.db2.gz XGMARLZFAWVLIN-UHFFFAOYSA-N 1 2 322.292 2.444 20 10 DECDLO CC(=O)[C@H]1C[N@H+](Cc2ccc(N3CCCCC3)cc2)CCO1 ZINC001138222080 796185070 /nfs/dbraw/zinc/18/50/70/796185070.db2.gz GDWKZAJHJLOAOO-GOSISDBHSA-N 1 2 302.418 2.467 20 10 DECDLO CC(=O)[C@H]1C[N@@H+](Cc2ccc(N3CCCCC3)cc2)CCO1 ZINC001138222080 796185072 /nfs/dbraw/zinc/18/50/72/796185072.db2.gz GDWKZAJHJLOAOO-GOSISDBHSA-N 1 2 302.418 2.467 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CC[C@](C)(CO)C1 ZINC001139126272 796327246 /nfs/dbraw/zinc/32/72/46/796327246.db2.gz DDZVSHGAZBIPBD-KRWDZBQOSA-N 1 2 303.358 2.011 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CC[C@](C)(CO)C1 ZINC001139126272 796327249 /nfs/dbraw/zinc/32/72/49/796327249.db2.gz DDZVSHGAZBIPBD-KRWDZBQOSA-N 1 2 303.358 2.011 20 10 DECDLO CCOC(=O)CC[N@H+](CC(=O)OCC)Cc1ccc(C)cc1O ZINC001140949879 796605230 /nfs/dbraw/zinc/60/52/30/796605230.db2.gz OFPHBLZVFUZFNW-UHFFFAOYSA-N 1 2 323.389 2.019 20 10 DECDLO CCOC(=O)CC[N@@H+](CC(=O)OCC)Cc1ccc(C)cc1O ZINC001140949879 796605232 /nfs/dbraw/zinc/60/52/32/796605232.db2.gz OFPHBLZVFUZFNW-UHFFFAOYSA-N 1 2 323.389 2.019 20 10 DECDLO Cc1cc(C)c(CNC(=O)c2ccc3[nH+]c(N)[nH]c3c2)c(O)c1 ZINC001156978642 798121735 /nfs/dbraw/zinc/12/17/35/798121735.db2.gz ANKZBWSMNVDZGW-UHFFFAOYSA-N 1 2 310.357 2.398 20 10 DECDLO COc1ccc2c(c1)c1c(n2C)CCN(c2cc(N)nc[nH+]2)C1 ZINC001166818966 799956146 /nfs/dbraw/zinc/95/61/46/799956146.db2.gz ZICBHCYLOFAMTJ-UHFFFAOYSA-N 1 2 309.373 2.122 20 10 DECDLO COC(=O)c1cccc2c1CC[N@H+](Cc1ccc(O)c(O)c1)C2 ZINC001203881605 800140125 /nfs/dbraw/zinc/14/01/25/800140125.db2.gz RDPCDVIDSGRAPZ-UHFFFAOYSA-N 1 2 313.353 2.443 20 10 DECDLO COC(=O)c1cccc2c1CC[N@@H+](Cc1ccc(O)c(O)c1)C2 ZINC001203881605 800140130 /nfs/dbraw/zinc/14/01/30/800140130.db2.gz RDPCDVIDSGRAPZ-UHFFFAOYSA-N 1 2 313.353 2.443 20 10 DECDLO COc1cc(C[N@@H+]2CCc3ncc(C)cc3C2)cc(O)c1O ZINC001204349378 800207216 /nfs/dbraw/zinc/20/72/16/800207216.db2.gz SFAPSEXMAXSAFZ-UHFFFAOYSA-N 1 2 300.358 2.368 20 10 DECDLO COc1cc(C[N@H+]2CCc3ncc(C)cc3C2)cc(O)c1O ZINC001204349378 800207218 /nfs/dbraw/zinc/20/72/18/800207218.db2.gz SFAPSEXMAXSAFZ-UHFFFAOYSA-N 1 2 300.358 2.368 20 10 DECDLO COc1ccc(N2CC[NH+](Cc3cnoc3)CC2)c(OC)c1 ZINC001205732194 800411067 /nfs/dbraw/zinc/41/10/67/800411067.db2.gz OVQZWXYWFIPXRY-UHFFFAOYSA-N 1 2 303.362 2.014 20 10 DECDLO Oc1cc(F)c(F)cc1C[N@@H+]1CCO[C@]2(CCSC2)C1 ZINC001206392905 800524375 /nfs/dbraw/zinc/52/43/75/800524375.db2.gz NPVRZYPPCHBWFZ-CQSZACIVSA-N 1 2 301.358 2.378 20 10 DECDLO Oc1cc(F)c(F)cc1C[N@H+]1CCO[C@]2(CCSC2)C1 ZINC001206392905 800524377 /nfs/dbraw/zinc/52/43/77/800524377.db2.gz NPVRZYPPCHBWFZ-CQSZACIVSA-N 1 2 301.358 2.378 20 10 DECDLO C[N@@H+]1CC[C@@H](Oc2ccc3c(c2)C(=O)c2ccc(O)cc2C3=O)C1 ZINC001229192643 801239692 /nfs/dbraw/zinc/23/96/92/801239692.db2.gz RFPBLXFDALVEQY-CYBMUJFWSA-N 1 2 323.348 2.251 20 10 DECDLO C[N@H+]1CC[C@@H](Oc2ccc3c(c2)C(=O)c2ccc(O)cc2C3=O)C1 ZINC001229192643 801239698 /nfs/dbraw/zinc/23/96/98/801239698.db2.gz RFPBLXFDALVEQY-CYBMUJFWSA-N 1 2 323.348 2.251 20 10 DECDLO CN1C(=O)CC[C@H]2C[N@@H+](Cc3cccc(Cl)c3O)CC[C@H]21 ZINC001231913913 801749913 /nfs/dbraw/zinc/74/99/13/801749913.db2.gz UERFYRQVMVNXHV-SMDDNHRTSA-N 1 2 308.809 2.488 20 10 DECDLO CN1C(=O)CC[C@H]2C[N@H+](Cc3cccc(Cl)c3O)CC[C@H]21 ZINC001231913913 801749916 /nfs/dbraw/zinc/74/99/16/801749916.db2.gz UERFYRQVMVNXHV-SMDDNHRTSA-N 1 2 308.809 2.488 20 10 DECDLO CN(C)C(=O)NC1CC[NH+](Cc2cccc(Cl)c2O)CC1 ZINC001231913685 801750277 /nfs/dbraw/zinc/75/02/77/801750277.db2.gz PGTGTUWCGAOSTE-UHFFFAOYSA-N 1 2 311.813 2.281 20 10 DECDLO COc1cc(O)c(C[N@H+]2C[C@H](F)C[C@@H](CO)C2)cc1Cl ZINC001232266071 801832327 /nfs/dbraw/zinc/83/23/27/801832327.db2.gz IJDKZZZFIMMIAZ-MWLCHTKSSA-N 1 2 303.761 2.207 20 10 DECDLO COc1cc(O)c(C[NH+]2CCN(CC(F)F)CC2)cc1Cl ZINC001232267688 801834169 /nfs/dbraw/zinc/83/41/69/801834169.db2.gz DSPSTPMQHXFQBW-UHFFFAOYSA-N 1 2 320.767 2.437 20 10 DECDLO COc1cc(O)c(C[N@H+]2CCc3nn(C)cc3C2)cc1Cl ZINC001232267360 801834254 /nfs/dbraw/zinc/83/42/54/801834254.db2.gz ANYYASBUBJLTRD-UHFFFAOYSA-N 1 2 307.781 2.346 20 10 DECDLO OC[C@H]1C[N@H+](Cc2c(O)ccc(F)c2F)C[C@@H]1C(F)(F)F ZINC001233332479 802076985 /nfs/dbraw/zinc/07/69/85/802076985.db2.gz MIUUIKOGGLIISO-APPZFPTMSA-N 1 2 311.250 2.273 20 10 DECDLO OC[C@H]1C[N@@H+](Cc2c(O)ccc(F)c2F)C[C@@H]1C(F)(F)F ZINC001233332479 802076988 /nfs/dbraw/zinc/07/69/88/802076988.db2.gz MIUUIKOGGLIISO-APPZFPTMSA-N 1 2 311.250 2.273 20 10 DECDLO Oc1ccc(F)c(F)c1C[NH+]1CCN(c2ccccn2)CC1 ZINC001233331652 802077878 /nfs/dbraw/zinc/07/78/78/802077878.db2.gz FLQBKXOFRDOLJI-UHFFFAOYSA-N 1 2 305.328 2.388 20 10 DECDLO C[C@H](C[NH2+][C@H](C)c1cccc(-c2nn[nH]n2)c1O)c1ccccn1 ZINC001603552237 1069985576 /nfs/dbraw/zinc/98/55/76/1069985576.db2.gz UUIGQCYOKRQVPL-VXGBXAGGSA-N 1 2 324.388 2.422 20 10 DECDLO CC[C@@H]([NH2+]CC(C)(C)CCO)c1cccc(-c2nn[nH]n2)c1O ZINC001604055724 1070189796 /nfs/dbraw/zinc/18/97/96/1070189796.db2.gz OIOOGCKWDSOSJM-CYBMUJFWSA-N 1 2 319.409 2.022 20 10 DECDLO O=C(NCc1ccc(O)cc1O)c1cccc(Cn2cc[nH+]c2)c1 ZINC001451772096 1056923351 /nfs/dbraw/zinc/92/33/51/1056923351.db2.gz UACAESGUVDHHJE-UHFFFAOYSA-N 1 2 323.352 2.273 20 10 DECDLO CC(C)(CNC(=O)c1ccc(N=NC(N)=O)cc1)n1cc[nH+]c1 ZINC001454171260 1057451347 /nfs/dbraw/zinc/45/13/47/1057451347.db2.gz LAAAJCGUTMBHEK-UHFFFAOYSA-N 1 2 314.349 2.211 20 10 DECDLO C[C@H]([NH2+]C[C@H]1CCOC1(C)C)c1cccc(-c2nn[nH]n2)c1O ZINC001589962093 1076536989 /nfs/dbraw/zinc/53/69/89/1076536989.db2.gz GJRIIEQYKPIKTN-WDEREUQCSA-N 1 2 317.393 2.038 20 10 DECDLO CC[C@@H]([NH2+]C[C@H](O)CC(C)C)c1cccc(-c2nn[nH]n2)c1O ZINC001590462882 1076631420 /nfs/dbraw/zinc/63/14/20/1076631420.db2.gz GGVJAJIDWNWPNV-BXUZGUMPSA-N 1 2 319.409 2.020 20 10 DECDLO CC[C@H]([NH2+]CCOC(C)(C)C)c1cccc(-c2nn[nH]n2)c1O ZINC001590470248 1076635265 /nfs/dbraw/zinc/63/52/65/1076635265.db2.gz PMGHRPVLMFSWPK-ZDUSSCGKSA-N 1 2 319.409 2.428 20 10 DECDLO CO[C@@H]1CCC[C@@H]1C[NH2+][C@@H](C)c1cccc(-c2nn[nH]n2)c1O ZINC001591359491 1076734023 /nfs/dbraw/zinc/73/40/23/1076734023.db2.gz DBTUDPPCQTXZTQ-MISXGVKJSA-N 1 2 317.393 2.038 20 10 DECDLO COC(=O)[C@H](C)[N@H+](C)Cc1cc(Br)c(C)cc1O ZINC001237678720 1080473240 /nfs/dbraw/zinc/47/32/40/1080473240.db2.gz LIXNDUQRVAJFMH-VIFPVBQESA-N 1 2 316.195 2.456 20 10 DECDLO COC(=O)[C@H](C)[N@@H+](C)Cc1cc(Br)c(C)cc1O ZINC001237678720 1080473244 /nfs/dbraw/zinc/47/32/44/1080473244.db2.gz LIXNDUQRVAJFMH-VIFPVBQESA-N 1 2 316.195 2.456 20 10 DECDLO CCOC(=O)c1cc(C[NH2+]Cc2cc(F)c(F)cc2O)on1 ZINC001665489744 1081033719 /nfs/dbraw/zinc/03/37/19/1081033719.db2.gz ODCDNNQPPPTVPJ-UHFFFAOYSA-N 1 2 312.272 2.125 20 10 DECDLO CC(C)(C)OC(=O)N[C@@H]1C[N@H+](Cc2ccccc2O)C[C@@H]1F ZINC001203557120 1084139246 /nfs/dbraw/zinc/13/92/46/1084139246.db2.gz ZOEOXKFZFAUYGY-QWHCGFSZSA-N 1 2 310.369 2.439 20 10 DECDLO CC(C)(C)OC(=O)N[C@@H]1C[N@@H+](Cc2ccccc2O)C[C@@H]1F ZINC001203557120 1084139254 /nfs/dbraw/zinc/13/92/54/1084139254.db2.gz ZOEOXKFZFAUYGY-QWHCGFSZSA-N 1 2 310.369 2.439 20 10 DECDLO CCN(CC)c1ccc(C[NH2+][C@H](Cc2c[nH+]c[nH]2)C(=O)[O-])cc1 ZINC001332485941 1126177257 /nfs/dbraw/zinc/17/72/57/1126177257.db2.gz MKEWOQFVAQWPPR-MRXNPFEDSA-N 1 2 316.405 2.041 20 10 DECDLO Oc1cc(OCC(F)(F)F)ccc1C[NH+]1CC2(CCO2)C1 ZINC001237057354 1138492936 /nfs/dbraw/zinc/49/29/36/1138492936.db2.gz BPHLOCQNIFXQEO-UHFFFAOYSA-N 1 2 303.280 2.308 20 10 DECDLO NC(=O)NC1CC[NH+](Cc2c(O)ccc(Cl)c2Cl)CC1 ZINC001237077058 1138499667 /nfs/dbraw/zinc/49/96/67/1138499667.db2.gz CBHITXOUPWYXRD-UHFFFAOYSA-N 1 2 318.204 2.332 20 10 DECDLO CC(=O)N(C)[C@H]1CC[N@H+](Cc2cc(F)cc(Cl)c2O)C1 ZINC001237801442 1138792329 /nfs/dbraw/zinc/79/23/29/1138792329.db2.gz IADCKTVULAEVLT-LBPRGKRZSA-N 1 2 300.761 2.237 20 10 DECDLO CC(=O)N(C)[C@H]1CC[N@@H+](Cc2cc(F)cc(Cl)c2O)C1 ZINC001237801442 1138792343 /nfs/dbraw/zinc/79/23/43/1138792343.db2.gz IADCKTVULAEVLT-LBPRGKRZSA-N 1 2 300.761 2.237 20 10 DECDLO CCCNC(=O)[C@H](C)[NH+]1CCN(c2ccc(OCC)cc2)CC1 ZINC001340946317 1143503542 /nfs/dbraw/zinc/50/35/42/1143503542.db2.gz UQKQNCCIIOEGSX-HNNXBMFYSA-N 1 2 319.449 2.122 20 10 DECDLO CN(C)c1ccc(CN(C)C(=O)C[N@H+](C)Cc2ccco2)cc1 ZINC000049967863 354364546 /nfs/dbraw/zinc/36/45/46/354364546.db2.gz RRWCUXOXOHROMB-UHFFFAOYSA-N 1 2 315.417 2.436 20 10 DECDLO CN(C)c1ccc(CN(C)C(=O)C[N@@H+](C)Cc2ccco2)cc1 ZINC000049967863 354364550 /nfs/dbraw/zinc/36/45/50/354364550.db2.gz RRWCUXOXOHROMB-UHFFFAOYSA-N 1 2 315.417 2.436 20 10 DECDLO C[C@H]([NH2+]CC1(CO)COC1)c1ccc(Cl)c(Cl)c1O ZINC000186146538 299279908 /nfs/dbraw/zinc/27/99/08/299279908.db2.gz GKOXIRHHWCHTRY-QMMMGPOBSA-N 1 2 306.189 2.359 20 10 DECDLO C[C@@H]([NH2+]CCN1CCSCC1)c1ccc(F)c(F)c1O ZINC000276971017 296125782 /nfs/dbraw/zinc/12/57/82/296125782.db2.gz UDIGOQRBWBCZCZ-SNVBAGLBSA-N 1 2 302.390 2.370 20 10 DECDLO COC(=O)c1ccc(O)c([C@@H](C)[NH2+][C@H](C)Cc2cc(C)[nH]n2)c1 ZINC000273533152 130133768 /nfs/dbraw/zinc/13/37/68/130133768.db2.gz WTIWINHFDXGHES-ZYHUDNBSSA-N 1 2 317.389 2.492 20 10 DECDLO CC[C@H]([NH2+][C@H](C(N)=O)c1ccccn1)c1ccc(N(C)C)cc1 ZINC000297286523 132007962 /nfs/dbraw/zinc/00/79/62/132007962.db2.gz LPDZILGDFGSLIZ-RDJZCZTQSA-N 1 2 312.417 2.415 20 10 DECDLO COc1c(O)c(C[N@H+](C)Cc2nccs2)ccc1[N+](=O)[O-] ZINC000278210016 286186658 /nfs/dbraw/zinc/18/66/58/286186658.db2.gz KFPSLOPGJBNBQA-UHFFFAOYSA-N 1 2 309.347 2.398 20 10 DECDLO COc1c(O)c(C[N@@H+](C)Cc2nccs2)ccc1[N+](=O)[O-] ZINC000278210016 286186659 /nfs/dbraw/zinc/18/66/59/286186659.db2.gz KFPSLOPGJBNBQA-UHFFFAOYSA-N 1 2 309.347 2.398 20 10 DECDLO CC[N@H+](Cc1c(O)cccc1Cl)[C@@H](C)CS(C)(=O)=O ZINC000126229942 402270937 /nfs/dbraw/zinc/27/09/37/402270937.db2.gz CQQOSUCKJSKEOU-JTQLQIEISA-N 1 2 305.827 2.301 20 10 DECDLO CC[N@@H+](Cc1c(O)cccc1Cl)[C@@H](C)CS(C)(=O)=O ZINC000126229942 402270938 /nfs/dbraw/zinc/27/09/38/402270938.db2.gz CQQOSUCKJSKEOU-JTQLQIEISA-N 1 2 305.827 2.301 20 10 DECDLO COc1cc(Cl)cc(C[N@@H+]2CCNC(=O)[C@H]2C(C)C)c1O ZINC000184688473 402291945 /nfs/dbraw/zinc/29/19/45/402291945.db2.gz DDXUEDAFEAWAGF-CYBMUJFWSA-N 1 2 312.797 2.011 20 10 DECDLO COc1cc(Cl)cc(C[N@H+]2CCNC(=O)[C@H]2C(C)C)c1O ZINC000184688473 402291946 /nfs/dbraw/zinc/29/19/46/402291946.db2.gz DDXUEDAFEAWAGF-CYBMUJFWSA-N 1 2 312.797 2.011 20 10 DECDLO COc1cc(Cl)cc(C[N@@H+]2CCOC[C@@]23CCOC3)c1O ZINC000195019087 286223197 /nfs/dbraw/zinc/22/31/97/286223197.db2.gz BHJAOEZXJDASCV-HNNXBMFYSA-N 1 2 313.781 2.046 20 10 DECDLO COc1cc(Cl)cc(C[N@H+]2CCOC[C@@]23CCOC3)c1O ZINC000195019087 286223198 /nfs/dbraw/zinc/22/31/98/286223198.db2.gz BHJAOEZXJDASCV-HNNXBMFYSA-N 1 2 313.781 2.046 20 10 DECDLO CC[C@@H]1CO[C@H](C)C[N@@H+]1Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000278284113 402862689 /nfs/dbraw/zinc/86/26/89/402862689.db2.gz UAMUJYULMQEHTJ-ZYHUDNBSSA-N 1 2 310.350 2.308 20 10 DECDLO CC[C@@H]1CO[C@H](C)C[N@H+]1Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000278284113 402862691 /nfs/dbraw/zinc/86/26/91/402862691.db2.gz UAMUJYULMQEHTJ-ZYHUDNBSSA-N 1 2 310.350 2.308 20 10 DECDLO COC(=O)COc1ccc([N@H+](C)CC2(CC(=O)OC)CC2)cc1 ZINC000281568738 403071506 /nfs/dbraw/zinc/07/15/06/403071506.db2.gz DSVZYUCZGRIOOQ-UHFFFAOYSA-N 1 2 321.373 2.018 20 10 DECDLO COC(=O)COc1ccc([N@@H+](C)CC2(CC(=O)OC)CC2)cc1 ZINC000281568738 403071508 /nfs/dbraw/zinc/07/15/08/403071508.db2.gz DSVZYUCZGRIOOQ-UHFFFAOYSA-N 1 2 321.373 2.018 20 10 DECDLO COc1cc(Cl)cc(C[N@@H+]2CC[S@@](=O)C[C@H](C)C2)c1O ZINC000277627118 403238567 /nfs/dbraw/zinc/23/85/67/403238567.db2.gz XMGUGGIMJOCXNO-CFMSYZGJSA-N 1 2 317.838 2.255 20 10 DECDLO COc1cc(Cl)cc(C[N@H+]2CC[S@@](=O)C[C@H](C)C2)c1O ZINC000277627118 403238569 /nfs/dbraw/zinc/23/85/69/403238569.db2.gz XMGUGGIMJOCXNO-CFMSYZGJSA-N 1 2 317.838 2.255 20 10 DECDLO CCOC(=O)[C@H]([NH2+]Cc1cc2c(cc1O)OCO2)[C@@H](C)CC ZINC000276527457 403183815 /nfs/dbraw/zinc/18/38/15/403183815.db2.gz VYILCWXUHXWYCT-ZUZCIYMTSA-N 1 2 309.362 2.188 20 10 DECDLO CCOCc1nc([C@H](C)[NH2+]Cc2cccc(OC)c2O)no1 ZINC000290972324 404367652 /nfs/dbraw/zinc/36/76/52/404367652.db2.gz SOLFVJBPLJAFEX-JTQLQIEISA-N 1 2 307.350 2.171 20 10 DECDLO O=C(NCc1ccc(N2CCCC2)cc1)[C@@H]1CCn2c[nH+]cc2C1 ZINC000372147882 227085104 /nfs/dbraw/zinc/08/51/04/227085104.db2.gz BEZWFDYQIZPOCL-MRXNPFEDSA-N 1 2 324.428 2.362 20 10 DECDLO C[C@](O)(C[NH2+]Cc1cc([N+](=O)[O-])ccc1O)c1cccs1 ZINC000265829269 525178939 /nfs/dbraw/zinc/17/89/39/525178939.db2.gz ZXTQKKRJAYNIRC-AWEZNQCLSA-N 1 2 308.359 2.359 20 10 DECDLO Cc1nc(C2([NH2+]Cc3cc4c(cc3O)OCO4)CCCC2)no1 ZINC000237957997 526768092 /nfs/dbraw/zinc/76/80/92/526768092.db2.gz XAOOWEZQUOVTOW-UHFFFAOYSA-N 1 2 317.345 2.371 20 10 DECDLO CCO[C@@H]1C[C@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2O)[C@@]12CCCO2 ZINC000272721508 535507275 /nfs/dbraw/zinc/50/72/75/535507275.db2.gz XOVPTQVBOZDCID-XHSDSOJGSA-N 1 2 322.361 2.117 20 10 DECDLO CN(C)c1ccc(C[N@@H+]2CC(=O)NC[C@@H]2c2ccccc2)cc1 ZINC000933326133 624170063 /nfs/dbraw/zinc/17/00/63/624170063.db2.gz YEHBTNYJXUBHNB-GOSISDBHSA-N 1 2 309.413 2.426 20 10 DECDLO CN(C)c1ccc(C[N@H+]2CC(=O)NC[C@@H]2c2ccccc2)cc1 ZINC000933326133 624170064 /nfs/dbraw/zinc/17/00/64/624170064.db2.gz YEHBTNYJXUBHNB-GOSISDBHSA-N 1 2 309.413 2.426 20 10 DECDLO CC[C@H]1COCC[N@@H+]1Cc1ccc(N2CCOCC2)c(F)c1 ZINC000091981033 624650029 /nfs/dbraw/zinc/65/00/29/624650029.db2.gz XCDYJEJMSYNURX-HNNXBMFYSA-N 1 2 308.397 2.273 20 10 DECDLO CC[C@H]1COCC[N@H+]1Cc1ccc(N2CCOCC2)c(F)c1 ZINC000091981033 624650030 /nfs/dbraw/zinc/65/00/30/624650030.db2.gz XCDYJEJMSYNURX-HNNXBMFYSA-N 1 2 308.397 2.273 20 10 DECDLO COC(=O)[C@@H]1[C@H]2CCC[C@H]2C[N@@H+]1Cc1cc(F)cc(F)c1O ZINC000894531806 637092796 /nfs/dbraw/zinc/09/27/96/637092796.db2.gz DIMTVRZUYRTFMJ-WFBYXXMGSA-N 1 2 311.328 2.444 20 10 DECDLO COC(=O)[C@@H]1[C@H]2CCC[C@H]2C[N@H+]1Cc1cc(F)cc(F)c1O ZINC000894531806 637092798 /nfs/dbraw/zinc/09/27/98/637092798.db2.gz DIMTVRZUYRTFMJ-WFBYXXMGSA-N 1 2 311.328 2.444 20 10 DECDLO Oc1c(Br)cc(Cl)cc1C[NH2+]C[C@@H]1COCO1 ZINC000894887128 637296160 /nfs/dbraw/zinc/29/61/60/637296160.db2.gz GRGXQFALSYTQNI-SECBINFHSA-N 1 2 322.586 2.271 20 10 DECDLO Cc1cc(O)c(C[NH+]2CC(n3cc([C@H](C)O)nn3)C2)c(Cl)c1 ZINC000840935853 650389003 /nfs/dbraw/zinc/38/90/03/650389003.db2.gz ASVYEYQRXMNJOO-JTQLQIEISA-N 1 2 322.796 2.056 20 10 DECDLO C[C@@H](NC(=O)NCCn1cc[nH+]c1)c1ccc(N(C)C)cc1 ZINC000773367109 641765021 /nfs/dbraw/zinc/76/50/21/641765021.db2.gz TTYXSDZKKYZAKF-CYBMUJFWSA-N 1 2 301.394 2.010 20 10 DECDLO CC(=O)N[C@@H]1CCC[N@H+](Cc2cc(Cl)cc(F)c2O)C1 ZINC000775652744 642073547 /nfs/dbraw/zinc/07/35/47/642073547.db2.gz QNYKLILFBDFLFW-GFCCVEGCSA-N 1 2 300.761 2.285 20 10 DECDLO CC(=O)N[C@@H]1CCC[N@@H+](Cc2cc(Cl)cc(F)c2O)C1 ZINC000775652744 642073551 /nfs/dbraw/zinc/07/35/51/642073551.db2.gz QNYKLILFBDFLFW-GFCCVEGCSA-N 1 2 300.761 2.285 20 10 DECDLO NC(=O)C[C@@H]1CCCC[N@@H+]1Cc1cc(Cl)cc(F)c1O ZINC000775663887 642075921 /nfs/dbraw/zinc/07/59/21/642075921.db2.gz HAGUVNTUHZZLGB-NSHDSACASA-N 1 2 300.761 2.415 20 10 DECDLO NC(=O)C[C@@H]1CCCC[N@H+]1Cc1cc(Cl)cc(F)c1O ZINC000775663887 642075925 /nfs/dbraw/zinc/07/59/25/642075925.db2.gz HAGUVNTUHZZLGB-NSHDSACASA-N 1 2 300.761 2.415 20 10 DECDLO CCO[C@@H]1C[C@H]([NH2+]Cc2cc(Cl)cc(F)c2O)[C@H]1OC ZINC000775979539 642118525 /nfs/dbraw/zinc/11/85/25/642118525.db2.gz VUNXCHQPZNWQSW-OUCADQQQSA-N 1 2 303.761 2.467 20 10 DECDLO C[C@@H]([NH2+][C@H]1CCn2cc[nH+]c2C1)c1cc([N+](=O)[O-])ccc1[O-] ZINC000779062339 642459654 /nfs/dbraw/zinc/45/96/54/642459654.db2.gz SMJZDXMHWBQXHR-MNOVXSKESA-N 1 2 302.334 2.163 20 10 DECDLO O=C(/C=C\c1ccc(O)c(O)c1)N1CCC[C@@H](n2cc[nH+]c2)C1 ZINC000779513843 642507318 /nfs/dbraw/zinc/50/73/18/642507318.db2.gz YJMSOVCSKCHDRT-KXQLTZBTSA-N 1 2 313.357 2.171 20 10 DECDLO COc1cccc(C[NH2+]Cc2ncc(CN(C)C)s2)c1O ZINC000809741781 646273904 /nfs/dbraw/zinc/27/39/04/646273904.db2.gz WGPJAEGJGIBQQR-UHFFFAOYSA-N 1 2 307.419 2.209 20 10 DECDLO O=C(NCCCSc1nccs1)N1CCn2c[nH+]cc2C1 ZINC000812154203 646613399 /nfs/dbraw/zinc/61/33/99/646613399.db2.gz PRIOCNHIJXDKAQ-UHFFFAOYSA-N 1 2 323.447 2.047 20 10 DECDLO CCN(CC)c1ccc(CN(C)C(=O)Cc2[nH]cc[nH+]2)cc1 ZINC000819974265 647753880 /nfs/dbraw/zinc/75/38/80/647753880.db2.gz LUCNDDBUHPKPAB-UHFFFAOYSA-N 1 2 300.406 2.457 20 10 DECDLO O=C1OCCN1C[C@@H]1CC[N@@H+](Cc2cccc(Cl)c2O)C1 ZINC000824454640 648591013 /nfs/dbraw/zinc/59/10/13/648591013.db2.gz JCAOFJOUAGDHOX-LLVKDONJSA-N 1 2 310.781 2.320 20 10 DECDLO O=C1OCCN1C[C@@H]1CC[N@H+](Cc2cccc(Cl)c2O)C1 ZINC000824454640 648591018 /nfs/dbraw/zinc/59/10/18/648591018.db2.gz JCAOFJOUAGDHOX-LLVKDONJSA-N 1 2 310.781 2.320 20 10 DECDLO OCCN1CCCC[C@@H]1C[NH2+]Cc1cc(Cl)cc(F)c1O ZINC000824583098 648616387 /nfs/dbraw/zinc/61/63/87/648616387.db2.gz HWYQIJJHCQPXAM-CYBMUJFWSA-N 1 2 316.804 2.121 20 10 DECDLO COc1cc(C[N@@H+]2CCNC(=O)[C@@H]2C)c(O)c(C(C)(C)C)c1 ZINC000824645817 648629457 /nfs/dbraw/zinc/62/94/57/648629457.db2.gz QMGJNSKUSITSKD-NSHDSACASA-N 1 2 306.406 2.019 20 10 DECDLO COc1cc(C[N@H+]2CCNC(=O)[C@@H]2C)c(O)c(C(C)(C)C)c1 ZINC000824645817 648629461 /nfs/dbraw/zinc/62/94/61/648629461.db2.gz QMGJNSKUSITSKD-NSHDSACASA-N 1 2 306.406 2.019 20 10 DECDLO COC(=O)[C@@H]1C[N@H+](Cc2cc(Cl)c(C)cc2O)C[C@H](C)O1 ZINC000826139829 648854535 /nfs/dbraw/zinc/85/45/35/648854535.db2.gz PLTQGEWMAULGQL-HZMBPMFUSA-N 1 2 313.781 2.116 20 10 DECDLO COC(=O)[C@@H]1C[N@@H+](Cc2cc(Cl)c(C)cc2O)C[C@H](C)O1 ZINC000826139829 648854538 /nfs/dbraw/zinc/85/45/38/648854538.db2.gz PLTQGEWMAULGQL-HZMBPMFUSA-N 1 2 313.781 2.116 20 10 DECDLO Oc1ccc(Cl)c(F)c1CN1CC[NH+]([C@@H]2CCOC2)CC1 ZINC000827120755 648975270 /nfs/dbraw/zinc/97/52/70/648975270.db2.gz VSKUBEHQRDFTSN-LLVKDONJSA-N 1 2 314.788 2.091 20 10 DECDLO Oc1c(F)cc(Cl)cc1CN1CC[NH+]([C@@H]2CCOC2)CC1 ZINC000827121208 648975371 /nfs/dbraw/zinc/97/53/71/648975371.db2.gz ZBNAOWMTMYCYBM-CYBMUJFWSA-N 1 2 314.788 2.091 20 10 DECDLO Cn1c[nH+]cc1[C@@H]1C[C@H]1C(=O)NCCCSc1nccs1 ZINC000827474711 649040066 /nfs/dbraw/zinc/04/00/66/649040066.db2.gz KJQHSIZWUUTVDL-GHMZBOCLSA-N 1 2 322.459 2.279 20 10 DECDLO CC[N@H+](CCO)CC(=O)c1cc(C)n(-c2ccc(F)cn2)c1C ZINC000827675367 649065539 /nfs/dbraw/zinc/06/55/39/649065539.db2.gz SOOFONKRSBICEI-UHFFFAOYSA-N 1 2 319.380 2.125 20 10 DECDLO CC[N@@H+](CCO)CC(=O)c1cc(C)n(-c2ccc(F)cn2)c1C ZINC000827675367 649065542 /nfs/dbraw/zinc/06/55/42/649065542.db2.gz SOOFONKRSBICEI-UHFFFAOYSA-N 1 2 319.380 2.125 20 10 DECDLO O=C1O[C@H](C[NH2+]Cc2cc(Cl)cc(F)c2O)CN1C1CC1 ZINC000848928802 651564905 /nfs/dbraw/zinc/56/49/05/651564905.db2.gz OALOLVYNCWJZGP-LLVKDONJSA-N 1 2 314.744 2.258 20 10 DECDLO O=C(NCc1ccc(-n2cc[nH+]c2)cc1)c1cccc(O)c1O ZINC000188474395 684356884 /nfs/dbraw/zinc/35/68/84/684356884.db2.gz CQEHKVPATWBTEZ-UHFFFAOYSA-N 1 2 309.325 2.214 20 10 DECDLO COC(=O)[C@H](C[C@@H]1CCCOC1)[NH2+]Cc1cc(C)c(C)cc1O ZINC000862515950 686313510 /nfs/dbraw/zinc/31/35/10/686313510.db2.gz GPNOORPWTWRBBH-HOCLYGCPSA-N 1 2 321.417 2.457 20 10 DECDLO COc1cccc([C@@H]2CN(C(=O)C3=CC(=O)CS3)CC[NH2+]2)c1 ZINC000870151689 688499330 /nfs/dbraw/zinc/49/93/30/688499330.db2.gz BKTAHJJNCPLUOB-AWEZNQCLSA-N 1 2 318.398 2.249 20 10 DECDLO CCCOc1ccc(C[NH2+]Cc2nnnn2C2CC2)cc1C ZINC000873065267 689152256 /nfs/dbraw/zinc/15/22/56/689152256.db2.gz PMEPGGOIYQAYJB-UHFFFAOYSA-N 1 2 301.394 2.395 20 10 DECDLO Cn1cnnc1C1CC[NH+](Cc2c(O)cc(F)cc2F)CC1 ZINC001140584046 777376336 /nfs/dbraw/zinc/37/63/36/777376336.db2.gz DRCYRBAYOQZSGP-UHFFFAOYSA-N 1 2 308.332 2.179 20 10 DECDLO Oc1cc(O)c(C[NH+]2CCN(C3CCCCC3)CC2)c(O)c1 ZINC001144500637 790933615 /nfs/dbraw/zinc/93/36/15/790933615.db2.gz XFAPMRYKYONYEX-UHFFFAOYSA-N 1 2 306.406 2.254 20 10 DECDLO CC(C)[C@H](O)C[NH2+]Cc1cc(Br)cc(F)c1O ZINC000715778853 792511883 /nfs/dbraw/zinc/51/18/83/792511883.db2.gz NBXZXCWXGOXKOW-LLVKDONJSA-N 1 2 306.175 2.400 20 10 DECDLO O=C(NCc1c(O)cccc1O)c1cccc(Cn2cc[nH+]c2)c1 ZINC001178912914 795029112 /nfs/dbraw/zinc/02/91/12/795029112.db2.gz ZCFJSGZCZDFRAO-UHFFFAOYSA-N 1 2 323.352 2.273 20 10 DECDLO Cc1nn(CCO)c(C)c1C[NH2+]Cc1cccc(Cl)c1O ZINC001120249125 795428467 /nfs/dbraw/zinc/42/84/67/795428467.db2.gz FVVBQMKDTIMEBZ-UHFFFAOYSA-N 1 2 309.797 2.141 20 10 DECDLO COC(=O)C[C@@H]1C[N@H+](Cc2c(C)n(C)c3ccccc32)CCO1 ZINC001138258702 796189342 /nfs/dbraw/zinc/18/93/42/796189342.db2.gz YSSQSTPUZSSCIM-CQSZACIVSA-N 1 2 316.401 2.251 20 10 DECDLO COC(=O)C[C@@H]1C[N@@H+](Cc2c(C)n(C)c3ccccc32)CCO1 ZINC001138258702 796189345 /nfs/dbraw/zinc/18/93/45/796189345.db2.gz YSSQSTPUZSSCIM-CQSZACIVSA-N 1 2 316.401 2.251 20 10 DECDLO CCN(CC)c1ccc(C[N@@H+]2CCOC[C@@H]2COC)c(OC)c1 ZINC001138391211 796210406 /nfs/dbraw/zinc/21/04/06/796210406.db2.gz DDXHLKOAHKEBHF-KRWDZBQOSA-N 1 2 322.449 2.389 20 10 DECDLO CCN(CC)c1ccc(C[N@H+]2CCOC[C@@H]2COC)c(OC)c1 ZINC001138391211 796210411 /nfs/dbraw/zinc/21/04/11/796210411.db2.gz DDXHLKOAHKEBHF-KRWDZBQOSA-N 1 2 322.449 2.389 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1C[C@H]2[C@H](CF)[C@H]2C1 ZINC001139132248 796330327 /nfs/dbraw/zinc/33/03/27/796330327.db2.gz UZASOVDWKBXDQJ-XYYAHUGASA-N 1 2 303.333 2.454 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1C[C@H]2[C@H](CF)[C@H]2C1 ZINC001139132248 796330329 /nfs/dbraw/zinc/33/03/29/796330329.db2.gz UZASOVDWKBXDQJ-XYYAHUGASA-N 1 2 303.333 2.454 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1C[C@@H](C)OC[C@H]1C ZINC001139130953 796330434 /nfs/dbraw/zinc/33/04/34/796330434.db2.gz KVWVIHLOMDEJIY-VXGBXAGGSA-N 1 2 303.358 2.416 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1C[C@@H](C)OC[C@H]1C ZINC001139130953 796330438 /nfs/dbraw/zinc/33/04/38/796330438.db2.gz KVWVIHLOMDEJIY-VXGBXAGGSA-N 1 2 303.358 2.416 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CC[C@@H](O)C[C@H]1C ZINC001139132729 796330489 /nfs/dbraw/zinc/33/04/89/796330489.db2.gz ZMJDEPSNEKBZKU-VXGBXAGGSA-N 1 2 303.358 2.152 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CC[C@@H](O)C[C@H]1C ZINC001139132729 796330495 /nfs/dbraw/zinc/33/04/95/796330495.db2.gz ZMJDEPSNEKBZKU-VXGBXAGGSA-N 1 2 303.358 2.152 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CC[C@H]2OCC[C@H]2C1 ZINC001139130745 796331042 /nfs/dbraw/zinc/33/10/42/796331042.db2.gz IZCOBNWLPYPMCL-BLLLJJGKSA-N 1 2 315.369 2.418 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CC[C@H]2OCC[C@H]2C1 ZINC001139130745 796331045 /nfs/dbraw/zinc/33/10/45/796331045.db2.gz IZCOBNWLPYPMCL-BLLLJJGKSA-N 1 2 315.369 2.418 20 10 DECDLO CC[C@@]12C[C@@H](CO1)[N@H+](Cc1ccc(N3CCOCC3)cc1F)C2 ZINC001140664410 796553535 /nfs/dbraw/zinc/55/35/35/796553535.db2.gz IVRPZQJQHNAERV-WMZOPIPTSA-N 1 2 320.408 2.416 20 10 DECDLO CC[C@@]12C[C@@H](CO1)[N@@H+](Cc1ccc(N3CCOCC3)cc1F)C2 ZINC001140664410 796553540 /nfs/dbraw/zinc/55/35/40/796553540.db2.gz IVRPZQJQHNAERV-WMZOPIPTSA-N 1 2 320.408 2.416 20 10 DECDLO O=C(c1cc(O)c(O)c(Cl)c1)N1CCC(n2cc[nH+]c2)CC1 ZINC001193611067 797592482 /nfs/dbraw/zinc/59/24/82/797592482.db2.gz AIMFKTHTWIRVCQ-UHFFFAOYSA-N 1 2 321.764 2.425 20 10 DECDLO C[N@@H+]1CC[C@H](Oc2cccc3c2C(=O)c2cccc(O)c2C3=O)C1 ZINC001229187189 801238839 /nfs/dbraw/zinc/23/88/39/801238839.db2.gz WPIXJGJNKKFUFR-NSHDSACASA-N 1 2 323.348 2.251 20 10 DECDLO C[N@H+]1CC[C@H](Oc2cccc3c2C(=O)c2cccc(O)c2C3=O)C1 ZINC001229187189 801238842 /nfs/dbraw/zinc/23/88/42/801238842.db2.gz WPIXJGJNKKFUFR-NSHDSACASA-N 1 2 323.348 2.251 20 10 DECDLO CCOC(=O)[C@@H]1CCC[N@@H+]1Cc1ccc(N(C)C)cc1OC ZINC001231855005 801738946 /nfs/dbraw/zinc/73/89/46/801738946.db2.gz OBKCRRFTSGJUPA-HNNXBMFYSA-N 1 2 306.406 2.289 20 10 DECDLO CCOC(=O)[C@@H]1CCC[N@H+]1Cc1ccc(N(C)C)cc1OC ZINC001231855005 801738947 /nfs/dbraw/zinc/73/89/47/801738947.db2.gz OBKCRRFTSGJUPA-HNNXBMFYSA-N 1 2 306.406 2.289 20 10 DECDLO C[C@H]1C[N@H+](Cc2c(O)cc(Br)cc2F)C[C@H]1O ZINC001233028915 802005745 /nfs/dbraw/zinc/00/57/45/802005745.db2.gz VRHNGYUAPBLIRH-JVXZTZIISA-N 1 2 304.159 2.106 20 10 DECDLO C[C@H]1C[N@@H+](Cc2c(O)cc(Br)cc2F)C[C@H]1O ZINC001233028915 802005752 /nfs/dbraw/zinc/00/57/52/802005752.db2.gz VRHNGYUAPBLIRH-JVXZTZIISA-N 1 2 304.159 2.106 20 10 DECDLO CC(C)CC[C@H](CO)[NH2+][C@@H](C)c1cccc(-c2nn[nH]n2)c1O ZINC001603278652 1069929840 /nfs/dbraw/zinc/92/98/40/1069929840.db2.gz RZEGMLNYZKUPGD-NWDGAFQWSA-N 1 2 319.409 2.020 20 10 DECDLO C[C@@H]([NH2+]CCC1CCOCC1)c1cccc(-c2nn[nH]n2)c1O ZINC001603661917 1070031764 /nfs/dbraw/zinc/03/17/64/1070031764.db2.gz DMZIOZFPOXNVGN-LLVKDONJSA-N 1 2 317.393 2.040 20 10 DECDLO NC(=O)[C@@H](F)C1CC[NH+](Cc2cc(Cl)cc(F)c2O)CC1 ZINC001474691947 1060916123 /nfs/dbraw/zinc/91/61/23/1060916123.db2.gz XBQYHATXWUEVGE-LBPRGKRZSA-N 1 2 318.751 2.220 20 10 DECDLO Oc1cc(F)c(F)cc1C[NH2+]Cc1nc2c(s1)COCC2 ZINC001474718709 1060922936 /nfs/dbraw/zinc/92/29/36/1060922936.db2.gz PDKREKWUIVMOPO-UHFFFAOYSA-N 1 2 312.341 2.489 20 10 DECDLO O=C(Cc1[nH]cc[nH+]1)Nc1c(-c2ccccn2)nc2ccccn21 ZINC001641971979 1078736677 /nfs/dbraw/zinc/73/66/77/1078736677.db2.gz JUZGHHKIDYBXCN-UHFFFAOYSA-N 1 2 318.340 2.301 20 10 DECDLO C[C@H]1C[N@H+](Cc2cc(F)cc(Br)c2O)C[C@H]1O ZINC001235296581 1079011121 /nfs/dbraw/zinc/01/11/21/1079011121.db2.gz LHWAPWYOJBQQHG-WRWORJQWSA-N 1 2 304.159 2.106 20 10 DECDLO C[C@H]1C[N@@H+](Cc2cc(F)cc(Br)c2O)C[C@H]1O ZINC001235296581 1079011136 /nfs/dbraw/zinc/01/11/36/1079011136.db2.gz LHWAPWYOJBQQHG-WRWORJQWSA-N 1 2 304.159 2.106 20 10 DECDLO CCOC(=O)C[N@H+](CCOCC(F)F)Cc1ccccc1O ZINC001559930432 1075130398 /nfs/dbraw/zinc/13/03/98/1075130398.db2.gz SREYCQUWMKKFSN-UHFFFAOYSA-N 1 2 317.332 2.039 20 10 DECDLO CCOC(=O)C[N@@H+](CCOCC(F)F)Cc1ccccc1O ZINC001559930432 1075130402 /nfs/dbraw/zinc/13/04/02/1075130402.db2.gz SREYCQUWMKKFSN-UHFFFAOYSA-N 1 2 317.332 2.039 20 10 DECDLO C[C@H]([NH2+]CC[C@H]1CC1(F)F)c1cccc(-c2nn[nH]n2)c1O ZINC001589962918 1076536633 /nfs/dbraw/zinc/53/66/33/1076536633.db2.gz VFIAUTCVZMGHEW-IUCAKERBSA-N 1 2 309.320 2.268 20 10 DECDLO CO[C@@H]([C@H](C)[NH2+][C@@H](C)c1cccc(-c2nn[nH]n2)c1O)C1CC1 ZINC001591326445 1076723608 /nfs/dbraw/zinc/72/36/08/1076723608.db2.gz LDRNMYAHHDIMKV-YHAQOWFVSA-N 1 2 317.393 2.036 20 10 DECDLO CCNC(=O)C(C)(C)C[NH2+]Cc1cc(Cl)cc(F)c1O ZINC001650810211 1079774079 /nfs/dbraw/zinc/77/40/79/1079774079.db2.gz UXACAYSIMZZNLC-UHFFFAOYSA-N 1 2 302.777 2.437 20 10 DECDLO C[C@H](CS(C)(=O)=O)[N@H+](Cc1cc(F)c(F)cc1O)C1CC1 ZINC001651952305 1079842439 /nfs/dbraw/zinc/84/24/39/1079842439.db2.gz LBPXBILSUIOXFG-SECBINFHSA-N 1 2 319.373 2.068 20 10 DECDLO C[C@H](CS(C)(=O)=O)[N@@H+](Cc1cc(F)c(F)cc1O)C1CC1 ZINC001651952305 1079842446 /nfs/dbraw/zinc/84/24/46/1079842446.db2.gz LBPXBILSUIOXFG-SECBINFHSA-N 1 2 319.373 2.068 20 10 DECDLO CN1c2ccccc2C[C@@H]([NH2+]Cc2ccc(F)c(F)c2O)C1=O ZINC001660268087 1080298869 /nfs/dbraw/zinc/29/88/69/1080298869.db2.gz NWPYKIPBPMEHEY-CYBMUJFWSA-N 1 2 318.323 2.348 20 10 DECDLO CN1CCO[C@@]2(CCC[N@H+](Cc3cccc(Cl)c3O)C2)C1 ZINC001276379944 1083743270 /nfs/dbraw/zinc/74/32/70/1083743270.db2.gz CGLIFLRSQXHZTB-INIZCTEOSA-N 1 2 310.825 2.342 20 10 DECDLO CN1CCO[C@@]2(CCC[N@@H+](Cc3cccc(Cl)c3O)C2)C1 ZINC001276379944 1083743278 /nfs/dbraw/zinc/74/32/78/1083743278.db2.gz CGLIFLRSQXHZTB-INIZCTEOSA-N 1 2 310.825 2.342 20 10 DECDLO C[C@H]([NH2+]Cc1c(O)cccc1Br)c1nncn1C ZINC000706829143 1086651777 /nfs/dbraw/zinc/65/17/77/1086651777.db2.gz MCOPTZWRYPUBRO-QMMMGPOBSA-N 1 2 311.183 2.134 20 10 DECDLO OC[C@@H]1C[C@H](F)C[N@H+](Cc2c(O)cccc2OC(F)(F)F)C1 ZINC001237120586 1138507546 /nfs/dbraw/zinc/50/75/46/1138507546.db2.gz QPDXQRNAHXMRTN-ZJUUUORDSA-N 1 2 323.286 2.443 20 10 DECDLO OC[C@@H]1C[C@H](F)C[N@@H+](Cc2c(O)cccc2OC(F)(F)F)C1 ZINC001237120586 1138507550 /nfs/dbraw/zinc/50/75/50/1138507550.db2.gz QPDXQRNAHXMRTN-ZJUUUORDSA-N 1 2 323.286 2.443 20 10 DECDLO C[C@H]1CN(C(=O)C=Cc2c[nH]c[nH+]2)c2ccccc2N(C)C1=O ZINC000492900959 249168536 /nfs/dbraw/zinc/16/85/36/249168536.db2.gz OFZONXSTWCBQCZ-KRZKBDHCSA-N 1 2 310.357 2.069 20 10 DECDLO O=C(C=Cc1c[nH]c[nH+]1)N1CCC[C@@H](O)c2cc(F)ccc21 ZINC000493438832 249296010 /nfs/dbraw/zinc/29/60/10/249296010.db2.gz ZCORZBCIGTUAOE-CSPWOOARSA-N 1 2 301.321 2.422 20 10 DECDLO O=C1CC[C@H]([NH2+]Cc2cc(Cl)c(F)cc2O)C2(CCC2)N1 ZINC000294731088 224198687 /nfs/dbraw/zinc/19/86/87/224198687.db2.gz PZPCXWROFNFYMP-ZDUSSCGKSA-N 1 2 312.772 2.476 20 10 DECDLO CCc1nnc([C@H](C)[NH2+][C@H](C)c2cc(C(=O)OC)ccc2O)[nH]1 ZINC000273347978 130110102 /nfs/dbraw/zinc/11/01/02/130110102.db2.gz BCSJNDAPNXTHIH-ZJUUUORDSA-N 1 2 318.377 2.271 20 10 DECDLO CN1CCCc2cc(CNC(=O)[C@@H]3CCn4cc[nH+]c4C3)ccc21 ZINC000161005359 402369012 /nfs/dbraw/zinc/36/90/12/402369012.db2.gz VPCJVDNQAVZDSI-MRXNPFEDSA-N 1 2 324.428 2.144 20 10 DECDLO CCNC(=O)C(C)(C)C[NH2+][C@@H](C)c1ccc(F)c(F)c1O ZINC000187872416 402512415 /nfs/dbraw/zinc/51/24/15/402512415.db2.gz ZDIQSNGEJNMWTD-VIFPVBQESA-N 1 2 300.349 2.483 20 10 DECDLO COc1cc(Cl)cc(C[N@@H+]2CC[C@@H](C)[S@](=O)CC2)c1O ZINC000277348394 286223227 /nfs/dbraw/zinc/22/32/27/286223227.db2.gz DHRWIFMVHULCFU-CFMSYZGJSA-N 1 2 317.838 2.397 20 10 DECDLO COc1cc(Cl)cc(C[N@H+]2CC[C@@H](C)[S@](=O)CC2)c1O ZINC000277348394 286223228 /nfs/dbraw/zinc/22/32/28/286223228.db2.gz DHRWIFMVHULCFU-CFMSYZGJSA-N 1 2 317.838 2.397 20 10 DECDLO COc1c(O)c(C[NH2+][C@H]2CCCc3cn[nH]c32)ccc1[N+](=O)[O-] ZINC000278545698 402868128 /nfs/dbraw/zinc/86/81/28/402868128.db2.gz YESKJRAEKDCTKF-NSHDSACASA-N 1 2 318.333 2.199 20 10 DECDLO COc1c(O)c(C[NH2+][C@H]2CCCc3c[nH]nc32)ccc1[N+](=O)[O-] ZINC000278545698 402868131 /nfs/dbraw/zinc/86/81/31/402868131.db2.gz YESKJRAEKDCTKF-NSHDSACASA-N 1 2 318.333 2.199 20 10 DECDLO COC(=O)[C@H](C)[N@H+](C)Cc1cc(Br)ccc1O ZINC000280203014 402974886 /nfs/dbraw/zinc/97/48/86/402974886.db2.gz BOBRYSBUEMUEPX-QMMMGPOBSA-N 1 2 302.168 2.148 20 10 DECDLO COC(=O)[C@H](C)[N@@H+](C)Cc1cc(Br)ccc1O ZINC000280203014 402974888 /nfs/dbraw/zinc/97/48/88/402974888.db2.gz BOBRYSBUEMUEPX-QMMMGPOBSA-N 1 2 302.168 2.148 20 10 DECDLO COc1cc(Cl)cc(C[N@@H+]2CC[S@@](=O)C[C@@H](C)C2)c1O ZINC000277627127 403238433 /nfs/dbraw/zinc/23/84/33/403238433.db2.gz XMGUGGIMJOCXNO-WVDJIFEKSA-N 1 2 317.838 2.255 20 10 DECDLO COc1cc(Cl)cc(C[N@H+]2CC[S@@](=O)C[C@@H](C)C2)c1O ZINC000277627127 403238435 /nfs/dbraw/zinc/23/84/35/403238435.db2.gz XMGUGGIMJOCXNO-WVDJIFEKSA-N 1 2 317.838 2.255 20 10 DECDLO NC(=O)[C@@H]([NH2+]Cc1ccc(N2CCCCC2)cc1)c1ccccn1 ZINC000295144576 403773103 /nfs/dbraw/zinc/77/31/03/403773103.db2.gz QJKDTGGMQQVUGP-SFHVURJKSA-N 1 2 324.428 2.388 20 10 DECDLO OC[C@@]1(F)CCC[N@H+](Cc2cc(Br)ccc2O)C1 ZINC000289849286 404003691 /nfs/dbraw/zinc/00/36/91/404003691.db2.gz PWSFVDWZFKNLGR-CYBMUJFWSA-N 1 2 318.186 2.451 20 10 DECDLO OC[C@@]1(F)CCC[N@@H+](Cc2cc(Br)ccc2O)C1 ZINC000289849286 404003694 /nfs/dbraw/zinc/00/36/94/404003694.db2.gz PWSFVDWZFKNLGR-CYBMUJFWSA-N 1 2 318.186 2.451 20 10 DECDLO C[C@@H]1C[N@H+](C/C=C/c2ccc(N(C)C)cc2)CC[S@](=O)C1 ZINC000835048361 649871466 /nfs/dbraw/zinc/87/14/66/649871466.db2.gz HMBPBIGYIGDQPP-BCSBQKBHSA-N 1 2 306.475 2.466 20 10 DECDLO C[C@@H]1C[N@@H+](C/C=C/c2ccc(N(C)C)cc2)CC[S@](=O)C1 ZINC000835048361 649871467 /nfs/dbraw/zinc/87/14/67/649871467.db2.gz HMBPBIGYIGDQPP-BCSBQKBHSA-N 1 2 306.475 2.466 20 10 DECDLO O=C1[C@@H]([NH2+]Cc2cc(Cl)cc(F)c2O)C[C@@H]2CCCCN12 ZINC000835072796 649875269 /nfs/dbraw/zinc/87/52/69/649875269.db2.gz JZNOBTVXGZCVHW-AAEUAGOBSA-N 1 2 312.772 2.428 20 10 DECDLO C[C@H](C[S@](C)=O)[NH2+]Cc1cccc(Br)c1O ZINC000164282166 625253053 /nfs/dbraw/zinc/25/30/53/625253053.db2.gz ZBAHMCYOKNRSJR-VPTHRUTESA-N 1 2 306.225 2.011 20 10 DECDLO C[N@H+](Cc1cc(Br)cc(F)c1O)CC1(CO)CC1 ZINC000894534525 637094486 /nfs/dbraw/zinc/09/44/86/637094486.db2.gz NLSVLCNIXIRHMY-UHFFFAOYSA-N 1 2 318.186 2.498 20 10 DECDLO C[N@@H+](Cc1cc(Br)cc(F)c1O)CC1(CO)CC1 ZINC000894534525 637094490 /nfs/dbraw/zinc/09/44/90/637094490.db2.gz NLSVLCNIXIRHMY-UHFFFAOYSA-N 1 2 318.186 2.498 20 10 DECDLO Cc1cc(O)c(C[N@@H+]2CCN3C(=O)OCC[C@@H]3C2)c(Cl)c1 ZINC000840920487 650382149 /nfs/dbraw/zinc/38/21/49/650382149.db2.gz KLEXQHJGCOIJSU-LLVKDONJSA-N 1 2 310.781 2.381 20 10 DECDLO Cc1cc(O)c(C[N@H+]2CCN3C(=O)OCC[C@@H]3C2)c(Cl)c1 ZINC000840920487 650382152 /nfs/dbraw/zinc/38/21/52/650382152.db2.gz KLEXQHJGCOIJSU-LLVKDONJSA-N 1 2 310.781 2.381 20 10 DECDLO COC(=O)[C@H](CC1CCOCC1)[NH2+]Cc1cc(C)c(C)cc1O ZINC000895591317 638105579 /nfs/dbraw/zinc/10/55/79/638105579.db2.gz NRHVHZHYVCCPQT-INIZCTEOSA-N 1 2 321.417 2.457 20 10 DECDLO C[C@H]([NH2+]CCN1CCOCC1(C)C)c1cc(F)cc(F)c1O ZINC000756538647 639670659 /nfs/dbraw/zinc/67/06/59/639670659.db2.gz DNPBTYYBNQGFCL-NSHDSACASA-N 1 2 314.376 2.432 20 10 DECDLO CC[N@H+](Cc1cn(C)nn1)Cc1cc(Cl)cc(OC)c1O ZINC000761217967 640286832 /nfs/dbraw/zinc/28/68/32/640286832.db2.gz ZAGHKRRFFYOJLF-UHFFFAOYSA-N 1 2 310.785 2.205 20 10 DECDLO CC[N@@H+](Cc1cn(C)nn1)Cc1cc(Cl)cc(OC)c1O ZINC000761217967 640286834 /nfs/dbraw/zinc/28/68/34/640286834.db2.gz ZAGHKRRFFYOJLF-UHFFFAOYSA-N 1 2 310.785 2.205 20 10 DECDLO C[C@@H]1C[N@H+](Cc2cc(Br)cc(F)c2O)C[C@H]1O ZINC000897675786 640898416 /nfs/dbraw/zinc/89/84/16/640898416.db2.gz CAGVVBWZNXSKGU-RDDDGLTNSA-N 1 2 304.159 2.106 20 10 DECDLO C[C@@H]1C[N@@H+](Cc2cc(Br)cc(F)c2O)C[C@H]1O ZINC000897675786 640898418 /nfs/dbraw/zinc/89/84/18/640898418.db2.gz CAGVVBWZNXSKGU-RDDDGLTNSA-N 1 2 304.159 2.106 20 10 DECDLO COc1cc(C[N@@H+](C)Cc2nc([C@@H](C)OC)no2)c(O)cc1C ZINC000768462641 641084338 /nfs/dbraw/zinc/08/43/38/641084338.db2.gz AZINHYHEQUHECT-LLVKDONJSA-N 1 2 321.377 2.432 20 10 DECDLO COc1cc(C[N@H+](C)Cc2nc([C@@H](C)OC)no2)c(O)cc1C ZINC000768462641 641084342 /nfs/dbraw/zinc/08/43/42/641084342.db2.gz AZINHYHEQUHECT-LLVKDONJSA-N 1 2 321.377 2.432 20 10 DECDLO C[C@@H](NC(=O)c1cc([C@H]2CCC[N@@H+]2C)n[nH]1)c1ccccc1O ZINC000899182331 641974599 /nfs/dbraw/zinc/97/45/99/641974599.db2.gz XUEQZJZDFQDCQJ-IAQYHMDHSA-N 1 2 314.389 2.373 20 10 DECDLO C[C@@H](NC(=O)c1cc([C@H]2CCC[N@H+]2C)n[nH]1)c1ccccc1O ZINC000899182331 641974607 /nfs/dbraw/zinc/97/46/07/641974607.db2.gz XUEQZJZDFQDCQJ-IAQYHMDHSA-N 1 2 314.389 2.373 20 10 DECDLO CC1(C)CN(CC[NH2+]Cc2cc(Cl)cc(F)c2O)CCO1 ZINC000776173750 642139061 /nfs/dbraw/zinc/13/90/61/642139061.db2.gz JHESJPYLKRCXHH-UHFFFAOYSA-N 1 2 316.804 2.385 20 10 DECDLO C[C@@H]1CC[N@H+](CC(=O)NCc2ccc(N(C)C)cc2)C[C@H]1F ZINC000778229669 642357312 /nfs/dbraw/zinc/35/73/12/642357312.db2.gz AFNBFOLEWZHVGR-CZUORRHYSA-N 1 2 307.413 2.049 20 10 DECDLO C[C@@H]1CC[N@@H+](CC(=O)NCc2ccc(N(C)C)cc2)C[C@H]1F ZINC000778229669 642357315 /nfs/dbraw/zinc/35/73/15/642357315.db2.gz AFNBFOLEWZHVGR-CZUORRHYSA-N 1 2 307.413 2.049 20 10 DECDLO O=C(CNc1cccc[nH+]1)NCc1c(O)ccc2c1CCCC2 ZINC000901130587 642573895 /nfs/dbraw/zinc/57/38/95/642573895.db2.gz DHQAMALPWIVUST-UHFFFAOYSA-N 1 2 311.385 2.394 20 10 DECDLO CC[C@H](CN1CCOCC1)[NH2+][C@H](C)c1cc(F)cc(F)c1O ZINC000903342817 643319838 /nfs/dbraw/zinc/31/98/38/643319838.db2.gz KXBXDSIGWGCUTF-DGCLKSJQSA-N 1 2 314.376 2.432 20 10 DECDLO CCOC(=O)[C@H]([NH2+]Cc1cccc(C)c1O)[C@H]1CCCOC1 ZINC000789579027 643750741 /nfs/dbraw/zinc/75/07/41/643750741.db2.gz DSKGNPLVUVCZCE-LSDHHAIUSA-N 1 2 307.390 2.149 20 10 DECDLO O=C1NCC2(CC[NH+](Cc3c(O)ccc(Cl)c3F)CC2)O1 ZINC000792179703 644085324 /nfs/dbraw/zinc/08/53/24/644085324.db2.gz KXQBDTKVDXGCGE-UHFFFAOYSA-N 1 2 314.744 2.259 20 10 DECDLO C[C@H]([NH2+][C@@H](CO)C[C@H](O)C(C)(C)C)c1cc(F)cc(F)c1O ZINC000793566527 644274721 /nfs/dbraw/zinc/27/47/21/644274721.db2.gz GJBOZUAXYQSPEC-PXWWUCIGSA-N 1 2 317.376 2.479 20 10 DECDLO Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)Cc1c[nH+]cn1C ZINC000839920185 645302448 /nfs/dbraw/zinc/30/24/48/645302448.db2.gz MRYZAUBZSSCAAO-CQSZACIVSA-N 1 2 314.433 2.084 20 10 DECDLO Oc1ccc(F)cc1CNc1ccc(N2CCOCC2)c[nH+]1 ZINC000802642723 645538473 /nfs/dbraw/zinc/53/84/73/645538473.db2.gz CPBSBPYYNPUKSZ-UHFFFAOYSA-N 1 2 303.337 2.375 20 10 DECDLO Cn1ncc2c1nc[nH+]c2NCc1ccc2c(c1)CCCN2C ZINC000058555597 646554929 /nfs/dbraw/zinc/55/49/29/646554929.db2.gz HWECQCDKGYBWJE-UHFFFAOYSA-N 1 2 308.389 2.358 20 10 DECDLO NC(=O)[C@@H]1[C@@H]2CCC[C@@H]2C[N@@H+]1Cc1cc(Cl)c(F)cc1O ZINC000816588980 647156434 /nfs/dbraw/zinc/15/64/34/647156434.db2.gz HRLGFOYBSCXSPM-PWZJLYFZSA-N 1 2 312.772 2.271 20 10 DECDLO NC(=O)[C@@H]1[C@@H]2CCC[C@@H]2C[N@H+]1Cc1cc(Cl)c(F)cc1O ZINC000816588980 647156437 /nfs/dbraw/zinc/15/64/37/647156437.db2.gz HRLGFOYBSCXSPM-PWZJLYFZSA-N 1 2 312.772 2.271 20 10 DECDLO C[C@H]([NH2+][C@@H]1CC[C@H]1O)c1cc(Br)cc(F)c1O ZINC000818357692 647457460 /nfs/dbraw/zinc/45/74/60/647457460.db2.gz HMWYVRWTHLYIRW-MQOMDTIOSA-N 1 2 304.159 2.468 20 10 DECDLO O=C(/C=C/c1ccc(O)c(O)c1)NCCCNc1cccc[nH+]1 ZINC000181099056 648550790 /nfs/dbraw/zinc/55/07/90/648550790.db2.gz INGMAGJUYGGGJJ-SOFGYWHQSA-N 1 2 313.357 2.124 20 10 DECDLO COc1ccc(N2CC[NH+](CCOCC(F)(F)F)CC2)cc1 ZINC000194301451 649253772 /nfs/dbraw/zinc/25/37/72/649253772.db2.gz XFWKSSQOAMHGLW-UHFFFAOYSA-N 1 2 318.339 2.396 20 10 DECDLO COC(=O)[C@@H](C)[N@@H+](C)Cc1ccc(N2CCC(OC)CC2)cc1 ZINC000829352560 649298819 /nfs/dbraw/zinc/29/88/19/649298819.db2.gz RWCWMLACSLTBFK-CQSZACIVSA-N 1 2 320.433 2.295 20 10 DECDLO COC(=O)[C@@H](C)[N@H+](C)Cc1ccc(N2CCC(OC)CC2)cc1 ZINC000829352560 649298822 /nfs/dbraw/zinc/29/88/22/649298822.db2.gz RWCWMLACSLTBFK-CQSZACIVSA-N 1 2 320.433 2.295 20 10 DECDLO C[C@@H](NC(=O)[C@@H]1C[C@H]1c1c[nH+]cn1C)c1ccc(N(C)C)cc1 ZINC000832431237 649709945 /nfs/dbraw/zinc/70/99/45/649709945.db2.gz LYUROPWXSKDQED-DAXOMENPSA-N 1 2 312.417 2.467 20 10 DECDLO C[C@@H]([NH2+]Cc1cnsn1)c1ccc(N2CCOCC2)cc1 ZINC000846846385 651356516 /nfs/dbraw/zinc/35/65/16/651356516.db2.gz VNSGLRQFRQNDNQ-GFCCVEGCSA-N 1 2 304.419 2.226 20 10 DECDLO C[C@H]([NH2+][C@H]1CCc2c(nnn2C)C1)c1cc(F)cc(F)c1O ZINC000848564007 651471517 /nfs/dbraw/zinc/47/15/17/651471517.db2.gz GRPMTEDDPRZREP-WPRPVWTQSA-N 1 2 308.332 2.007 20 10 DECDLO CS[C@@H](CO)[C@@H](C)[NH2+]Cc1cccc(Br)c1O ZINC000219044556 685106017 /nfs/dbraw/zinc/10/60/17/685106017.db2.gz NRWIMIVVOWICAJ-KCJUWKMLSA-N 1 2 320.252 2.357 20 10 DECDLO COC(=O)[C@@H](C[C@@H]1CCCOC1)[NH2+]Cc1cccc(C)c1O ZINC000862516351 686313338 /nfs/dbraw/zinc/31/33/38/686313338.db2.gz PLTOOVMCFLOESI-DZGCQCFKSA-N 1 2 307.390 2.149 20 10 DECDLO COC(=O)CCCc1nc(C[NH2+][C@H](C)c2ccccc2O)no1 ZINC000879648166 690699494 /nfs/dbraw/zinc/69/94/94/690699494.db2.gz AXAUKDANCBSJTN-LLVKDONJSA-N 1 2 319.361 2.122 20 10 DECDLO CN(C)c1ccc(C[NH+]2CCN(CCCCCO)CC2)cc1 ZINC000931495767 694413042 /nfs/dbraw/zinc/41/30/42/694413042.db2.gz OAXTWQDTAFUFIS-UHFFFAOYSA-N 1 2 305.466 2.033 20 10 DECDLO Oc1c(F)cc(F)cc1C[NH2+][C@@H]1CCN(CC(F)(F)F)C1 ZINC000882944293 691394631 /nfs/dbraw/zinc/39/46/31/691394631.db2.gz BEKWERUYISDFKV-SNVBAGLBSA-N 1 2 310.266 2.397 20 10 DECDLO NC(=O)C1CCN(c2ccc(CNc3cccc[nH+]3)cc2)CC1 ZINC000884694234 691785087 /nfs/dbraw/zinc/78/50/87/691785087.db2.gz GMIUOKXVIYBHGQ-UHFFFAOYSA-N 1 2 310.401 2.395 20 10 DECDLO O=C(NCCCn1cc[nH+]c1)NCc1cccc(Cl)c1O ZINC000891428859 692960401 /nfs/dbraw/zinc/96/04/01/692960401.db2.gz FCVVGGOQPFUXHC-UHFFFAOYSA-N 1 2 308.769 2.132 20 10 DECDLO Cn1cc[nH+]c1[C@H]1CCCN(C(=O)NCc2ccc(N)cc2)C1 ZINC001346738656 1151019077 /nfs/dbraw/zinc/01/90/77/1151019077.db2.gz IVDHTIUSMNSOQS-AWEZNQCLSA-N 1 2 313.405 2.092 20 10 DECDLO Nc1cc[nH+]c(-c2cc(NC(=O)c3cccc(O)c3O)ccn2)c1 ZINC001148212286 791711295 /nfs/dbraw/zinc/71/12/95/791711295.db2.gz VZFGPVRBHFNDBD-UHFFFAOYSA-N 1 2 322.324 2.389 20 10 DECDLO Oc1c(F)cc(Br)cc1C[NH2+]CC1(O)CCC1 ZINC000715759470 792511826 /nfs/dbraw/zinc/51/18/26/792511826.db2.gz NQJIGSBJVCGGND-UHFFFAOYSA-N 1 2 304.159 2.298 20 10 DECDLO CC(C)(CO)C[NH2+]Cc1cc(Br)cc(F)c1O ZINC000715776690 792511896 /nfs/dbraw/zinc/51/18/96/792511896.db2.gz CJGSHFXFBQOHRF-UHFFFAOYSA-N 1 2 306.175 2.402 20 10 DECDLO COC[C@@H]1C[N@H+](Cc2cccc(F)c2O)Cc2ncn(C)c21 ZINC001138125805 796167038 /nfs/dbraw/zinc/16/70/38/796167038.db2.gz XHTQOBSYQRIEIX-LBPRGKRZSA-N 1 2 305.353 2.011 20 10 DECDLO COC[C@@H]1C[N@@H+](Cc2cccc(F)c2O)Cc2ncn(C)c21 ZINC001138125805 796167042 /nfs/dbraw/zinc/16/70/42/796167042.db2.gz XHTQOBSYQRIEIX-LBPRGKRZSA-N 1 2 305.353 2.011 20 10 DECDLO Oc1c(C[N@@H+]2CCn3nccc3C2)cc2c3c1CCCN3CCC2 ZINC001138341718 796200582 /nfs/dbraw/zinc/20/05/82/796200582.db2.gz JJOJSHPCYQWCBZ-UHFFFAOYSA-N 1 2 324.428 2.303 20 10 DECDLO Oc1c(C[N@H+]2CCn3nccc3C2)cc2c3c1CCCN3CCC2 ZINC001138341718 796200587 /nfs/dbraw/zinc/20/05/87/796200587.db2.gz JJOJSHPCYQWCBZ-UHFFFAOYSA-N 1 2 324.428 2.303 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CC[C@@H](F)[C@@H](O)CC1 ZINC001139126772 796327223 /nfs/dbraw/zinc/32/72/23/796327223.db2.gz PTMZGFKENHJGBM-HIFRSBDPSA-N 1 2 321.348 2.102 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CC[C@@H](F)[C@@H](O)CC1 ZINC001139126772 796327226 /nfs/dbraw/zinc/32/72/26/796327226.db2.gz PTMZGFKENHJGBM-HIFRSBDPSA-N 1 2 321.348 2.102 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CC[C@](C)(O)[C@@H](C)C1 ZINC001139126712 796328300 /nfs/dbraw/zinc/32/83/00/796328300.db2.gz NOILWTLGRKAKDA-SGTLLEGYSA-N 1 2 317.385 2.400 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CC[C@](C)(O)[C@@H](C)C1 ZINC001139126712 796328307 /nfs/dbraw/zinc/32/83/07/796328307.db2.gz NOILWTLGRKAKDA-SGTLLEGYSA-N 1 2 317.385 2.400 20 10 DECDLO COc1cc(O)c(C[N@@H+]2CCN(C)CC23CCCC3)c(OC)c1 ZINC001141032420 796622333 /nfs/dbraw/zinc/62/23/33/796622333.db2.gz BFXLPEQKWZIFKO-UHFFFAOYSA-N 1 2 320.433 2.470 20 10 DECDLO COc1cc(O)c(C[N@H+]2CCN(C)CC23CCCC3)c(OC)c1 ZINC001141032420 796622335 /nfs/dbraw/zinc/62/23/35/796622335.db2.gz BFXLPEQKWZIFKO-UHFFFAOYSA-N 1 2 320.433 2.470 20 10 DECDLO CCOCc1noc2c1C[N@H+](Cc1cc(O)ccc1O)CC2 ZINC001141158540 796642455 /nfs/dbraw/zinc/64/24/55/796642455.db2.gz DCSUZQONKHSXBG-UHFFFAOYSA-N 1 2 304.346 2.181 20 10 DECDLO CCOCc1noc2c1C[N@@H+](Cc1cc(O)ccc1O)CC2 ZINC001141158540 796642458 /nfs/dbraw/zinc/64/24/58/796642458.db2.gz DCSUZQONKHSXBG-UHFFFAOYSA-N 1 2 304.346 2.181 20 10 DECDLO CCOc1ccc(N2CC[NH+](Cc3cc(C)nn3C)CC2)cc1 ZINC001205935821 800446383 /nfs/dbraw/zinc/44/63/83/800446383.db2.gz UWRDOISUFOFCQF-UHFFFAOYSA-N 1 2 314.433 2.449 20 10 DECDLO COc1ccc(N2CC[NH+](Cc3cnc(C)cn3)CC2)c(C)c1 ZINC001207080589 800677363 /nfs/dbraw/zinc/67/73/63/800677363.db2.gz UITWWAOKBDURPD-UHFFFAOYSA-N 1 2 312.417 2.424 20 10 DECDLO Oc1cc(C[N@@H+]2CCCC[C@](O)(C(F)(F)F)C2)cc(O)c1O ZINC001233009986 802000470 /nfs/dbraw/zinc/00/04/70/802000470.db2.gz GDJXJPSPBRBBFV-CYBMUJFWSA-N 1 2 321.295 2.083 20 10 DECDLO Oc1cc(C[N@H+]2CCCC[C@](O)(C(F)(F)F)C2)cc(O)c1O ZINC001233009986 802000479 /nfs/dbraw/zinc/00/04/79/802000479.db2.gz GDJXJPSPBRBBFV-CYBMUJFWSA-N 1 2 321.295 2.083 20 10 DECDLO Cc1nccnc1O[C@@H]1CC[N@@H+](Cc2c(O)ccc(F)c2F)C1 ZINC001233336534 802079855 /nfs/dbraw/zinc/07/98/55/802079855.db2.gz OZSFKQUDVKEVCV-LLVKDONJSA-N 1 2 321.327 2.422 20 10 DECDLO CCC(CC)[C@@H](O)C[NH2+][C@H](C)c1cccc(-c2nn[nH]n2)c1O ZINC001604023736 1070178813 /nfs/dbraw/zinc/17/88/13/1070178813.db2.gz ZXKLKHYXQDHEQJ-YGRLFVJLSA-N 1 2 319.409 2.020 20 10 DECDLO CC[C@H]([NH2+]CC1(OC)CCC1)c1cccc(-c2nn[nH]n2)c1O ZINC001604055351 1070189805 /nfs/dbraw/zinc/18/98/05/1070189805.db2.gz MNSRYLABRGMEEI-ZDUSSCGKSA-N 1 2 317.393 2.182 20 10 DECDLO O=C(Cc1ccc(O)c(O)c1)NCCCCNc1cccc[nH+]1 ZINC001464875195 1059221466 /nfs/dbraw/zinc/22/14/66/1059221466.db2.gz VTKPPOUFHHXWEM-UHFFFAOYSA-N 1 2 315.373 2.044 20 10 DECDLO NC(=O)N=Nc1ccc(C(=O)N2CCc3cc[nH+]c(N)c3C2)cc1 ZINC001635027592 1078442387 /nfs/dbraw/zinc/44/23/87/1078442387.db2.gz WHEZCBDJMHYGGH-UHFFFAOYSA-N 1 2 324.344 2.025 20 10 DECDLO C[C@@H]([NH2+][C@@H](C)C1CCOCC1)c1cccc(-c2nn[nH]n2)c1O ZINC001589950315 1076531772 /nfs/dbraw/zinc/53/17/72/1076531772.db2.gz RBPWLYNMWKCTGI-WDEREUQCSA-N 1 2 317.393 2.038 20 10 DECDLO C[C@@H]([NH2+][C@@H](C)c1cccc(-c2nn[nH]n2)c1O)C1CCOCC1 ZINC001589950311 1076531941 /nfs/dbraw/zinc/53/19/41/1076531941.db2.gz RBPWLYNMWKCTGI-MNOVXSKESA-N 1 2 317.393 2.038 20 10 DECDLO C[C@@H]([NH2+][C@H](C)C1CCOCC1)c1cccc(-c2nn[nH]n2)c1O ZINC001589950309 1076532095 /nfs/dbraw/zinc/53/20/95/1076532095.db2.gz RBPWLYNMWKCTGI-GHMZBOCLSA-N 1 2 317.393 2.038 20 10 DECDLO C[C@@H]([NH2+][C@H]1CCOC(C)(C)C1)c1cccc(-c2nn[nH]n2)c1O ZINC001589952825 1076534452 /nfs/dbraw/zinc/53/44/52/1076534452.db2.gz DGQYSVMIAYCJGJ-MNOVXSKESA-N 1 2 317.393 2.181 20 10 DECDLO CC[C@H]([NH2+]C[C@@](C)(O)C(C)C)c1cccc(-c2nn[nH]n2)c1O ZINC001590464003 1076632088 /nfs/dbraw/zinc/63/20/88/1076632088.db2.gz NYPGMUQASWYINE-XJKSGUPXSA-N 1 2 319.409 2.020 20 10 DECDLO CC[C@@H]([NH2+]CCOC1CCC1)c1cccc(-c2nn[nH]n2)c1O ZINC001590466006 1076633378 /nfs/dbraw/zinc/63/33/78/1076633378.db2.gz JCHQFJHMQQYIDN-CQSZACIVSA-N 1 2 317.393 2.182 20 10 DECDLO CO[C@@](C)(C[NH2+][C@H](C)c1cccc(-c2nn[nH]n2)c1O)C1CC1 ZINC001591317588 1076720464 /nfs/dbraw/zinc/72/04/64/1076720464.db2.gz GNVVPXVCXUVMAA-HWPZZCPQSA-N 1 2 317.393 2.038 20 10 DECDLO COC1(C[NH2+][C@@H](C)c2cccc(-c3nn[nH]n3)c2O)CCCC1 ZINC001591342118 1076729360 /nfs/dbraw/zinc/72/93/60/1076729360.db2.gz IIAMCUCODPMYLI-NSHDSACASA-N 1 2 317.393 2.182 20 10 DECDLO COC(=O)C[C@@H]1CSCC[N@@H+]1Cc1cc(F)c(F)cc1O ZINC001658851297 1080219412 /nfs/dbraw/zinc/21/94/12/1080219412.db2.gz VDWBPXHDQHHHBK-SNVBAGLBSA-N 1 2 317.357 2.151 20 10 DECDLO COC(=O)C[C@@H]1CSCC[N@H+]1Cc1cc(F)c(F)cc1O ZINC001658851297 1080219418 /nfs/dbraw/zinc/21/94/18/1080219418.db2.gz VDWBPXHDQHHHBK-SNVBAGLBSA-N 1 2 317.357 2.151 20 10 DECDLO CN1CCCc2cc(C[N@@H+]3CCc4cc(C(N)=O)[nH]c4C3)ccc21 ZINC001277254185 1083875231 /nfs/dbraw/zinc/87/52/31/1083875231.db2.gz PAKXSZBROLGETC-UHFFFAOYSA-N 1 2 324.428 2.054 20 10 DECDLO CN1CCCc2cc(C[N@H+]3CCc4cc(C(N)=O)[nH]c4C3)ccc21 ZINC001277254185 1083875238 /nfs/dbraw/zinc/87/52/38/1083875238.db2.gz PAKXSZBROLGETC-UHFFFAOYSA-N 1 2 324.428 2.054 20 10 DECDLO C[C@]1(O)COCC[N@H+](Cc2cc(Cl)c(Cl)cc2O)C1 ZINC001236792607 1138430543 /nfs/dbraw/zinc/43/05/43/1138430543.db2.gz FUHQOUCYVZLLGN-CYBMUJFWSA-N 1 2 306.189 2.282 20 10 DECDLO C[C@]1(O)COCC[N@@H+](Cc2cc(Cl)c(Cl)cc2O)C1 ZINC001236792607 1138430546 /nfs/dbraw/zinc/43/05/46/1138430546.db2.gz FUHQOUCYVZLLGN-CYBMUJFWSA-N 1 2 306.189 2.282 20 10 DECDLO CCOc1ccc(C[N@@H+]2CCN(C(C)(C)C)C(=O)C2)c(O)c1 ZINC001237044856 1138487217 /nfs/dbraw/zinc/48/72/17/1138487217.db2.gz VBVQFHGWRVCOHC-UHFFFAOYSA-N 1 2 306.406 2.234 20 10 DECDLO CCOc1ccc(C[N@H+]2CCN(C(C)(C)C)C(=O)C2)c(O)c1 ZINC001237044856 1138487220 /nfs/dbraw/zinc/48/72/20/1138487220.db2.gz VBVQFHGWRVCOHC-UHFFFAOYSA-N 1 2 306.406 2.234 20 10 DECDLO Oc1cc(OCC(F)(F)F)ccc1C[N@@H+]1CCO[C@H]2C[C@H]21 ZINC001237062946 1138493200 /nfs/dbraw/zinc/49/32/00/1138493200.db2.gz QLNASABKDLSFDP-YPMHNXCESA-N 1 2 303.280 2.306 20 10 DECDLO Oc1cc(OCC(F)(F)F)ccc1C[N@H+]1CCO[C@H]2C[C@H]21 ZINC001237062946 1138493204 /nfs/dbraw/zinc/49/32/04/1138493204.db2.gz QLNASABKDLSFDP-YPMHNXCESA-N 1 2 303.280 2.306 20 10 DECDLO COc1cc(C[N@@H+]2CCC[C@H]2c2nc(C)no2)c(O)c(OC)c1 ZINC001237678587 1138753071 /nfs/dbraw/zinc/75/30/71/1138753071.db2.gz PNVFGKFFZZIILS-ZDUSSCGKSA-N 1 2 319.361 2.438 20 10 DECDLO COc1cc(C[N@H+]2CCC[C@H]2c2nc(C)no2)c(O)c(OC)c1 ZINC001237678587 1138753085 /nfs/dbraw/zinc/75/30/85/1138753085.db2.gz PNVFGKFFZZIILS-ZDUSSCGKSA-N 1 2 319.361 2.438 20 10 DECDLO CC(C)(O)C[NH+]1CCN(Cc2cc(F)cc(Cl)c2O)CC1 ZINC001237802709 1138792544 /nfs/dbraw/zinc/79/25/44/1138792544.db2.gz OCVHLEHTWMBXAJ-UHFFFAOYSA-N 1 2 316.804 2.073 20 10 DECDLO CN(C)C(=O)c1cc2c([nH]1)C[N@H+](Cc1cc(F)ccc1O)CC2 ZINC001278254586 1138860104 /nfs/dbraw/zinc/86/01/04/1138860104.db2.gz AGRGMHUJNSWODR-UHFFFAOYSA-N 1 2 317.364 2.120 20 10 DECDLO CN(C)C(=O)c1cc2c([nH]1)C[N@@H+](Cc1cc(F)ccc1O)CC2 ZINC001278254586 1138860107 /nfs/dbraw/zinc/86/01/07/1138860107.db2.gz AGRGMHUJNSWODR-UHFFFAOYSA-N 1 2 317.364 2.120 20 10 DECDLO COc1cc(O)c(C[NH+]2CCC2)cc1I ZINC001248459193 1141800286 /nfs/dbraw/zinc/80/02/86/1141800286.db2.gz RNKAGLRPYLUVCB-UHFFFAOYSA-N 1 2 319.142 2.211 20 10 DECDLO COC(=O)[C@H](Cc1ccc(O)c(O)c1)[NH2+][C@H]1CCC[C@@H](C)C1 ZINC001258806748 1144042945 /nfs/dbraw/zinc/04/29/45/1144042945.db2.gz BKJXDHROJVTYLU-XBFCOCLRSA-N 1 2 307.390 2.350 20 10 DECDLO COC(=O)c1ccc(O)c([C@@H](C)[NH2+][C@@H]2CCn3ccnc32)c1 ZINC000834829925 649852661 /nfs/dbraw/zinc/85/26/61/649852661.db2.gz ABNFCFJAWIGHCV-ZWNOBZJWSA-N 1 2 301.346 2.171 20 10 DECDLO C[N@H+](Cc1cc(Cl)cc(Cl)c1O)[C@@H]1CCS(=O)(=O)C1 ZINC000132399641 401866872 /nfs/dbraw/zinc/86/68/72/401866872.db2.gz KBZYJMXSUIDAPY-SNVBAGLBSA-N 1 2 324.229 2.318 20 10 DECDLO C[N@@H+](Cc1cc(Cl)cc(Cl)c1O)[C@@H]1CCS(=O)(=O)C1 ZINC000132399641 401866873 /nfs/dbraw/zinc/86/68/73/401866873.db2.gz KBZYJMXSUIDAPY-SNVBAGLBSA-N 1 2 324.229 2.318 20 10 DECDLO COC(=O)[C@]1(C)CCC[N@@H+]1Cc1cc(F)cc(C(C)=O)c1O ZINC000186396812 402427987 /nfs/dbraw/zinc/42/79/87/402427987.db2.gz QOZYAJAMKQBKQL-INIZCTEOSA-N 1 2 309.337 2.261 20 10 DECDLO COC(=O)[C@]1(C)CCC[N@H+]1Cc1cc(F)cc(C(C)=O)c1O ZINC000186396812 402427990 /nfs/dbraw/zinc/42/79/90/402427990.db2.gz QOZYAJAMKQBKQL-INIZCTEOSA-N 1 2 309.337 2.261 20 10 DECDLO COCCN(CCCn1cc[nH+]c1)c1ccc(OC)c(OC)c1 ZINC000182927583 402727830 /nfs/dbraw/zinc/72/78/30/402727830.db2.gz BVLHFLVAEBQPNW-UHFFFAOYSA-N 1 2 319.405 2.443 20 10 DECDLO C[C@@H]1CCNC(=O)[C@H]1[NH2+]Cc1cc(Cl)cc(Cl)c1O ZINC000193700563 402776048 /nfs/dbraw/zinc/77/60/48/402776048.db2.gz VJGXZDILKXXHMT-HQJQHLMTSA-N 1 2 303.189 2.313 20 10 DECDLO CC[C@@H]1CO[C@@H](C)C[N@@H+]1Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000278284101 402862370 /nfs/dbraw/zinc/86/23/70/402862370.db2.gz UAMUJYULMQEHTJ-CMPLNLGQSA-N 1 2 310.350 2.308 20 10 DECDLO CC[C@@H]1CO[C@@H](C)C[N@H+]1Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000278284101 402862371 /nfs/dbraw/zinc/86/23/71/402862371.db2.gz UAMUJYULMQEHTJ-CMPLNLGQSA-N 1 2 310.350 2.308 20 10 DECDLO OCC[C@]1([NH2+]Cc2cc(Cl)cc(Cl)c2O)CCOC1 ZINC000278542700 402868187 /nfs/dbraw/zinc/86/81/87/402868187.db2.gz XQKQRDIUYXDTLM-ZDUSSCGKSA-N 1 2 306.189 2.330 20 10 DECDLO COc1c(O)c(C[NH2+]C(C)(C)c2noc(C)n2)ccc1[N+](=O)[O-] ZINC000278566967 402868462 /nfs/dbraw/zinc/86/84/62/402868462.db2.gz CCIDNMSYQHDEDS-UHFFFAOYSA-N 1 2 322.321 2.025 20 10 DECDLO C[C@H]([NH2+]Cc1cc(Br)ccc1O)c1ncn(C)n1 ZINC000275827601 403126724 /nfs/dbraw/zinc/12/67/24/403126724.db2.gz NVYFJUGQKWNSFF-QMMMGPOBSA-N 1 2 311.183 2.134 20 10 DECDLO OC[C@@H]1CCCCN1c1cc(NCc2ccccc2O)[nH+]cn1 ZINC000277445964 403218659 /nfs/dbraw/zinc/21/86/59/403218659.db2.gz NAEFGCWSUBGBHU-AWEZNQCLSA-N 1 2 314.389 2.146 20 10 DECDLO OC[C@@H]1CCCCN1c1cc(NCc2ccccc2O)nc[nH+]1 ZINC000277445964 403218662 /nfs/dbraw/zinc/21/86/62/403218662.db2.gz NAEFGCWSUBGBHU-AWEZNQCLSA-N 1 2 314.389 2.146 20 10 DECDLO Cn1cc[nH+]c1[C@H]1N(C(=O)c2cccc(O)c2O)CC1(C)C ZINC000295824370 404015274 /nfs/dbraw/zinc/01/52/74/404015274.db2.gz HYNOBYHZMUHGCX-CYBMUJFWSA-N 1 2 301.346 2.055 20 10 DECDLO CN(C)c1ccc(C[N@@H+]2CCNC(=O)[C@@H]2c2cccs2)cc1 ZINC000373167314 404531940 /nfs/dbraw/zinc/53/19/40/404531940.db2.gz QGOBUAXYZHPWGK-INIZCTEOSA-N 1 2 315.442 2.487 20 10 DECDLO CN(C)c1ccc(C[N@H+]2CCNC(=O)[C@@H]2c2cccs2)cc1 ZINC000373167314 404531948 /nfs/dbraw/zinc/53/19/48/404531948.db2.gz QGOBUAXYZHPWGK-INIZCTEOSA-N 1 2 315.442 2.487 20 10 DECDLO CN(C)c1ccc(/C=C\C[NH+]2CCC(S(C)(=O)=O)CC2)cc1 ZINC000835025650 649868085 /nfs/dbraw/zinc/86/80/85/649868085.db2.gz IPVOGQXCFVNTMP-PLNGDYQASA-N 1 2 322.474 2.275 20 10 DECDLO CN(C)c1ccc(C[NH+]2CCN(c3ncccn3)CC2)cc1F ZINC000158810918 522180070 /nfs/dbraw/zinc/18/00/70/522180070.db2.gz KKNUBSZPSLXHKA-UHFFFAOYSA-N 1 2 315.396 2.004 20 10 DECDLO C[C@@H]([NH2+]Cc1cccc(Cl)c1O)C(=O)NCc1ccco1 ZINC000181197781 525533615 /nfs/dbraw/zinc/53/36/15/525533615.db2.gz HTLMRZVEXUAFIS-SNVBAGLBSA-N 1 2 308.765 2.433 20 10 DECDLO Cc1ccc(C(=O)NCCCNc2cccc[nH+]2)c(O)c1O ZINC000182470752 526162048 /nfs/dbraw/zinc/16/20/48/526162048.db2.gz HWABAZWLXRWVRL-UHFFFAOYSA-N 1 2 301.346 2.033 20 10 DECDLO Nc1ccc(CC(=O)NCc2cc[nH+]c(N3CCCC3)c2)cc1 ZINC000237908657 527477822 /nfs/dbraw/zinc/47/78/22/527477822.db2.gz CMOHPESWCWWOEJ-UHFFFAOYSA-N 1 2 310.401 2.123 20 10 DECDLO Cc1[nH+]cc2n1C[C@H](C(=O)NCc1cccc(Cl)c1O)CC2 ZINC000890759052 623197419 /nfs/dbraw/zinc/19/74/19/623197419.db2.gz AUMLJOZOPWISMU-GFCCVEGCSA-N 1 2 319.792 2.429 20 10 DECDLO COc1ccc(O)c([C@@H](C)NC(=O)[C@H]2CCn3cc[nH+]c3C2)c1 ZINC000161404410 625039835 /nfs/dbraw/zinc/03/98/35/625039835.db2.gz NSPFDJNSGJVSIL-NEPJUHHUSA-N 1 2 315.373 2.037 20 10 DECDLO CC(=O)NC1CC[NH+](Cc2cc(Cl)cc(C(C)=O)c2O)CC1 ZINC000177083724 625762658 /nfs/dbraw/zinc/76/26/58/625762658.db2.gz KLJPPRHIJAQABV-UHFFFAOYSA-N 1 2 324.808 2.349 20 10 DECDLO Cc1cc(C(=O)N2CC(n3cc[nH+]c3)C2)c(C)n1-c1ccccn1 ZINC000733985472 633311590 /nfs/dbraw/zinc/31/15/90/633311590.db2.gz FXVALFAQLLNYOJ-UHFFFAOYSA-N 1 2 321.384 2.383 20 10 DECDLO C[C@H](CS(C)(=O)=O)[N@H+](Cc1cc(Cl)ccc1O)C1CC1 ZINC000093392311 633919569 /nfs/dbraw/zinc/91/95/69/633919569.db2.gz QHINJDSDZIZROJ-SNVBAGLBSA-N 1 2 317.838 2.443 20 10 DECDLO C[C@H](CS(C)(=O)=O)[N@@H+](Cc1cc(Cl)ccc1O)C1CC1 ZINC000093392311 633919575 /nfs/dbraw/zinc/91/95/75/633919575.db2.gz QHINJDSDZIZROJ-SNVBAGLBSA-N 1 2 317.838 2.443 20 10 DECDLO OC[C@@H]1CC[N@H+](Cc2cc(Br)cc(F)c2O)C1 ZINC000893987341 636084661 /nfs/dbraw/zinc/08/46/61/636084661.db2.gz UNULMTQNUXKRIG-MRVPVSSYSA-N 1 2 304.159 2.108 20 10 DECDLO OC[C@@H]1CC[N@@H+](Cc2cc(Br)cc(F)c2O)C1 ZINC000893987341 636084664 /nfs/dbraw/zinc/08/46/64/636084664.db2.gz UNULMTQNUXKRIG-MRVPVSSYSA-N 1 2 304.159 2.108 20 10 DECDLO Oc1c(Cl)cccc1C[NH2+]CC1(C2(O)CCOCC2)CC1 ZINC000896634231 638615811 /nfs/dbraw/zinc/61/58/11/638615811.db2.gz WNDVDGPKGIHYPM-UHFFFAOYSA-N 1 2 311.809 2.457 20 10 DECDLO COc1ccc(O)c([C@H](C)NC(=O)N[C@H](C)Cn2cc[nH+]c2)c1 ZINC000103512873 639767103 /nfs/dbraw/zinc/76/71/03/639767103.db2.gz BENRHXDEIVLSPI-NEPJUHHUSA-N 1 2 318.377 2.046 20 10 DECDLO COCC[N@H+](CC(=O)OC(C)(C)C)Cc1cc(C)ccc1O ZINC000769233326 641201181 /nfs/dbraw/zinc/20/11/81/641201181.db2.gz RGMHAAOLMABXIX-UHFFFAOYSA-N 1 2 309.406 2.491 20 10 DECDLO COCC[N@@H+](CC(=O)OC(C)(C)C)Cc1cc(C)ccc1O ZINC000769233326 641201188 /nfs/dbraw/zinc/20/11/88/641201188.db2.gz RGMHAAOLMABXIX-UHFFFAOYSA-N 1 2 309.406 2.491 20 10 DECDLO CCN(CC)c1ccc(C[N@@H+]2C[C@@H](CO)OC[C@H]2C)cc1F ZINC000770353749 641358810 /nfs/dbraw/zinc/35/88/10/641358810.db2.gz TUGHIMSCBSKUPX-HIFRSBDPSA-N 1 2 310.413 2.254 20 10 DECDLO CCN(CC)c1ccc(C[N@H+]2C[C@@H](CO)OC[C@H]2C)cc1F ZINC000770353749 641358811 /nfs/dbraw/zinc/35/88/11/641358811.db2.gz TUGHIMSCBSKUPX-HIFRSBDPSA-N 1 2 310.413 2.254 20 10 DECDLO CCC[NH+]1CCC([NH2+]Cc2ccc([N+](=O)[O-])c(OC)c2[O-])CC1 ZINC000775051953 641999643 /nfs/dbraw/zinc/99/96/43/641999643.db2.gz RIVOJRUURCAZCH-UHFFFAOYSA-N 1 2 323.393 2.273 20 10 DECDLO C[C@H](NC(=O)[C@@H]1CCn2cc[nH+]c2C1)c1ccc(N(C)C)cc1 ZINC000775405812 642040528 /nfs/dbraw/zinc/04/05/28/642040528.db2.gz VKERCJRXKGAKFT-DZGCQCFKSA-N 1 2 312.417 2.389 20 10 DECDLO OCC1CCN(c2ccc(CNc3cc[nH+]cc3F)cc2)CC1 ZINC000775483805 642050808 /nfs/dbraw/zinc/05/08/08/642050808.db2.gz CBECHUUXYAKFNK-UHFFFAOYSA-N 1 2 315.392 2.463 20 10 DECDLO CCOCC[NH+]1CCN(Cc2cc(Cl)cc(F)c2O)CC1 ZINC000775648332 642071804 /nfs/dbraw/zinc/07/18/04/642071804.db2.gz SFCPFJCLVPNQGG-UHFFFAOYSA-N 1 2 316.804 2.339 20 10 DECDLO CC(C)COC(=O)N1CC[NH+](Cc2cc(F)ccc2O)CC1 ZINC000779002773 642454437 /nfs/dbraw/zinc/45/44/37/642454437.db2.gz ONZDIEPCAGPQCW-UHFFFAOYSA-N 1 2 310.369 2.442 20 10 DECDLO C[C@@H]([NH2+]Cc1cccc(Br)c1O)c1nncn1C ZINC000042412006 642583695 /nfs/dbraw/zinc/58/36/95/642583695.db2.gz QBJVOJJBMCGVQK-MRVPVSSYSA-N 1 2 311.183 2.134 20 10 DECDLO Cc1ccc(C(=O)N[C@H](Cn2cc[nH+]c2)C(C)(C)C)c(O)c1O ZINC000780907656 642688488 /nfs/dbraw/zinc/68/84/88/642688488.db2.gz RUJBDLGUSYPACR-CYBMUJFWSA-N 1 2 317.389 2.447 20 10 DECDLO C[C@H](C(=O)OCC(=O)c1ccc(O)c(O)c1)[NH+]1[C@H](C)CC[C@H]1C ZINC000783781567 643052140 /nfs/dbraw/zinc/05/21/40/643052140.db2.gz YRFSNEZUZKYBRD-IJLUTSLNSA-N 1 2 321.373 2.085 20 10 DECDLO Cc1cc(N(C)C)ccc1CNC(=O)[C@@H]1CCc2[nH+]ccn2C1 ZINC000786988560 643438072 /nfs/dbraw/zinc/43/80/72/643438072.db2.gz MNKJZOWWFBMMSU-OAHLLOKOSA-N 1 2 312.417 2.136 20 10 DECDLO CCOCc1cc(C[NH2+]Cc2ncnn2CC)ccc1OC ZINC000793347561 644239162 /nfs/dbraw/zinc/23/91/62/644239162.db2.gz YBQSXERLVMRAPX-UHFFFAOYSA-N 1 2 304.394 2.133 20 10 DECDLO C[C@@H]([NH2+]Cc1cc(Cl)cc(F)c1O)C1(S(C)(=O)=O)CC1 ZINC000809703150 646265436 /nfs/dbraw/zinc/26/54/36/646265436.db2.gz GCBJYORBIUMMBE-MRVPVSSYSA-N 1 2 321.801 2.240 20 10 DECDLO CCOC[C@@H](C(=O)OC)[N@H+](C)Cc1ccc(N(C)C)c(C)c1 ZINC000815074736 646963941 /nfs/dbraw/zinc/96/39/41/646963941.db2.gz CHCLOBVMUJGUDT-INIZCTEOSA-N 1 2 308.422 2.071 20 10 DECDLO CCOC[C@@H](C(=O)OC)[N@@H+](C)Cc1ccc(N(C)C)c(C)c1 ZINC000815074736 646963942 /nfs/dbraw/zinc/96/39/42/646963942.db2.gz CHCLOBVMUJGUDT-INIZCTEOSA-N 1 2 308.422 2.071 20 10 DECDLO CCN(C)c1ccc(C[N@@H+]2CCC[C@H](c3n[nH]c(=O)[nH]3)C2)cc1 ZINC000815120004 646973331 /nfs/dbraw/zinc/97/33/31/646973331.db2.gz LSEZPJAVAWCDDV-AWEZNQCLSA-N 1 2 315.421 2.346 20 10 DECDLO CCN(C)c1ccc(C[N@H+]2CCC[C@H](c3n[nH]c(=O)[nH]3)C2)cc1 ZINC000815120004 646973334 /nfs/dbraw/zinc/97/33/34/646973334.db2.gz LSEZPJAVAWCDDV-AWEZNQCLSA-N 1 2 315.421 2.346 20 10 DECDLO COC(=O)c1conc1C(C)(C)[NH2+]Cc1cc(OC)ccc1O ZINC000822534328 648227633 /nfs/dbraw/zinc/22/76/33/648227633.db2.gz CUHCWXITNISWQL-UHFFFAOYSA-N 1 2 320.345 2.200 20 10 DECDLO OCCN1CCCC[C@H]1C[NH2+]Cc1cc(Cl)cc(F)c1O ZINC000824583100 648616688 /nfs/dbraw/zinc/61/66/88/648616688.db2.gz HWYQIJJHCQPXAM-ZDUSSCGKSA-N 1 2 316.804 2.121 20 10 DECDLO CN(C)C(=O)N[C@@H]1CCC[N@H+](Cc2cccc(Cl)c2O)C1 ZINC000825280059 648735810 /nfs/dbraw/zinc/73/58/10/648735810.db2.gz WXFFBCFRWRFMRU-GFCCVEGCSA-N 1 2 311.813 2.281 20 10 DECDLO CN(C)C(=O)N[C@@H]1CCC[N@@H+](Cc2cccc(Cl)c2O)C1 ZINC000825280059 648735814 /nfs/dbraw/zinc/73/58/14/648735814.db2.gz WXFFBCFRWRFMRU-GFCCVEGCSA-N 1 2 311.813 2.281 20 10 DECDLO CO[C@H](C[NH2+]Cc1cc(Cl)cc(F)c1O)[C@@H]1CCOC1 ZINC000826821660 648931660 /nfs/dbraw/zinc/93/16/60/648931660.db2.gz AXTOLIMKZSJPSC-NOZJJQNGSA-N 1 2 303.761 2.326 20 10 DECDLO COc1c(O)c(CN[C@H]2CC[N@@H+](C(C)(C)C)C2)ccc1[N+](=O)[O-] ZINC000826867774 648939334 /nfs/dbraw/zinc/93/93/34/648939334.db2.gz LHRYPMJVJGSSCY-LBPRGKRZSA-N 1 2 323.393 2.271 20 10 DECDLO COc1c(O)c(CN[C@H]2CC[N@H+](C(C)(C)C)C2)ccc1[N+](=O)[O-] ZINC000826867774 648939336 /nfs/dbraw/zinc/93/93/36/648939336.db2.gz LHRYPMJVJGSSCY-LBPRGKRZSA-N 1 2 323.393 2.271 20 10 DECDLO CO[C@]1(CO)CCC[N@H+](Cc2cc(Cl)cc(F)c2O)C1 ZINC000826952902 648951798 /nfs/dbraw/zinc/95/17/98/648951798.db2.gz WPOYFKXUKAEUDJ-CQSZACIVSA-N 1 2 303.761 2.158 20 10 DECDLO CO[C@]1(CO)CCC[N@@H+](Cc2cc(Cl)cc(F)c2O)C1 ZINC000826952902 648951799 /nfs/dbraw/zinc/95/17/99/648951799.db2.gz WPOYFKXUKAEUDJ-CQSZACIVSA-N 1 2 303.761 2.158 20 10 DECDLO C[C@@H](Cn1cc[nH+]c1)NC(=O)NCc1cc(Cl)ccc1O ZINC000844281698 651103210 /nfs/dbraw/zinc/10/32/10/651103210.db2.gz OZDKFXNPFJVOBY-JTQLQIEISA-N 1 2 308.769 2.130 20 10 DECDLO O=C(NCCCn1cc[nH+]c1)NCc1cc(Cl)ccc1O ZINC000844282434 651103679 /nfs/dbraw/zinc/10/36/79/651103679.db2.gz WNKOKTPPKDLFGA-UHFFFAOYSA-N 1 2 308.769 2.132 20 10 DECDLO Oc1cccc2c1[C@H]([NH2+]Cc1nc([C@H]3CCCO3)n[nH]1)CC2 ZINC000848557905 651470689 /nfs/dbraw/zinc/47/06/89/651470689.db2.gz NEXWBYBIMHZLHG-DGCLKSJQSA-N 1 2 300.362 2.139 20 10 DECDLO COc1ccc(O)c([C@H](C)[NH2+]Cc2nc([C@@H]3CCCO3)n[nH]2)c1 ZINC000848557354 651470739 /nfs/dbraw/zinc/47/07/39/651470739.db2.gz IMVWOMJRTMEZRN-HZMBPMFUSA-N 1 2 318.377 2.221 20 10 DECDLO CCc1cccc(C[N@H+](C)Cc2nc(CCOC)no2)c1O ZINC000848888235 651546997 /nfs/dbraw/zinc/54/69/97/651546997.db2.gz PKVRLKFCJZLSAB-UHFFFAOYSA-N 1 2 305.378 2.159 20 10 DECDLO CCc1cccc(C[N@@H+](C)Cc2nc(CCOC)no2)c1O ZINC000848888235 651547000 /nfs/dbraw/zinc/54/70/00/651547000.db2.gz PKVRLKFCJZLSAB-UHFFFAOYSA-N 1 2 305.378 2.159 20 10 DECDLO CC[NH+]1CCN(C(=O)[C@H](C)Sc2ncc(Cl)s2)CC1 ZINC000849998719 651798501 /nfs/dbraw/zinc/79/85/01/651798501.db2.gz RVOCLIPXAXVGEA-VIFPVBQESA-N 1 2 319.883 2.441 20 10 DECDLO COCc1n[nH]c(C[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3F)n1 ZINC000850514563 651942409 /nfs/dbraw/zinc/94/24/09/651942409.db2.gz NNYBTKSAAPAVNU-PSASIEDQSA-N 1 2 306.341 2.134 20 10 DECDLO CC(C)OC(=O)[C@@H](C)[N@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000093773066 684051793 /nfs/dbraw/zinc/05/17/93/684051793.db2.gz XAWBJNMUZHHNDP-OAHLLOKOSA-N 1 2 320.433 2.295 20 10 DECDLO CC(C)OC(=O)[C@@H](C)[N@@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000093773066 684051797 /nfs/dbraw/zinc/05/17/97/684051797.db2.gz XAWBJNMUZHHNDP-OAHLLOKOSA-N 1 2 320.433 2.295 20 10 DECDLO COc1ccc(N2CC[NH+](Cc3cnc(C)o3)CC2)cc1F ZINC000862252833 686267030 /nfs/dbraw/zinc/26/70/30/686267030.db2.gz XPOLIPOOSMTWLS-UHFFFAOYSA-N 1 2 305.353 2.453 20 10 DECDLO CNC(=O)OC[C@H]1CCCC[N@@H+]1Cc1cc(F)cc(F)c1O ZINC000894785233 692988457 /nfs/dbraw/zinc/98/84/57/692988457.db2.gz SJPCOCRURKXCMW-GFCCVEGCSA-N 1 2 314.332 2.381 20 10 DECDLO CNC(=O)OC[C@H]1CCCC[N@H+]1Cc1cc(F)cc(F)c1O ZINC000894785233 692988462 /nfs/dbraw/zinc/98/84/62/692988462.db2.gz SJPCOCRURKXCMW-GFCCVEGCSA-N 1 2 314.332 2.381 20 10 DECDLO C[C@@H](CCO)C[NH2+]Cc1cc(Br)cc(F)c1O ZINC000715778467 792511394 /nfs/dbraw/zinc/51/13/94/792511394.db2.gz MFEVIAYFKGVSQL-QMMMGPOBSA-N 1 2 306.175 2.402 20 10 DECDLO Nc1ccc(N(CCO)c2c[nH+]c(N)cc2C(F)(F)F)cc1 ZINC001175713076 794270404 /nfs/dbraw/zinc/27/04/04/794270404.db2.gz PBAJDVIUZBPZRZ-UHFFFAOYSA-N 1 2 312.295 2.395 20 10 DECDLO C[N@@H+]1Cc2ccccc2[C@@H]1CNC(=O)c1c(F)ccc(O)c1O ZINC001184152014 795997679 /nfs/dbraw/zinc/99/76/79/795997679.db2.gz CTLOCIRBGAXOKZ-ZDUSSCGKSA-N 1 2 316.332 2.153 20 10 DECDLO C[N@H+]1Cc2ccccc2[C@@H]1CNC(=O)c1c(F)ccc(O)c1O ZINC001184152014 795997683 /nfs/dbraw/zinc/99/76/83/795997683.db2.gz CTLOCIRBGAXOKZ-ZDUSSCGKSA-N 1 2 316.332 2.153 20 10 DECDLO CCn1cc2c(n1)C[N@@H+](Cc1c(O)cccc1F)C[C@H]2COC ZINC001137834915 796144063 /nfs/dbraw/zinc/14/40/63/796144063.db2.gz YIDYOUOZLMNBOQ-LBPRGKRZSA-N 1 2 319.380 2.494 20 10 DECDLO CCn1cc2c(n1)C[N@H+](Cc1c(O)cccc1F)C[C@H]2COC ZINC001137834915 796144067 /nfs/dbraw/zinc/14/40/67/796144067.db2.gz YIDYOUOZLMNBOQ-LBPRGKRZSA-N 1 2 319.380 2.494 20 10 DECDLO CCOC[C@@H]1C[N@H+](Cc2c(O)cccc2F)Cc2ncn(C)c21 ZINC001137834286 796144527 /nfs/dbraw/zinc/14/45/27/796144527.db2.gz AUSWYDLLTYYBBO-LBPRGKRZSA-N 1 2 319.380 2.401 20 10 DECDLO CCOC[C@@H]1C[N@@H+](Cc2c(O)cccc2F)Cc2ncn(C)c21 ZINC001137834286 796144531 /nfs/dbraw/zinc/14/45/31/796144531.db2.gz AUSWYDLLTYYBBO-LBPRGKRZSA-N 1 2 319.380 2.401 20 10 DECDLO CC[C@H]1COCC[N@@H+]1Cc1c(O)ccc2c(C)cc(=O)oc21 ZINC001139132100 796330355 /nfs/dbraw/zinc/33/03/55/796330355.db2.gz TVXOFRQXDIPLDB-LBPRGKRZSA-N 1 2 303.358 2.418 20 10 DECDLO CC[C@H]1COCC[N@H+]1Cc1c(O)ccc2c(C)cc(=O)oc21 ZINC001139132100 796330360 /nfs/dbraw/zinc/33/03/60/796330360.db2.gz TVXOFRQXDIPLDB-LBPRGKRZSA-N 1 2 303.358 2.418 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CCOC2(CC2)C1 ZINC001139133739 796331855 /nfs/dbraw/zinc/33/18/55/796331855.db2.gz NZPWGNOEKADXOM-UHFFFAOYSA-N 1 2 301.342 2.172 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CCOC2(CC2)C1 ZINC001139133739 796331860 /nfs/dbraw/zinc/33/18/60/796331860.db2.gz NZPWGNOEKADXOM-UHFFFAOYSA-N 1 2 301.342 2.172 20 10 DECDLO C[NH+]1CC2(C1)CCN(Cc1c(O)cccc1Br)C2 ZINC001140103520 796476931 /nfs/dbraw/zinc/47/69/31/796476931.db2.gz NAZWSTXBXCIEIN-UHFFFAOYSA-N 1 2 311.223 2.292 20 10 DECDLO Fc1cc(N2CCOCC2)ccc1C[N@H+]1C[C@H]2CC[C@@H](C1)O2 ZINC001140660278 796551896 /nfs/dbraw/zinc/55/18/96/796551896.db2.gz MRTOALVRGBUCPL-IYBDPMFKSA-N 1 2 306.381 2.026 20 10 DECDLO Fc1cc(N2CCOCC2)ccc1C[N@@H+]1C[C@H]2CC[C@@H](C1)O2 ZINC001140660278 796551899 /nfs/dbraw/zinc/55/18/99/796551899.db2.gz MRTOALVRGBUCPL-IYBDPMFKSA-N 1 2 306.381 2.026 20 10 DECDLO C[C@@H]1C[N@H+](Cc2ccc(N3CCOCC3)cc2F)[C@H](C)CO1 ZINC001140664555 796553239 /nfs/dbraw/zinc/55/32/39/796553239.db2.gz LDKSPCZCVAUSSN-ZIAGYGMSSA-N 1 2 308.397 2.272 20 10 DECDLO C[C@@H]1C[N@@H+](Cc2ccc(N3CCOCC3)cc2F)[C@H](C)CO1 ZINC001140664555 796553241 /nfs/dbraw/zinc/55/32/41/796553241.db2.gz LDKSPCZCVAUSSN-ZIAGYGMSSA-N 1 2 308.397 2.272 20 10 DECDLO Oc1c(Cl)cccc1C[N@@H+]1CC[C@@H](Oc2cnccn2)C1 ZINC001231912974 801749664 /nfs/dbraw/zinc/74/96/64/801749664.db2.gz BKGOQHDASCDNEU-GFCCVEGCSA-N 1 2 305.765 2.489 20 10 DECDLO Oc1c(Cl)cccc1C[N@H+]1CC[C@@H](Oc2cnccn2)C1 ZINC001231912974 801749666 /nfs/dbraw/zinc/74/96/66/801749666.db2.gz BKGOQHDASCDNEU-GFCCVEGCSA-N 1 2 305.765 2.489 20 10 DECDLO Oc1cc(Br)cc(F)c1C[NH+]1CC(C2COC2)C1 ZINC001233027656 802007319 /nfs/dbraw/zinc/00/73/19/802007319.db2.gz WFICRFCDXHVDGD-UHFFFAOYSA-N 1 2 316.170 2.372 20 10 DECDLO CN1C[C@]2(CC1=O)CCCC[N@@H+]2Cc1c(O)ccc(F)c1F ZINC001233333299 802079037 /nfs/dbraw/zinc/07/90/37/802079037.db2.gz QTWBRJBXYKEFDU-MRXNPFEDSA-N 1 2 310.344 2.257 20 10 DECDLO CN1C[C@]2(CC1=O)CCCC[N@H+]2Cc1c(O)ccc(F)c1F ZINC001233333299 802079046 /nfs/dbraw/zinc/07/90/46/802079046.db2.gz QTWBRJBXYKEFDU-MRXNPFEDSA-N 1 2 310.344 2.257 20 10 DECDLO CN1CCC[N@@H+](Cc2cccc(C(F)(F)F)c2O)CC1=O ZINC001233418457 802111377 /nfs/dbraw/zinc/11/13/77/802111377.db2.gz HSLZJGDWGRUDHR-UHFFFAOYSA-N 1 2 302.296 2.075 20 10 DECDLO C[NH+](C)Cc1cc(C(=O)NCc2cccc(Cl)c2O)no1 ZINC001334059800 1150182462 /nfs/dbraw/zinc/18/24/62/1150182462.db2.gz LQMJKPPTUJRHFY-UHFFFAOYSA-N 1 2 309.753 2.025 20 10 DECDLO C[C@H]([NH2+]CC[C@@H]1CCSC1)c1cccc(-c2nn[nH]n2)c1O ZINC001603661908 1070032251 /nfs/dbraw/zinc/03/22/51/1070032251.db2.gz DDNMAHXYXQSYKT-WDEREUQCSA-N 1 2 319.434 2.366 20 10 DECDLO CC(C)c1[nH]cc(CNC(=O)C=Cc2ccc(O)c(O)c2)[nH+]1 ZINC001639428231 1078612364 /nfs/dbraw/zinc/61/23/64/1078612364.db2.gz YINZWVUKDHMJII-XQRVVYSFSA-N 1 2 301.346 2.274 20 10 DECDLO CC(C)c1[nH]c(CNC(=O)C=Cc2ccc(O)c(O)c2)c[nH+]1 ZINC001639428231 1078612366 /nfs/dbraw/zinc/61/23/66/1078612366.db2.gz YINZWVUKDHMJII-XQRVVYSFSA-N 1 2 301.346 2.274 20 10 DECDLO CCN(Cc1ccc(N(C)C)cc1)C(=O)CCc1[nH+]ccn1C ZINC001520838443 1069183010 /nfs/dbraw/zinc/18/30/10/1069183010.db2.gz MRSGHBYLEKVNNA-UHFFFAOYSA-N 1 2 314.433 2.467 20 10 DECDLO CC[C@H]([NH2+]C[C@](C)(O)C(C)C)c1cccc(-c2nn[nH]n2)c1O ZINC001590464000 1076632317 /nfs/dbraw/zinc/63/23/17/1076632317.db2.gz NYPGMUQASWYINE-BBRMVZONSA-N 1 2 319.409 2.020 20 10 DECDLO CC[C@@H]([NH2+]C[C@]1(C)CCCO1)c1cccc(-c2nn[nH]n2)c1O ZINC001590465125 1076633544 /nfs/dbraw/zinc/63/35/44/1076633544.db2.gz SPEMQAWVEZLJSQ-CJNGLKHVSA-N 1 2 317.393 2.182 20 10 DECDLO CC[C@@H]([NH2+][C@H]1C[C@@H](COC)C1)c1cccc(-c2nn[nH]n2)c1O ZINC001590471563 1076636506 /nfs/dbraw/zinc/63/65/06/1076636506.db2.gz IZLXNZFJGKQASK-UHIISALHSA-N 1 2 317.393 2.038 20 10 DECDLO COC1(C[NH2+][C@H](C)c2cccc(-c3nn[nH]n3)c2O)CCCC1 ZINC001591342116 1076728869 /nfs/dbraw/zinc/72/88/69/1076728869.db2.gz IIAMCUCODPMYLI-LLVKDONJSA-N 1 2 317.393 2.182 20 10 DECDLO O=C(NCc1cccc(O)c1O)c1ccc(Cn2cc[nH+]c2)cc1 ZINC001651173190 1079793190 /nfs/dbraw/zinc/79/31/90/1079793190.db2.gz SSYCBLSFSBPZJN-UHFFFAOYSA-N 1 2 323.352 2.273 20 10 DECDLO CS(=O)(=O)[C@@H]1CCCC[N@H+](Cc2cc(F)c(F)cc2O)C1 ZINC001664491815 1080916795 /nfs/dbraw/zinc/91/67/95/1080916795.db2.gz DANRGLWCYNYAHJ-LLVKDONJSA-N 1 2 319.373 2.070 20 10 DECDLO CS(=O)(=O)[C@@H]1CCCC[N@@H+](Cc2cc(F)c(F)cc2O)C1 ZINC001664491815 1080916799 /nfs/dbraw/zinc/91/67/99/1080916799.db2.gz DANRGLWCYNYAHJ-LLVKDONJSA-N 1 2 319.373 2.070 20 10 DECDLO COC(C[N@H+](C)Cc1cc(F)cc(Br)c1O)OC ZINC001235304552 1084381187 /nfs/dbraw/zinc/38/11/87/1084381187.db2.gz ZGBMBINPPSIFAH-UHFFFAOYSA-N 1 2 322.174 2.345 20 10 DECDLO COC(C[N@@H+](C)Cc1cc(F)cc(Br)c1O)OC ZINC001235304552 1084381198 /nfs/dbraw/zinc/38/11/98/1084381198.db2.gz ZGBMBINPPSIFAH-UHFFFAOYSA-N 1 2 322.174 2.345 20 10 DECDLO CC(C)NC(=O)N1CCC12C[NH+](Cc1c(O)cccc1Cl)C2 ZINC001275216723 1091618915 /nfs/dbraw/zinc/61/89/15/1091618915.db2.gz BTAGECGRGGNOLH-UHFFFAOYSA-N 1 2 323.824 2.424 20 10 DECDLO COC(=O)C1CC[NH+](Cc2ccc(OC)c(Cl)c2O)CC1 ZINC001236801617 1138431928 /nfs/dbraw/zinc/43/19/28/1138431928.db2.gz KPJAKPDMEACOAF-UHFFFAOYSA-N 1 2 313.781 2.439 20 10 DECDLO COc1cc(O)c(C[N@@H+]2CCO[C@@]3(CCOC3)C2)c(Cl)c1 ZINC001236797530 1138431966 /nfs/dbraw/zinc/43/19/66/1138431966.db2.gz FXXWMJAPXGRNLZ-HNNXBMFYSA-N 1 2 313.781 2.046 20 10 DECDLO COc1cc(O)c(C[N@H+]2CCO[C@@]3(CCOC3)C2)c(Cl)c1 ZINC001236797530 1138431976 /nfs/dbraw/zinc/43/19/76/1138431976.db2.gz FXXWMJAPXGRNLZ-HNNXBMFYSA-N 1 2 313.781 2.046 20 10 DECDLO COc1cc(O)c(C[NH+]2CCN(CCF)CC2)c(Cl)c1 ZINC001236803563 1138433664 /nfs/dbraw/zinc/43/36/64/1138433664.db2.gz OYMRZBCNLZARGH-UHFFFAOYSA-N 1 2 302.777 2.141 20 10 DECDLO C[N@H+]1CCC[C@@H](NC2CC[NH+](Cc3ccccc3O)CC2)C1 ZINC001255475700 1143652977 /nfs/dbraw/zinc/65/29/77/1143652977.db2.gz TYKFVLSZUAADBX-QGZVFWFLSA-N 1 2 303.450 2.040 20 10 DECDLO CN(C)c1ccc(C[N@@H+]2CCOC[C@@H]2[C@H]2CCCO2)cc1F ZINC000377701406 529780411 /nfs/dbraw/zinc/78/04/11/529780411.db2.gz PAVKBOIRVYFCTB-IAGOWNOFSA-N 1 2 308.397 2.272 20 10 DECDLO CN(C)c1ccc(C[N@H+]2CCOC[C@@H]2[C@H]2CCCO2)cc1F ZINC000377701406 529780412 /nfs/dbraw/zinc/78/04/12/529780412.db2.gz PAVKBOIRVYFCTB-IAGOWNOFSA-N 1 2 308.397 2.272 20 10 DECDLO C[C@@H]1CN(C(=O)C=Cc2c[nH]c[nH+]2)c2ccccc2N(C)C1=O ZINC000492900960 249168272 /nfs/dbraw/zinc/16/82/72/249168272.db2.gz OFZONXSTWCBQCZ-QDZRJHCZSA-N 1 2 310.357 2.069 20 10 DECDLO C[C@@H]1C[N@H+](Cc2cc(Cl)c(F)cc2O)CC[S@](=O)C1 ZINC000294799621 224229932 /nfs/dbraw/zinc/22/99/32/224229932.db2.gz VVSINTNZVWENJS-HOGDKLEQSA-N 1 2 305.802 2.385 20 10 DECDLO C[C@@H]1C[N@@H+](Cc2cc(Cl)c(F)cc2O)CC[S@](=O)C1 ZINC000294799621 224229934 /nfs/dbraw/zinc/22/99/34/224229934.db2.gz VVSINTNZVWENJS-HOGDKLEQSA-N 1 2 305.802 2.385 20 10 DECDLO CCOCc1cc(C[NH2+][C@@H](C)c2ncn(C)n2)ccc1OC ZINC000275768994 130382701 /nfs/dbraw/zinc/38/27/01/130382701.db2.gz GUJQZVZARFIXKS-LBPRGKRZSA-N 1 2 304.394 2.211 20 10 DECDLO COc1ccc(C[NH2+]Cc2cc([N+](=O)[O-])ccc2O)c(OC)n1 ZINC000289503384 131391654 /nfs/dbraw/zinc/39/16/54/131391654.db2.gz HIFKWVJAXWJRTD-UHFFFAOYSA-N 1 2 319.317 2.002 20 10 DECDLO C[C@@H]([NH2+]Cc1ncn(C)n1)c1ccc(Br)cc1O ZINC000186214708 402411292 /nfs/dbraw/zinc/41/12/92/402411292.db2.gz XLTXQUBYQCHBFQ-MRVPVSSYSA-N 1 2 311.183 2.134 20 10 DECDLO CC[C@H](C)[C@H]([NH2+]Cc1cc(F)cc(C(C)=O)c1O)C(=O)OC ZINC000183685922 402788842 /nfs/dbraw/zinc/78/88/42/402788842.db2.gz KGUIWDSRPKKEMC-XPTSAGLGSA-N 1 2 311.353 2.411 20 10 DECDLO COc1c(O)c(CN[C@H]2CC[N@@H+]3CCCC[C@H]23)ccc1[N+](=O)[O-] ZINC000278948910 402889279 /nfs/dbraw/zinc/88/92/79/402889279.db2.gz YZLBMJUNQBVQPO-QWHCGFSZSA-N 1 2 321.377 2.025 20 10 DECDLO COc1c(O)c(CN[C@H]2CC[N@H+]3CCCC[C@H]23)ccc1[N+](=O)[O-] ZINC000278948910 402889281 /nfs/dbraw/zinc/88/92/81/402889281.db2.gz YZLBMJUNQBVQPO-QWHCGFSZSA-N 1 2 321.377 2.025 20 10 DECDLO COc1c(O)c(C[NH2+][C@H]2CCN3CCCC[C@H]23)ccc1[N+](=O)[O-] ZINC000278948910 402889284 /nfs/dbraw/zinc/88/92/84/402889284.db2.gz YZLBMJUNQBVQPO-QWHCGFSZSA-N 1 2 321.377 2.025 20 10 DECDLO COc1c(O)c(C[N@H+]2C[C@@H](C3CC3)O[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000280492808 403005560 /nfs/dbraw/zinc/00/55/60/403005560.db2.gz FLQSGZOLOAIEJC-HZMBPMFUSA-N 1 2 322.361 2.308 20 10 DECDLO COc1c(O)c(C[N@@H+]2C[C@@H](C3CC3)O[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000280492808 403005561 /nfs/dbraw/zinc/00/55/61/403005561.db2.gz FLQSGZOLOAIEJC-HZMBPMFUSA-N 1 2 322.361 2.308 20 10 DECDLO COc1cc(O)c(C[NH+]2CC(O)(c3ccccc3)C2)cc1OC ZINC000365614843 404699966 /nfs/dbraw/zinc/69/99/66/404699966.db2.gz VNMZUIQISGLELZ-UHFFFAOYSA-N 1 2 315.369 2.113 20 10 DECDLO COc1cc(O)c(C[N@@H+]2CCC[C@@H]2c2ncon2)cc1OC ZINC000360777671 404837728 /nfs/dbraw/zinc/83/77/28/404837728.db2.gz NRVOWJIQNWFPBG-LLVKDONJSA-N 1 2 305.334 2.130 20 10 DECDLO COc1cc(O)c(C[N@H+]2CCC[C@@H]2c2ncon2)cc1OC ZINC000360777671 404837729 /nfs/dbraw/zinc/83/77/29/404837729.db2.gz NRVOWJIQNWFPBG-LLVKDONJSA-N 1 2 305.334 2.130 20 10 DECDLO CCOC[C@@H]1C[N@H+](Cc2cc(Cl)cc(F)c2O)CCO1 ZINC000529667163 405763605 /nfs/dbraw/zinc/76/36/05/405763605.db2.gz RQAMKMMGQIMUHQ-LBPRGKRZSA-N 1 2 303.761 2.422 20 10 DECDLO CCOC[C@@H]1C[N@@H+](Cc2cc(Cl)cc(F)c2O)CCO1 ZINC000529667163 405763610 /nfs/dbraw/zinc/76/36/10/405763610.db2.gz RQAMKMMGQIMUHQ-LBPRGKRZSA-N 1 2 303.761 2.422 20 10 DECDLO Cc1n[nH]c(C)c1[C@H]1COCC[N@@H+]1Cc1cc(F)ccc1O ZINC000368461737 227011395 /nfs/dbraw/zinc/01/13/95/227011395.db2.gz LAYASYMRFDELRE-CQSZACIVSA-N 1 2 305.353 2.445 20 10 DECDLO Cc1n[nH]c(C)c1[C@H]1COCC[N@H+]1Cc1cc(F)ccc1O ZINC000368461737 227011401 /nfs/dbraw/zinc/01/14/01/227011401.db2.gz LAYASYMRFDELRE-CQSZACIVSA-N 1 2 305.353 2.445 20 10 DECDLO Oc1ccc(Cl)c(F)c1CNC[C@@H]1C[N@@H+]2CCC[C@H]2CO1 ZINC000377394611 227189239 /nfs/dbraw/zinc/18/92/39/227189239.db2.gz YDGLKRLAEBMTOG-WDEREUQCSA-N 1 2 314.788 2.138 20 10 DECDLO Oc1ccc(Cl)c(F)c1CNC[C@@H]1C[N@H+]2CCC[C@H]2CO1 ZINC000377394611 227189244 /nfs/dbraw/zinc/18/92/44/227189244.db2.gz YDGLKRLAEBMTOG-WDEREUQCSA-N 1 2 314.788 2.138 20 10 DECDLO CO[C@@H]1COCC[C@H]1C[NH2+][C@H](C)c1cc(F)cc(F)c1O ZINC000834881004 649857236 /nfs/dbraw/zinc/85/72/36/649857236.db2.gz XVUXIUHDTOINOK-ISTVAULSSA-N 1 2 301.333 2.373 20 10 DECDLO Cc1c2ccccc2n(C)c1CNc1ncnc2c1C[N@H+](C)CC2 ZINC000359851305 424834416 /nfs/dbraw/zinc/83/44/16/424834416.db2.gz XCAGXDJDADYHOF-UHFFFAOYSA-N 1 2 321.428 2.877 20 10 DECDLO Cc1c2ccccc2n(C)c1CNc1ncnc2c1C[N@@H+](C)CC2 ZINC000359851305 424834418 /nfs/dbraw/zinc/83/44/18/424834418.db2.gz XCAGXDJDADYHOF-UHFFFAOYSA-N 1 2 321.428 2.877 20 10 DECDLO CC(=O)Nc1cccc2c1CCCN2C(=O)C=Cc1c[nH]c[nH+]1 ZINC000492899366 277087835 /nfs/dbraw/zinc/08/78/35/277087835.db2.gz MAQOXUDTOSJWSF-BQYQJAHWSA-N 1 2 310.357 2.361 20 10 DECDLO NC(=O)[C@@H]1[C@@H]2CCC[C@H]2C[N@@H+]1Cc1c(O)ccc(Cl)c1F ZINC000364586608 303319945 /nfs/dbraw/zinc/31/99/45/303319945.db2.gz ZJRIHFOEHJTRCV-QIBSRJKCSA-N 1 2 312.772 2.271 20 10 DECDLO NC(=O)[C@@H]1[C@@H]2CCC[C@H]2C[N@H+]1Cc1c(O)ccc(Cl)c1F ZINC000364586608 303319946 /nfs/dbraw/zinc/31/99/46/303319946.db2.gz ZJRIHFOEHJTRCV-QIBSRJKCSA-N 1 2 312.772 2.271 20 10 DECDLO CN(C)c1ccc(C[NH2+][C@H]2CS(=O)(=O)c3ccccc32)cc1 ZINC000267944233 522211189 /nfs/dbraw/zinc/21/11/89/522211189.db2.gz RCALBALBDRSNES-INIZCTEOSA-N 1 2 316.426 2.371 20 10 DECDLO COc1cc(Cl)cc(C[N@@H+]2CCC[C@]23CCOC3=O)c1O ZINC000190035545 522536407 /nfs/dbraw/zinc/53/64/07/522536407.db2.gz IANGDSGFQRSTTP-OAHLLOKOSA-N 1 2 311.765 2.336 20 10 DECDLO COc1cc(Cl)cc(C[N@H+]2CCC[C@]23CCOC3=O)c1O ZINC000190035545 522536415 /nfs/dbraw/zinc/53/64/15/522536415.db2.gz IANGDSGFQRSTTP-OAHLLOKOSA-N 1 2 311.765 2.336 20 10 DECDLO CCc1nsc(N2CC[NH+](Cc3cc(F)ccc3O)CC2)n1 ZINC000180196003 522965581 /nfs/dbraw/zinc/96/55/81/522965581.db2.gz MMLGPIOQRNLKQD-UHFFFAOYSA-N 1 2 322.409 2.267 20 10 DECDLO CCN(CC)c1ccc(C[N@@H+]2CCN3C(=O)OC[C@@H]3C2)cc1F ZINC000378344994 528298393 /nfs/dbraw/zinc/29/83/93/528298393.db2.gz FXWUAZRFBBPVAL-AWEZNQCLSA-N 1 2 321.396 2.308 20 10 DECDLO CCN(CC)c1ccc(C[N@H+]2CCN3C(=O)OC[C@@H]3C2)cc1F ZINC000378344994 528298398 /nfs/dbraw/zinc/29/83/98/528298398.db2.gz FXWUAZRFBBPVAL-AWEZNQCLSA-N 1 2 321.396 2.308 20 10 DECDLO CCOC(=O)CCC[N@H+](C)c1ccc(OCC(=O)OC)cc1 ZINC000273084757 535632187 /nfs/dbraw/zinc/63/21/87/535632187.db2.gz LTVNQAWRTADSAU-UHFFFAOYSA-N 1 2 309.362 2.018 20 10 DECDLO CCOC(=O)CCC[N@@H+](C)c1ccc(OCC(=O)OC)cc1 ZINC000273084757 535632192 /nfs/dbraw/zinc/63/21/92/535632192.db2.gz LTVNQAWRTADSAU-UHFFFAOYSA-N 1 2 309.362 2.018 20 10 DECDLO CN1CCCN(C(=O)C=Cc2c[nH]c[nH+]2)c2ccc(F)cc21 ZINC000492890870 536359408 /nfs/dbraw/zinc/35/94/08/536359408.db2.gz CDUNQXYUJMUTSL-GQCTYLIASA-N 1 2 300.337 2.435 20 10 DECDLO CN(C)c1ccc(/C=C\C[N@@H+]2CCC[C@@H](S(C)(=O)=O)C2)cc1 ZINC000835048057 649871301 /nfs/dbraw/zinc/87/13/01/649871301.db2.gz YZCRRQSHAJDIQZ-XQDHMALISA-N 1 2 322.474 2.275 20 10 DECDLO CN(C)c1ccc(/C=C\C[N@H+]2CCC[C@@H](S(C)(=O)=O)C2)cc1 ZINC000835048057 649871304 /nfs/dbraw/zinc/87/13/04/649871304.db2.gz YZCRRQSHAJDIQZ-XQDHMALISA-N 1 2 322.474 2.275 20 10 DECDLO Oc1ccccc1CNc1c(-c2nn[nH]n2)c[nH+]c2ccccc21 ZINC000826511151 608377045 /nfs/dbraw/zinc/37/70/45/608377045.db2.gz DTXPQZDYGJIZTP-UHFFFAOYSA-N 1 2 318.340 2.155 20 10 DECDLO COc1ccc(C[N@H+](C)[C@H](C)C(=O)OC(C)C)c(O)c1OC ZINC000892148781 624796793 /nfs/dbraw/zinc/79/67/93/624796793.db2.gz MYUAQGJJXRJDHV-LLVKDONJSA-N 1 2 311.378 2.181 20 10 DECDLO COc1ccc(C[N@@H+](C)[C@H](C)C(=O)OC(C)C)c(O)c1OC ZINC000892148781 624796794 /nfs/dbraw/zinc/79/67/94/624796794.db2.gz MYUAQGJJXRJDHV-LLVKDONJSA-N 1 2 311.378 2.181 20 10 DECDLO CCN(CC)c1ccc(C[N@@H+]2CCO[C@H]([C@H](C)O)C2)cc1F ZINC000840976571 636005366 /nfs/dbraw/zinc/00/53/66/636005366.db2.gz DQCORGICZKLBTJ-GUYCJALGSA-N 1 2 310.413 2.254 20 10 DECDLO CCN(CC)c1ccc(C[N@H+]2CCO[C@H]([C@H](C)O)C2)cc1F ZINC000840976571 636005367 /nfs/dbraw/zinc/00/53/67/636005367.db2.gz DQCORGICZKLBTJ-GUYCJALGSA-N 1 2 310.413 2.254 20 10 DECDLO Cc1ccc(NC(=O)NCCc2ccc(N)cc2)c(N(C)C)[nH+]1 ZINC000841154950 636451294 /nfs/dbraw/zinc/45/12/94/636451294.db2.gz OEMGLFRXUFBFHN-UHFFFAOYSA-N 1 2 313.405 2.402 20 10 DECDLO C[C@H]1CC[N@H+](Cc2cc(Br)cc(F)c2O)[C@H]1CO ZINC000894533465 637093602 /nfs/dbraw/zinc/09/36/02/637093602.db2.gz MSLILADODOAQFB-UFBFGSQYSA-N 1 2 318.186 2.497 20 10 DECDLO C[C@H]1CC[N@@H+](Cc2cc(Br)cc(F)c2O)[C@H]1CO ZINC000894533465 637093605 /nfs/dbraw/zinc/09/36/05/637093605.db2.gz MSLILADODOAQFB-UFBFGSQYSA-N 1 2 318.186 2.497 20 10 DECDLO C[C@H]1C[C@H](O)C[N@@H+]1Cc1cc(Br)cc(F)c1O ZINC000894538810 637096677 /nfs/dbraw/zinc/09/66/77/637096677.db2.gz MEWLEZCNOLATPX-XVKPBYJWSA-N 1 2 304.159 2.249 20 10 DECDLO C[C@H]1C[C@H](O)C[N@H+]1Cc1cc(Br)cc(F)c1O ZINC000894538810 637096680 /nfs/dbraw/zinc/09/66/80/637096680.db2.gz MEWLEZCNOLATPX-XVKPBYJWSA-N 1 2 304.159 2.249 20 10 DECDLO C[C@@H]([NH2+][C@@H](C)CN1CCOCC1)c1cc(F)cc(F)c1O ZINC000756413000 639659849 /nfs/dbraw/zinc/65/98/49/639659849.db2.gz BDDRRRPBXPAOGA-WDEREUQCSA-N 1 2 300.349 2.042 20 10 DECDLO C[C@@H]([NH2+]CCN1CCSCC1)c1cc(F)cc(F)c1O ZINC000756576721 639677427 /nfs/dbraw/zinc/67/74/27/639677427.db2.gz OCPADLNDLHSCOY-SNVBAGLBSA-N 1 2 302.390 2.370 20 10 DECDLO C[C@@H]([NH2+][C@@H](C)CC(N)=O)c1cc(Br)c(F)cc1O ZINC000756661200 639683460 /nfs/dbraw/zinc/68/34/60/639683460.db2.gz PUQOCRMYQQCBBI-NKWVEPMBSA-N 1 2 319.174 2.208 20 10 DECDLO C[C@H](CC(N)=O)[NH2+][C@@H](C)c1cc(Br)c(F)cc1O ZINC000756661202 639683666 /nfs/dbraw/zinc/68/36/66/639683666.db2.gz PUQOCRMYQQCBBI-RQJHMYQMSA-N 1 2 319.174 2.208 20 10 DECDLO O=C(NCCc1ccc(O)c(O)c1)Nc1ccc2[nH+]ccn2c1 ZINC000761645558 640333130 /nfs/dbraw/zinc/33/31/30/640333130.db2.gz HOBYMBBFJAOIER-UHFFFAOYSA-N 1 2 312.329 2.110 20 10 DECDLO Cc1nc(N(C)C)nc(NCc2ccc3c(c2)CCCN3C)[nH+]1 ZINC000768527289 641092062 /nfs/dbraw/zinc/09/20/62/641092062.db2.gz WJBHNCHTKNYKHJ-UHFFFAOYSA-N 1 2 312.421 2.241 20 10 DECDLO Cc1nc(N(C)C)nc(N[C@@H](C)c2ccc(N(C)C)cc2)[nH+]1 ZINC000772300830 641622373 /nfs/dbraw/zinc/62/23/73/641622373.db2.gz OTGLRLLKYWXPOV-NSHDSACASA-N 1 2 300.410 2.485 20 10 DECDLO C[C@@H]1CC[C@@H](C(N)=O)C[N@@H+]1Cc1cc(Cl)cc(F)c1O ZINC000775648844 642071874 /nfs/dbraw/zinc/07/18/74/642071874.db2.gz GNLGQARIJKLXKB-RKDXNWHRSA-N 1 2 300.761 2.271 20 10 DECDLO C[C@@H]1CC[C@@H](C(N)=O)C[N@H+]1Cc1cc(Cl)cc(F)c1O ZINC000775648844 642071877 /nfs/dbraw/zinc/07/18/77/642071877.db2.gz GNLGQARIJKLXKB-RKDXNWHRSA-N 1 2 300.761 2.271 20 10 DECDLO Oc1c(F)cc(Cl)cc1C[N@@H+]1CC[C@H](N2CCOCC2)C1 ZINC000775657881 642074530 /nfs/dbraw/zinc/07/45/30/642074530.db2.gz BARLIJFMHWZZBC-ZDUSSCGKSA-N 1 2 314.788 2.091 20 10 DECDLO Oc1c(F)cc(Cl)cc1C[N@H+]1CC[C@H](N2CCOCC2)C1 ZINC000775657881 642074536 /nfs/dbraw/zinc/07/45/36/642074536.db2.gz BARLIJFMHWZZBC-ZDUSSCGKSA-N 1 2 314.788 2.091 20 10 DECDLO NC(=O)C[C@H]1CCCC[N@@H+]1Cc1cc(Cl)cc(F)c1O ZINC000775663885 642075107 /nfs/dbraw/zinc/07/51/07/642075107.db2.gz HAGUVNTUHZZLGB-LLVKDONJSA-N 1 2 300.761 2.415 20 10 DECDLO NC(=O)C[C@H]1CCCC[N@H+]1Cc1cc(Cl)cc(F)c1O ZINC000775663885 642075111 /nfs/dbraw/zinc/07/51/11/642075111.db2.gz HAGUVNTUHZZLGB-LLVKDONJSA-N 1 2 300.761 2.415 20 10 DECDLO NC(=O)C[C@@H]1CCC[N@H+](Cc2cc(Cl)cc(F)c2O)C1 ZINC000775727213 642085581 /nfs/dbraw/zinc/08/55/81/642085581.db2.gz MKCRQIBAUPUQIG-VIFPVBQESA-N 1 2 300.761 2.272 20 10 DECDLO NC(=O)C[C@@H]1CCC[N@@H+](Cc2cc(Cl)cc(F)c2O)C1 ZINC000775727213 642085584 /nfs/dbraw/zinc/08/55/84/642085584.db2.gz MKCRQIBAUPUQIG-VIFPVBQESA-N 1 2 300.761 2.272 20 10 DECDLO C[C@H]([NH2+]Cc1csnn1)c1ccc(N2CCOCC2)cc1 ZINC000776102934 642131240 /nfs/dbraw/zinc/13/12/40/642131240.db2.gz NFZIFBZVDGSDIB-LBPRGKRZSA-N 1 2 304.419 2.226 20 10 DECDLO O=[N+]([O-])c1cc(Cl)cc(C[N@@H+]2CC[C@H]3[NH2+]CC[C@H]3C2)c1[O-] ZINC000843128901 650902406 /nfs/dbraw/zinc/90/24/06/650902406.db2.gz YUTUNZNSXGXSAA-JOYOIKCWSA-N 1 2 311.769 2.138 20 10 DECDLO O=[N+]([O-])c1cc(Cl)cc(C[N@H+]2CC[C@H]3[NH2+]CC[C@H]3C2)c1[O-] ZINC000843128901 650902411 /nfs/dbraw/zinc/90/24/11/650902411.db2.gz YUTUNZNSXGXSAA-JOYOIKCWSA-N 1 2 311.769 2.138 20 10 DECDLO Cc1cc(Br)c(O)c(C[N@@H+]2CC[C@](F)(CO)C2)c1 ZINC000802660202 645541485 /nfs/dbraw/zinc/54/14/85/645541485.db2.gz DVTJBQKMYKTOQL-CYBMUJFWSA-N 1 2 318.186 2.369 20 10 DECDLO Cc1cc(Br)c(O)c(C[N@H+]2CC[C@](F)(CO)C2)c1 ZINC000802660202 645541487 /nfs/dbraw/zinc/54/14/87/645541487.db2.gz DVTJBQKMYKTOQL-CYBMUJFWSA-N 1 2 318.186 2.369 20 10 DECDLO Cn1ncc2c1nc[nH+]c2NCc1ccc(N2CC=CC2)cc1 ZINC000172641798 646745858 /nfs/dbraw/zinc/74/58/58/646745858.db2.gz DBYIILZNBBTAFA-UHFFFAOYSA-N 1 2 306.373 2.352 20 10 DECDLO OC[C@@]1([C@H]([NH2+]Cc2cccc(Cl)c2O)C2CC2)CCCO1 ZINC000816667248 647165720 /nfs/dbraw/zinc/16/57/20/647165720.db2.gz HNRSUSLQNVPAMG-HZPDHXFCSA-N 1 2 311.809 2.455 20 10 DECDLO COC(=O)[C@H]1C[C@H]([NH2+]Cc2cccc(Br)c2O)C1 ZINC000827812090 649089377 /nfs/dbraw/zinc/08/93/77/649089377.db2.gz BZECPESIGWTVST-MGCOHNPYSA-N 1 2 314.179 2.196 20 10 DECDLO C[C@@H]([NH2+][C@@H]1CCc2c(nnn2C)C1)c1cc(F)cc(F)c1O ZINC000848564004 651471615 /nfs/dbraw/zinc/47/16/15/651471615.db2.gz GRPMTEDDPRZREP-PSASIEDQSA-N 1 2 308.332 2.007 20 10 DECDLO [NH2+]=C(NCc1cc(Cl)cc(Cl)c1O)NC[C@@H]1CCCO1 ZINC000849028758 651588078 /nfs/dbraw/zinc/58/80/78/651588078.db2.gz XGXRRJMZHJBDKX-JTQLQIEISA-N 1 2 318.204 2.492 20 10 DECDLO CCN(C)c1ccc([C@H](C)[NH2+]Cc2nc(COC)n[nH]2)cc1 ZINC000850512922 651942544 /nfs/dbraw/zinc/94/25/44/651942544.db2.gz BYHXPYLYYCFZPF-LBPRGKRZSA-N 1 2 303.410 2.258 20 10 DECDLO COc1cc(O)c(C[N@@H+]2CCO[C@](C)(C(F)F)C2)cc1OC ZINC000853634583 652581943 /nfs/dbraw/zinc/58/19/43/652581943.db2.gz MUBWNHHNDLAAMN-HNNXBMFYSA-N 1 2 317.332 2.265 20 10 DECDLO COc1cc(O)c(C[N@H+]2CCO[C@](C)(C(F)F)C2)cc1OC ZINC000853634583 652581944 /nfs/dbraw/zinc/58/19/44/652581944.db2.gz MUBWNHHNDLAAMN-HNNXBMFYSA-N 1 2 317.332 2.265 20 10 DECDLO CCN(CC)c1ccc(C[N@H+]2C[C@H](CO)O[C@@H](C)C2)cc1F ZINC000249436272 685179856 /nfs/dbraw/zinc/17/98/56/685179856.db2.gz SHCIHJPGXVOKKD-DZGCQCFKSA-N 1 2 310.413 2.254 20 10 DECDLO CCN(CC)c1ccc(C[N@@H+]2C[C@H](CO)O[C@@H](C)C2)cc1F ZINC000249436272 685179860 /nfs/dbraw/zinc/17/98/60/685179860.db2.gz SHCIHJPGXVOKKD-DZGCQCFKSA-N 1 2 310.413 2.254 20 10 DECDLO CN(C)c1cc(F)c(C[N@@H+]2CCC[C@@H]2C(=O)NC2CC2)cc1F ZINC000862223490 686258041 /nfs/dbraw/zinc/25/80/41/686258041.db2.gz QGNATOYBCBWNRD-OAHLLOKOSA-N 1 2 323.387 2.274 20 10 DECDLO CN(C)c1cc(F)c(C[N@H+]2CCC[C@@H]2C(=O)NC2CC2)cc1F ZINC000862223490 686258046 /nfs/dbraw/zinc/25/80/46/686258046.db2.gz QGNATOYBCBWNRD-OAHLLOKOSA-N 1 2 323.387 2.274 20 10 DECDLO CN(C)c1cc(F)c(C[N@@H+]2CCc3n[nH]c(=O)cc3C2)cc1F ZINC000862330951 686277261 /nfs/dbraw/zinc/27/72/61/686277261.db2.gz DREWCDKJPZPFJN-UHFFFAOYSA-N 1 2 320.343 2.085 20 10 DECDLO CN(C)c1cc(F)c(C[N@H+]2CCc3n[nH]c(=O)cc3C2)cc1F ZINC000862330951 686277265 /nfs/dbraw/zinc/27/72/65/686277265.db2.gz DREWCDKJPZPFJN-UHFFFAOYSA-N 1 2 320.343 2.085 20 10 DECDLO OC[C@@H]1C[C@H](F)C[N@@H+]1Cc1c(O)cccc1Br ZINC000862337557 686278868 /nfs/dbraw/zinc/27/88/68/686278868.db2.gz XAKLPRFAMADKPE-IUCAKERBSA-N 1 2 304.159 2.059 20 10 DECDLO OC[C@@H]1C[C@H](F)C[N@H+]1Cc1c(O)cccc1Br ZINC000862337557 686278870 /nfs/dbraw/zinc/27/88/70/686278870.db2.gz XAKLPRFAMADKPE-IUCAKERBSA-N 1 2 304.159 2.059 20 10 DECDLO CCOC(=O)C[N@H+](CCc1ccns1)Cc1ccccc1O ZINC000930764995 694236241 /nfs/dbraw/zinc/23/62/41/694236241.db2.gz WXPLAYUBVFHFPJ-UHFFFAOYSA-N 1 2 320.414 2.457 20 10 DECDLO CCOC(=O)C[N@@H+](CCc1ccns1)Cc1ccccc1O ZINC000930764995 694236245 /nfs/dbraw/zinc/23/62/45/694236245.db2.gz WXPLAYUBVFHFPJ-UHFFFAOYSA-N 1 2 320.414 2.457 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@@H+](C)[C@H]2CCCCN(C)C2=O)c1O ZINC000872263583 688967902 /nfs/dbraw/zinc/96/79/02/688967902.db2.gz RBXBEJPEUHCJFQ-HNNXBMFYSA-N 1 2 322.380 2.177 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@H+](C)[C@H]2CCCCN(C)C2=O)c1O ZINC000872263583 688967904 /nfs/dbraw/zinc/96/79/04/688967904.db2.gz RBXBEJPEUHCJFQ-HNNXBMFYSA-N 1 2 322.380 2.177 20 10 DECDLO Cn1cc(C[C@H]2CC[N@H+](Cc3ccc(F)c(F)c3O)C2)cn1 ZINC000876796808 689939414 /nfs/dbraw/zinc/93/94/14/689939414.db2.gz JHSMJLFWIQZETK-LLVKDONJSA-N 1 2 307.344 2.469 20 10 DECDLO Cn1cc(C[C@H]2CC[N@@H+](Cc3ccc(F)c(F)c3O)C2)cn1 ZINC000876796808 689939416 /nfs/dbraw/zinc/93/94/16/689939416.db2.gz JHSMJLFWIQZETK-LLVKDONJSA-N 1 2 307.344 2.469 20 10 DECDLO Cc1cnc(C[NH2+]Cc2ccc(N3CCC(O)CC3)cc2)o1 ZINC000877458329 690118735 /nfs/dbraw/zinc/11/87/35/690118735.db2.gz OXXYAEKSZHMIIG-UHFFFAOYSA-N 1 2 301.390 2.234 20 10 DECDLO C[C@@H]1OCC[C@@]12C[N@H+](Cc1ccc(F)c(F)c1O)C[C@@H](C)O2 ZINC000877485721 690128139 /nfs/dbraw/zinc/12/81/39/690128139.db2.gz DVZYWNPMBTVJCE-OHUAYANFSA-N 1 2 313.344 2.439 20 10 DECDLO C[C@@H]1OCC[C@@]12C[N@@H+](Cc1ccc(F)c(F)c1O)C[C@@H](C)O2 ZINC000877485721 690128144 /nfs/dbraw/zinc/12/81/44/690128144.db2.gz DVZYWNPMBTVJCE-OHUAYANFSA-N 1 2 313.344 2.439 20 10 DECDLO C[C@](CO)([NH2+]Cc1ccc(F)c(F)c1O)c1cccc(O)c1 ZINC000877648733 690178748 /nfs/dbraw/zinc/17/87/48/690178748.db2.gz SXSRUZTWSJTBRC-MRXNPFEDSA-N 1 2 309.312 2.373 20 10 DECDLO COCc1n[nH]c(C[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3C)n1 ZINC001333327660 1150034128 /nfs/dbraw/zinc/03/41/28/1150034128.db2.gz OKZYQZDLJOJYKU-MNOVXSKESA-N 1 2 302.378 2.303 20 10 DECDLO Oc1c(F)cc(Br)cc1C[NH2+]CCOCCF ZINC000715737528 792509523 /nfs/dbraw/zinc/50/95/23/792509523.db2.gz KQSRBJCIBCGXKY-UHFFFAOYSA-N 1 2 310.138 2.370 20 10 DECDLO FC(F)(F)c1n[nH]c(C[NH2+]Cc2ccc3c(c2)CCCO3)n1 ZINC001184452736 796067450 /nfs/dbraw/zinc/06/74/50/796067450.db2.gz SEVDYPMMSSHINY-UHFFFAOYSA-N 1 2 312.295 2.438 20 10 DECDLO CO[C@@H](C)C1C[NH+](Cc2c(O)ccc3c(C)cc(=O)oc32)C1 ZINC001139132915 796330318 /nfs/dbraw/zinc/33/03/18/796330318.db2.gz CMEMIAQONNKGOJ-NSHDSACASA-N 1 2 303.358 2.274 20 10 DECDLO COc1ccncc1C[N@@H+]1CCCc2cc(O)c(O)cc2C1 ZINC001139610962 796402474 /nfs/dbraw/zinc/40/24/74/796402474.db2.gz VAUZUMAJLJGAFH-UHFFFAOYSA-N 1 2 300.358 2.450 20 10 DECDLO COc1ccncc1C[N@H+]1CCCc2cc(O)c(O)cc2C1 ZINC001139610962 796402477 /nfs/dbraw/zinc/40/24/77/796402477.db2.gz VAUZUMAJLJGAFH-UHFFFAOYSA-N 1 2 300.358 2.450 20 10 DECDLO Oc1ccc(F)cc1C[NH+]1CCN(CCc2ccccn2)CC1 ZINC001140055560 796471541 /nfs/dbraw/zinc/47/15/41/796471541.db2.gz KXQLFNMZTBVZCO-UHFFFAOYSA-N 1 2 315.392 2.287 20 10 DECDLO Oc1ccc(F)cc1CN1CC[NH+](CCc2ccccn2)CC1 ZINC001140055560 796471543 /nfs/dbraw/zinc/47/15/43/796471543.db2.gz KXQLFNMZTBVZCO-UHFFFAOYSA-N 1 2 315.392 2.287 20 10 DECDLO CC(C)COC[C@H](O)C[NH2+]Cc1cc(Cl)cc(F)c1O ZINC001199722555 798526883 /nfs/dbraw/zinc/52/68/83/798526883.db2.gz SRRVAMNOAZCMKI-GFCCVEGCSA-N 1 2 305.777 2.308 20 10 DECDLO COC(=O)c1c(C[N@@H+]2CCCC23COC3)c2ccccc2n1C ZINC001232408304 801872046 /nfs/dbraw/zinc/87/20/46/801872046.db2.gz ZYNOEBWOQKOLCY-UHFFFAOYSA-N 1 2 314.385 2.330 20 10 DECDLO COC(=O)c1c(C[N@H+]2CCCC23COC3)c2ccccc2n1C ZINC001232408304 801872050 /nfs/dbraw/zinc/87/20/50/801872050.db2.gz ZYNOEBWOQKOLCY-UHFFFAOYSA-N 1 2 314.385 2.330 20 10 DECDLO CC(=O)N1CC[N@@H+](Cc2cccc(C(F)(F)F)c2O)C[C@H]1C ZINC001233419461 802113538 /nfs/dbraw/zinc/11/35/38/802113538.db2.gz YFNOSFWXIXKESD-SNVBAGLBSA-N 1 2 316.323 2.464 20 10 DECDLO CC(=O)N1CC[N@H+](Cc2cccc(C(F)(F)F)c2O)C[C@H]1C ZINC001233419461 802113541 /nfs/dbraw/zinc/11/35/41/802113541.db2.gz YFNOSFWXIXKESD-SNVBAGLBSA-N 1 2 316.323 2.464 20 10 DECDLO COCCOC1C[NH+](Cc2cccc(OC(F)(F)F)c2O)C1 ZINC001233776420 802207342 /nfs/dbraw/zinc/20/73/42/802207342.db2.gz RTFRPXZCGXGIEZ-UHFFFAOYSA-N 1 2 321.295 2.138 20 10 DECDLO Cc1cc(C(=O)N2CC[NH+](Cc3ccc(N)cc3)CC2)c(C)o1 ZINC001334754266 1150339706 /nfs/dbraw/zinc/33/97/06/1150339706.db2.gz NQKLQYFCGQMQIC-UHFFFAOYSA-N 1 2 313.401 2.437 20 10 DECDLO C[C@@H]([NH2+]C[C@@]1(C)CC1(F)F)c1cccc(-c2nn[nH]n2)c1O ZINC001603656696 1070023970 /nfs/dbraw/zinc/02/39/70/1070023970.db2.gz IAORIHZVNXKSNG-AMIZOPFISA-N 1 2 309.320 2.268 20 10 DECDLO C[NH+]1CCN(c2ccc(C[NH2+][C@H](C[NH3+])C(C)(C)C)cc2F)CC1 ZINC001328682464 1148824086 /nfs/dbraw/zinc/82/40/86/1148824086.db2.gz VAZFVHWVYGYJEO-QGZVFWFLSA-N 1 2 322.472 2.041 20 10 DECDLO O=[N+]([O-])c1ccc(O)c(CNc2c[nH+]ccc2-n2cccn2)c1 ZINC001474086250 1060812347 /nfs/dbraw/zinc/81/23/47/1060812347.db2.gz VNTKAZXTCZFTSF-UHFFFAOYSA-N 1 2 311.301 2.493 20 10 DECDLO Cc1ccc(C(=O)NCCCN(C)c2cccc[nH+]2)c(O)c1O ZINC001633060966 1078397149 /nfs/dbraw/zinc/39/71/49/1078397149.db2.gz VQCCMUVEJQQIQR-UHFFFAOYSA-N 1 2 315.373 2.058 20 10 DECDLO COCC1(CC[NH2+][C@@H](C)c2cccc(-c3nn[nH]n3)c2O)CC1 ZINC001591387835 1076738871 /nfs/dbraw/zinc/73/88/71/1076738871.db2.gz GDALWKVXIXGZMZ-NSHDSACASA-N 1 2 317.393 2.040 20 10 DECDLO Cc1ccc(C[NH2+][C@@H](C)c2cccc(-c3nn[nH]n3)c2O)cn1 ZINC001592165022 1076865413 /nfs/dbraw/zinc/86/54/13/1076865413.db2.gz DKQUYNQRXQADKU-NSHDSACASA-N 1 2 310.361 2.127 20 10 DECDLO NC(=O)[C@@H]([NH2+]Cc1cc(F)cc(F)c1O)c1ccc(F)cc1 ZINC001656056929 1080032232 /nfs/dbraw/zinc/03/22/32/1080032232.db2.gz UMEFNAXRGLESKF-ZDUSSCGKSA-N 1 2 310.275 2.126 20 10 DECDLO CC(C)N1C[C@@H]([NH2+]Cc2cc(Cl)cc(F)c2O)CC1=O ZINC001657264210 1080167449 /nfs/dbraw/zinc/16/74/49/1080167449.db2.gz PGEQZOKAHBSYQP-NSHDSACASA-N 1 2 300.761 2.284 20 10 DECDLO O=C1Nc2ccccc2C[C@H]1[NH2+]Cc1ccc(F)c(F)c1O ZINC001660463139 1080335730 /nfs/dbraw/zinc/33/57/30/1080335730.db2.gz SSCCMECJUDXVEK-CYBMUJFWSA-N 1 2 304.296 2.323 20 10 DECDLO CCOC(=O)N[C@H]1CCC[N@H+](Cc2cc(F)c(F)cc2O)C1 ZINC001663600985 1080784176 /nfs/dbraw/zinc/78/41/76/1080784176.db2.gz UWQQOXCOZBVGDY-NSHDSACASA-N 1 2 314.332 2.381 20 10 DECDLO CCOC(=O)N[C@H]1CCC[N@@H+](Cc2cc(F)c(F)cc2O)C1 ZINC001663600985 1080784182 /nfs/dbraw/zinc/78/41/82/1080784182.db2.gz UWQQOXCOZBVGDY-NSHDSACASA-N 1 2 314.332 2.381 20 10 DECDLO Nc1[nH+]cccc1CNC(=O)NCc1ccc(N2CC=CC2)cc1 ZINC001669425260 1081449915 /nfs/dbraw/zinc/44/99/15/1081449915.db2.gz IRJAHBYBLMPMNV-UHFFFAOYSA-N 1 2 323.400 2.039 20 10 DECDLO COc1ccc(N2C[C@@H]3OCC[N@H+](Cc4ccc[nH]4)[C@H]3C2)cc1 ZINC001276925199 1083682887 /nfs/dbraw/zinc/68/28/87/1083682887.db2.gz XKIVHDXMGVWVKZ-ROUUACIJSA-N 1 2 313.401 2.113 20 10 DECDLO COc1ccc(N2C[C@@H]3OCC[N@@H+](Cc4ccc[nH]4)[C@H]3C2)cc1 ZINC001276925199 1083682893 /nfs/dbraw/zinc/68/28/93/1083682893.db2.gz XKIVHDXMGVWVKZ-ROUUACIJSA-N 1 2 313.401 2.113 20 10 DECDLO OC[C@@H]1CCC[N@H+](Cc2cc(F)cc(Br)c2O)C1 ZINC001235299311 1084379087 /nfs/dbraw/zinc/37/90/87/1084379087.db2.gz UCMPEFNLUCWQDW-SECBINFHSA-N 1 2 318.186 2.498 20 10 DECDLO OC[C@@H]1CCC[N@@H+](Cc2cc(F)cc(Br)c2O)C1 ZINC001235299311 1084379095 /nfs/dbraw/zinc/37/90/95/1084379095.db2.gz UCMPEFNLUCWQDW-SECBINFHSA-N 1 2 318.186 2.498 20 10 DECDLO CN1CC[C@]2(CCC[N@@H+]2Cc2cc(Cl)cc(F)c2O)C1=O ZINC001274365870 1091208917 /nfs/dbraw/zinc/20/89/17/1091208917.db2.gz LYWJENULKGUVAU-OAHLLOKOSA-N 1 2 312.772 2.381 20 10 DECDLO CN1CC[C@]2(CCC[N@H+]2Cc2cc(Cl)cc(F)c2O)C1=O ZINC001274365870 1091208923 /nfs/dbraw/zinc/20/89/23/1091208923.db2.gz LYWJENULKGUVAU-OAHLLOKOSA-N 1 2 312.772 2.381 20 10 DECDLO Oc1cc(Cl)c(Cl)cc1C[N@H+]1CCc2nncn2CC1 ZINC001236792203 1138429920 /nfs/dbraw/zinc/42/99/20/1138429920.db2.gz CQZFFPGHZBFPLA-UHFFFAOYSA-N 1 2 313.188 2.349 20 10 DECDLO Oc1cc(Cl)c(Cl)cc1C[N@@H+]1CCc2nncn2CC1 ZINC001236792203 1138429925 /nfs/dbraw/zinc/42/99/25/1138429925.db2.gz CQZFFPGHZBFPLA-UHFFFAOYSA-N 1 2 313.188 2.349 20 10 DECDLO COc1ccc(C[NH+]2CCC3(CC2)OCCO3)c(O)c1Cl ZINC001236801962 1138433791 /nfs/dbraw/zinc/43/37/91/1138433791.db2.gz OYJIUXJEUDQZKA-UHFFFAOYSA-N 1 2 313.781 2.393 20 10 DECDLO CC(C)c1ccc(CN2CC[NH+]([C@@H]3CCOC3)CC2)c(O)c1 ZINC001237046955 1138487518 /nfs/dbraw/zinc/48/75/18/1138487518.db2.gz XNQUBMJXZLAOCH-QGZVFWFLSA-N 1 2 304.434 2.422 20 10 DECDLO CC(=O)N1CCC[N@@H+](Cc2c(O)ccc(F)c2Cl)CC1 ZINC001237119094 1138506989 /nfs/dbraw/zinc/50/69/89/1138506989.db2.gz APFODHGNPXPRRS-UHFFFAOYSA-N 1 2 300.761 2.239 20 10 DECDLO CN(C)C(=O)[C@@H]1CCC[N@@H+]1Cc1cc(F)c(Cl)cc1O ZINC001237948611 1138811985 /nfs/dbraw/zinc/81/19/85/1138811985.db2.gz FNMQYKSIEYOJJS-LBPRGKRZSA-N 1 2 300.761 2.237 20 10 DECDLO CN(C)C(=O)[C@@H]1CCC[N@H+]1Cc1cc(F)c(Cl)cc1O ZINC001237948611 1138811986 /nfs/dbraw/zinc/81/19/86/1138811986.db2.gz FNMQYKSIEYOJJS-LBPRGKRZSA-N 1 2 300.761 2.237 20 10 DECDLO COCCOC1C[NH+](Cc2ccc3c(c2O)C=CC(C)(C)O3)C1 ZINC001249263865 1141866092 /nfs/dbraw/zinc/86/60/92/1141866092.db2.gz ZLWVQJOBUIVRST-UHFFFAOYSA-N 1 2 319.401 2.424 20 10 DECDLO O=C(c1cc(-n2cc[nH+]c2)ccc1O)N1Cc2cccc(O)c2C1 ZINC001302788507 1147316079 /nfs/dbraw/zinc/31/60/79/1147316079.db2.gz XGMCLMILKVAIOC-UHFFFAOYSA-N 1 2 321.336 2.440 20 10 DECDLO C[C@@H](CCS(C)(=O)=O)[NH2+]Cc1cc(Cl)cc(F)c1O ZINC001308329336 1147467200 /nfs/dbraw/zinc/46/72/00/1147467200.db2.gz VYGQFWQYRSXMEN-QMMMGPOBSA-N 1 2 309.790 2.098 20 10 DECDLO COc1cc(C)c(C[NH2+]Cc2nc(C(F)(F)F)n[nH]2)c(O)c1 ZINC001308990126 1147494216 /nfs/dbraw/zinc/49/42/16/1147494216.db2.gz QXFJDCXQFTZVJD-UHFFFAOYSA-N 1 2 316.283 2.136 20 10 DECDLO C[C@@H]([NH2+]CCCN1CCOC1=O)c1ccc(F)c(F)c1O ZINC000187695767 296124113 /nfs/dbraw/zinc/12/41/13/296124113.db2.gz GBPDBGWPOCSVFL-SECBINFHSA-N 1 2 300.305 2.163 20 10 DECDLO COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@H](C)Cc2cc(C)[nH]n2)c1 ZINC000273533148 130134028 /nfs/dbraw/zinc/13/40/28/130134028.db2.gz WTIWINHFDXGHES-PWSUYJOCSA-N 1 2 317.389 2.492 20 10 DECDLO O=C(NC1CC1)N[C@H]1CC[N@@H+](Cc2cccc(Cl)c2O)C1 ZINC000273731372 130159387 /nfs/dbraw/zinc/15/93/87/130159387.db2.gz KDLXRCUANNXQBR-LBPRGKRZSA-N 1 2 309.797 2.082 20 10 DECDLO O=C(NC1CC1)N[C@H]1CC[N@H+](Cc2cccc(Cl)c2O)C1 ZINC000273731372 130159389 /nfs/dbraw/zinc/15/93/89/130159389.db2.gz KDLXRCUANNXQBR-LBPRGKRZSA-N 1 2 309.797 2.082 20 10 DECDLO COCC[N@H+](Cc1cc(Cl)cc(Cl)c1O)[C@H](C)C(N)=O ZINC000093138412 402011808 /nfs/dbraw/zinc/01/18/08/402011808.db2.gz NJMKZKJPVDZUTQ-MRVPVSSYSA-N 1 2 321.204 2.021 20 10 DECDLO COCC[N@@H+](Cc1cc(Cl)cc(Cl)c1O)[C@H](C)C(N)=O ZINC000093138412 402011811 /nfs/dbraw/zinc/01/18/11/402011811.db2.gz NJMKZKJPVDZUTQ-MRVPVSSYSA-N 1 2 321.204 2.021 20 10 DECDLO C[C@H](CN1CCOCC1)[NH2+][C@H](C)c1ccc(F)c(F)c1O ZINC000191204651 402651179 /nfs/dbraw/zinc/65/11/79/402651179.db2.gz MXADZURULGTLJZ-GHMZBOCLSA-N 1 2 300.349 2.042 20 10 DECDLO CC[C@H](C)[N@H+](C)CCNCc1ccc([N+](=O)[O-])c(OC)c1O ZINC000278917277 402885426 /nfs/dbraw/zinc/88/54/26/402885426.db2.gz UFOYIQAEPCXNQR-NSHDSACASA-N 1 2 311.382 2.129 20 10 DECDLO CC[C@H](C)[N@@H+](C)CCNCc1ccc([N+](=O)[O-])c(OC)c1O ZINC000278917277 402885429 /nfs/dbraw/zinc/88/54/29/402885429.db2.gz UFOYIQAEPCXNQR-NSHDSACASA-N 1 2 311.382 2.129 20 10 DECDLO CC[C@H](C)N(C)CC[NH2+]Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000278917277 402885431 /nfs/dbraw/zinc/88/54/31/402885431.db2.gz UFOYIQAEPCXNQR-NSHDSACASA-N 1 2 311.382 2.129 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@H+]2C[C@H](C)O[C@]3(CCOC3)C2)c1O ZINC000280606785 403018345 /nfs/dbraw/zinc/01/83/45/403018345.db2.gz VQIJFZYPXUFCJM-APPDUMDISA-N 1 2 323.364 2.114 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@@H+]2C[C@H](C)O[C@]3(CCOC3)C2)c1O ZINC000280606785 403018347 /nfs/dbraw/zinc/01/83/47/403018347.db2.gz VQIJFZYPXUFCJM-APPDUMDISA-N 1 2 323.364 2.114 20 10 DECDLO CC[C@@H]([NH2+]CC(=O)NCC(F)F)c1cccc(Cl)c1O ZINC000286868556 403548224 /nfs/dbraw/zinc/54/82/24/403548224.db2.gz BPNNWOFLYRQPHP-SNVBAGLBSA-N 1 2 306.740 2.468 20 10 DECDLO CNC(=O)[C@H]1CCCC[N@@H+]1Cc1cc(Cl)c(F)cc1O ZINC000295229513 403804443 /nfs/dbraw/zinc/80/44/43/403804443.db2.gz CRBWCGDAQRPIOR-GFCCVEGCSA-N 1 2 300.761 2.285 20 10 DECDLO CNC(=O)[C@H]1CCCC[N@H+]1Cc1cc(Cl)c(F)cc1O ZINC000295229513 403804448 /nfs/dbraw/zinc/80/44/48/403804448.db2.gz CRBWCGDAQRPIOR-GFCCVEGCSA-N 1 2 300.761 2.285 20 10 DECDLO Cc1cc(Br)cc(C[NH2+][C@]2(C)CCOC2=O)c1O ZINC000291044579 404371494 /nfs/dbraw/zinc/37/14/94/404371494.db2.gz ZJQGFSFFXVXLIW-CYBMUJFWSA-N 1 2 314.179 2.258 20 10 DECDLO Cn1cc(N2CC[C@@H]([NH2+]Cc3cccc(Cl)c3O)C2)cn1 ZINC000364726057 404516438 /nfs/dbraw/zinc/51/64/38/404516438.db2.gz WJDYVSJNTYRBKZ-GFCCVEGCSA-N 1 2 306.797 2.148 20 10 DECDLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)N1CCOc2cc(N(C)C)ccc21 ZINC000571535680 406533563 /nfs/dbraw/zinc/53/35/63/406533563.db2.gz SRKSQTYTHSREPH-LBPRGKRZSA-N 1 2 314.389 2.080 20 10 DECDLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)N1CCOc2cc(N(C)C)ccc21 ZINC000571535680 406533567 /nfs/dbraw/zinc/53/35/67/406533567.db2.gz SRKSQTYTHSREPH-LBPRGKRZSA-N 1 2 314.389 2.080 20 10 DECDLO Oc1ccc(Cl)c(F)c1CNC[C@H]1C[N@@H+]2CCC[C@H]2CO1 ZINC000377394610 227190175 /nfs/dbraw/zinc/19/01/75/227190175.db2.gz YDGLKRLAEBMTOG-QWRGUYRKSA-N 1 2 314.788 2.138 20 10 DECDLO Oc1ccc(Cl)c(F)c1CNC[C@H]1C[N@H+]2CCC[C@H]2CO1 ZINC000377394610 227190180 /nfs/dbraw/zinc/19/01/80/227190180.db2.gz YDGLKRLAEBMTOG-QWRGUYRKSA-N 1 2 314.788 2.138 20 10 DECDLO CC(=O)N1CCN(c2ccc(CNc3cccc[nH+]3)cc2)CC1 ZINC000191859516 526633890 /nfs/dbraw/zinc/63/38/90/526633890.db2.gz PDYAUMWOFIPZQW-UHFFFAOYSA-N 1 2 310.401 2.362 20 10 DECDLO CCN(CC)c1ccc(C[N@@H+]2CCOC[C@H]2CC(=O)OC)cc1 ZINC000377833091 528299129 /nfs/dbraw/zinc/29/91/29/528299129.db2.gz DIKCTFVJPOVNLC-QGZVFWFLSA-N 1 2 320.433 2.297 20 10 DECDLO CCN(CC)c1ccc(C[N@H+]2CCOC[C@H]2CC(=O)OC)cc1 ZINC000377833091 528299137 /nfs/dbraw/zinc/29/91/37/528299137.db2.gz DIKCTFVJPOVNLC-QGZVFWFLSA-N 1 2 320.433 2.297 20 10 DECDLO [NH3+]C[C@@H]1CN(Cc2cc(Cl)cc(Cl)c2O)CCCO1 ZINC000313333620 633514084 /nfs/dbraw/zinc/51/40/84/633514084.db2.gz ACHSPDKUZFOUHU-LLVKDONJSA-N 1 2 305.205 2.249 20 10 DECDLO C[C@@H]1C[C@H](O)C[N@@H+]1Cc1cc(Br)cc(F)c1O ZINC000894538809 637096702 /nfs/dbraw/zinc/09/67/02/637096702.db2.gz MEWLEZCNOLATPX-XCBNKYQSSA-N 1 2 304.159 2.249 20 10 DECDLO C[C@@H]1C[C@H](O)C[N@H+]1Cc1cc(Br)cc(F)c1O ZINC000894538809 637096707 /nfs/dbraw/zinc/09/67/07/637096707.db2.gz MEWLEZCNOLATPX-XCBNKYQSSA-N 1 2 304.159 2.249 20 10 DECDLO C[C@@H]1OCC[C@]12C[N@H+](Cc1cc(F)cc(F)c1O)C[C@@H](C)O2 ZINC000894598107 637127360 /nfs/dbraw/zinc/12/73/60/637127360.db2.gz USTKVLLOULIGFW-GDLVEWKHSA-N 1 2 313.344 2.439 20 10 DECDLO Oc1c(F)cc(F)cc1C[N@@H+]1CCCN(CC(F)F)CC1 ZINC000894779962 637207577 /nfs/dbraw/zinc/20/75/77/637207577.db2.gz STASAMUYOQBQIZ-UHFFFAOYSA-N 1 2 306.303 2.443 20 10 DECDLO Oc1c(F)cc(F)cc1C[N@H+]1CCCN(CC(F)F)CC1 ZINC000894779962 637207581 /nfs/dbraw/zinc/20/75/81/637207581.db2.gz STASAMUYOQBQIZ-UHFFFAOYSA-N 1 2 306.303 2.443 20 10 DECDLO COCC[N@H+]1[C@H](C)CN(Cc2cc(F)cc(F)c2O)C[C@@H]1C ZINC000895078281 637511947 /nfs/dbraw/zinc/51/19/47/637511947.db2.gz GTYXEKJKJXNVSX-TXEJJXNPSA-N 1 2 314.376 2.211 20 10 DECDLO COCC[N@@H+]1[C@H](C)CN(Cc2cc(F)cc(F)c2O)C[C@@H]1C ZINC000895078281 637511951 /nfs/dbraw/zinc/51/19/51/637511951.db2.gz GTYXEKJKJXNVSX-TXEJJXNPSA-N 1 2 314.376 2.211 20 10 DECDLO CCn1ncc(C[N@@H+]2CCCN(c3ccc(OC)cc3)CC2)n1 ZINC000838802761 637653370 /nfs/dbraw/zinc/65/33/70/637653370.db2.gz ICAKUXVPMNXNLG-UHFFFAOYSA-N 1 2 315.421 2.019 20 10 DECDLO CCn1ncc(C[N@H+]2CCCN(c3ccc(OC)cc3)CC2)n1 ZINC000838802761 637653373 /nfs/dbraw/zinc/65/33/73/637653373.db2.gz ICAKUXVPMNXNLG-UHFFFAOYSA-N 1 2 315.421 2.019 20 10 DECDLO COC(=O)CC[N@H+](CC(=O)OC(C)(C)C)Cc1ccccc1O ZINC000895713347 638158610 /nfs/dbraw/zinc/15/86/10/638158610.db2.gz OEWFCPWQVXCIGY-UHFFFAOYSA-N 1 2 323.389 2.099 20 10 DECDLO COC(=O)CC[N@@H+](CC(=O)OC(C)(C)C)Cc1ccccc1O ZINC000895713347 638158613 /nfs/dbraw/zinc/15/86/13/638158613.db2.gz OEWFCPWQVXCIGY-UHFFFAOYSA-N 1 2 323.389 2.099 20 10 DECDLO COC(=O)/C(C)=C\C[NH+]1CCN(c2ccc(OC)c(F)c2)CC1 ZINC000753857401 639350447 /nfs/dbraw/zinc/35/04/47/639350447.db2.gz LHXPQTZMGDLQRC-MLPAPPSSSA-N 1 2 322.380 2.076 20 10 DECDLO C[C@@H]([NH2+]CCCN1CCOCC1)c1cc(F)cc(F)c1O ZINC000756342959 639652265 /nfs/dbraw/zinc/65/22/65/639652265.db2.gz LZWZVRYVYXRKMX-LLVKDONJSA-N 1 2 300.349 2.043 20 10 DECDLO C[C@H]([NH2+][C@@H](C)[C@@H]1CN(C)CCO1)c1cc(F)cc(F)c1O ZINC000756762324 639692691 /nfs/dbraw/zinc/69/26/91/639692691.db2.gz XPJVOEJXTPUXMK-BHDSKKPTSA-N 1 2 300.349 2.040 20 10 DECDLO C[C@H]([NH2+]CCS(=O)(=O)CC1CC1)c1cc(F)cc(F)c1O ZINC000756762862 639693046 /nfs/dbraw/zinc/69/30/46/639693046.db2.gz SDDJDWHYPHDBIR-VIFPVBQESA-N 1 2 319.373 2.146 20 10 DECDLO CN(C)c1nccc(C[NH2+]Cc2cc(Cl)cc(F)c2O)n1 ZINC000757866041 639889775 /nfs/dbraw/zinc/88/97/75/639889775.db2.gz JDHVWLRMKYXHMR-UHFFFAOYSA-N 1 2 310.760 2.331 20 10 DECDLO OC1CCN(c2ccc(C[NH2+]Cc3cocn3)cc2F)CC1 ZINC000758307064 639943813 /nfs/dbraw/zinc/94/38/13/639943813.db2.gz HJUYKWXRCHHPKF-UHFFFAOYSA-N 1 2 305.353 2.065 20 10 DECDLO CCO[C@H]1COCC[C@@H]1[NH2+]Cc1cc(Cl)cc(F)c1O ZINC000761223929 640288142 /nfs/dbraw/zinc/28/81/42/640288142.db2.gz VGIWSPWIBQRIFL-STQMWFEESA-N 1 2 303.761 2.468 20 10 DECDLO Cc1noc([C@@H](C)[N@H+](C)Cc2ccc(N3CCOCC3)cc2)n1 ZINC000764142702 640611016 /nfs/dbraw/zinc/61/10/16/640611016.db2.gz OLHWQMMVXONKPN-CYBMUJFWSA-N 1 2 316.405 2.408 20 10 DECDLO Cc1noc([C@@H](C)[N@@H+](C)Cc2ccc(N3CCOCC3)cc2)n1 ZINC000764142702 640611020 /nfs/dbraw/zinc/61/10/20/640611020.db2.gz OLHWQMMVXONKPN-CYBMUJFWSA-N 1 2 316.405 2.408 20 10 DECDLO CC(C)OC(=O)[C@@H]1CCC[N@@H+]1Cc1cc2c(cc1O)OCO2 ZINC000769462355 641244106 /nfs/dbraw/zinc/24/41/06/641244106.db2.gz FUYMPINYIJIDAD-LBPRGKRZSA-N 1 2 307.346 2.037 20 10 DECDLO CC(C)OC(=O)[C@@H]1CCC[N@H+]1Cc1cc2c(cc1O)OCO2 ZINC000769462355 641244110 /nfs/dbraw/zinc/24/41/10/641244110.db2.gz FUYMPINYIJIDAD-LBPRGKRZSA-N 1 2 307.346 2.037 20 10 DECDLO COC(=O)[C@@H](COC(C)C)[N@H+](C)Cc1cc(C)c(C)cc1O ZINC000770354182 641358618 /nfs/dbraw/zinc/35/86/18/641358618.db2.gz FFCYYZVADJTNDO-OAHLLOKOSA-N 1 2 309.406 2.407 20 10 DECDLO COC(=O)[C@@H](COC(C)C)[N@@H+](C)Cc1cc(C)c(C)cc1O ZINC000770354182 641358622 /nfs/dbraw/zinc/35/86/22/641358622.db2.gz FFCYYZVADJTNDO-OAHLLOKOSA-N 1 2 309.406 2.407 20 10 DECDLO NC(=O)C[N@H+](Cc1cc(Cl)cc(F)c1O)C1CCCC1 ZINC000775649384 642072760 /nfs/dbraw/zinc/07/27/60/642072760.db2.gz PWMXHLLQJLJSBA-UHFFFAOYSA-N 1 2 300.761 2.415 20 10 DECDLO NC(=O)C[N@@H+](Cc1cc(Cl)cc(F)c1O)C1CCCC1 ZINC000775649384 642072765 /nfs/dbraw/zinc/07/27/65/642072765.db2.gz PWMXHLLQJLJSBA-UHFFFAOYSA-N 1 2 300.761 2.415 20 10 DECDLO CNC(=O)[C@@H]1CCC[C@H]1[NH2+]Cc1cc(Cl)cc(F)c1O ZINC000776252592 642149328 /nfs/dbraw/zinc/14/93/28/642149328.db2.gz MPJIHJLDHQGBJE-ZYHUDNBSSA-N 1 2 300.761 2.189 20 10 DECDLO CC[C@@H]([NH2+]CCCc1nnnn1C)c1cccc(Cl)c1O ZINC000903348802 643323138 /nfs/dbraw/zinc/32/31/38/643323138.db2.gz LEHRNLWRPPWLTD-GFCCVEGCSA-N 1 2 309.801 2.243 20 10 DECDLO C[C@@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)c1nnnn1C1CC1 ZINC000791008841 643919382 /nfs/dbraw/zinc/91/93/82/643919382.db2.gz JQDXRMOBNZXGOP-SNVBAGLBSA-N 1 2 304.373 2.064 20 10 DECDLO OCCO[C@@H]1CCC[N@H+](Cc2c(O)ccc(Cl)c2F)C1 ZINC000792168001 644082942 /nfs/dbraw/zinc/08/29/42/644082942.db2.gz XIHXXHGFHFIKKF-SNVBAGLBSA-N 1 2 303.761 2.158 20 10 DECDLO OCCO[C@@H]1CCC[N@@H+](Cc2c(O)ccc(Cl)c2F)C1 ZINC000792168001 644082946 /nfs/dbraw/zinc/08/29/46/644082946.db2.gz XIHXXHGFHFIKKF-SNVBAGLBSA-N 1 2 303.761 2.158 20 10 DECDLO Cc1cn(C(C)(C)C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)c[nH+]1 ZINC000907272062 644488244 /nfs/dbraw/zinc/48/82/44/644488244.db2.gz DHNQUDGFMRNFQT-LLVKDONJSA-N 1 2 317.389 2.085 20 10 DECDLO COC(=O)[C@@H](CC(C)C)[NH+]1CCN(c2ccc(OC)cc2)CC1 ZINC000795855601 644647578 /nfs/dbraw/zinc/64/75/78/644647578.db2.gz NFGYYIWHDWMTAZ-QGZVFWFLSA-N 1 2 320.433 2.405 20 10 DECDLO CO[C@@H]1COCC[C@@H]1C[NH2+]Cc1cc(Cl)cc(F)c1O ZINC000824710233 648640419 /nfs/dbraw/zinc/64/04/19/648640419.db2.gz WCWIQMWLNZVJEP-NOZJJQNGSA-N 1 2 303.761 2.326 20 10 DECDLO COc1ccc(O)c([C@H](C)[NH2+]Cc2nc([C@H](C)OC)no2)c1 ZINC000182348286 648887180 /nfs/dbraw/zinc/88/71/80/648887180.db2.gz CTOSMNTUOJGHBM-UWVGGRQHSA-N 1 2 307.350 2.342 20 10 DECDLO COc1c(O)c(C[N@@H+]2CCO[C@@](C)(C3CC3)C2)ccc1[N+](=O)[O-] ZINC000826877178 648941549 /nfs/dbraw/zinc/94/15/49/648941549.db2.gz BWALUXKIJMFNLY-MRXNPFEDSA-N 1 2 322.361 2.310 20 10 DECDLO COc1c(O)c(C[N@H+]2CCO[C@@](C)(C3CC3)C2)ccc1[N+](=O)[O-] ZINC000826877178 648941550 /nfs/dbraw/zinc/94/15/50/648941550.db2.gz BWALUXKIJMFNLY-MRXNPFEDSA-N 1 2 322.361 2.310 20 10 DECDLO C[C@@H]([NH2+]C[C@H]1CC(=O)N(C2CC2)C1)c1cc(F)cc(F)c1O ZINC000846205706 651315048 /nfs/dbraw/zinc/31/50/48/651315048.db2.gz KGQRQIZTKHHCDK-NXEZZACHSA-N 1 2 310.344 2.332 20 10 DECDLO COc1cc(C[NH2+]Cc2ncn(C)n2)c(O)c(C(C)(C)C)c1 ZINC000850234372 651870508 /nfs/dbraw/zinc/87/05/08/651870508.db2.gz FNNMKZYRKGUCMM-UHFFFAOYSA-N 1 2 304.394 2.117 20 10 DECDLO COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@@H]2C[C@@H](C)n3ncnc32)c1 ZINC000850499334 651940483 /nfs/dbraw/zinc/94/04/83/651940483.db2.gz NOTDQDPVBPYPOI-GBIKHYSHSA-N 1 2 316.361 2.127 20 10 DECDLO CC(=O)N1CCC[N@@H+](Cc2cc(F)c(N(C)C)cc2F)CC1 ZINC000862214935 686255769 /nfs/dbraw/zinc/25/57/69/686255769.db2.gz CLDOWHOLUBZXNQ-UHFFFAOYSA-N 1 2 311.376 2.085 20 10 DECDLO CC(=O)N1CCC[N@H+](Cc2cc(F)c(N(C)C)cc2F)CC1 ZINC000862214935 686255774 /nfs/dbraw/zinc/25/57/74/686255774.db2.gz CLDOWHOLUBZXNQ-UHFFFAOYSA-N 1 2 311.376 2.085 20 10 DECDLO CN(C)c1cc(F)c(C[N@H+](CCO)Cc2cccnc2)cc1F ZINC000862238975 686262746 /nfs/dbraw/zinc/26/27/46/686262746.db2.gz QNAVHKGOOCHHEU-UHFFFAOYSA-N 1 2 321.371 2.420 20 10 DECDLO CN(C)c1cc(F)c(C[N@@H+](CCO)Cc2cccnc2)cc1F ZINC000862238975 686262748 /nfs/dbraw/zinc/26/27/48/686262748.db2.gz QNAVHKGOOCHHEU-UHFFFAOYSA-N 1 2 321.371 2.420 20 10 DECDLO Cc1noc([C@@H](C)[NH2+]Cc2ccc(N3CCC(O)CC3)cc2)n1 ZINC000877469865 690122769 /nfs/dbraw/zinc/12/27/69/690122769.db2.gz APWDUKQIOSYORC-GFCCVEGCSA-N 1 2 316.405 2.190 20 10 DECDLO Oc1c(C[NH2+][C@@H]2COc3ccccc3[C@@H]2O)ccc(F)c1F ZINC000877537599 690144669 /nfs/dbraw/zinc/14/46/69/690144669.db2.gz MXBOXGCDCGIKGV-WBMJQRKESA-N 1 2 307.296 2.255 20 10 DECDLO Oc1c(F)cc(Cl)cc1C[N@@H+]1CC[C@@H](C2OCCO2)C1 ZINC000896385662 693000997 /nfs/dbraw/zinc/00/09/97/693000997.db2.gz HZEGQHFFZZCKIS-SECBINFHSA-N 1 2 301.745 2.380 20 10 DECDLO Oc1c(F)cc(Cl)cc1C[N@H+]1CC[C@@H](C2OCCO2)C1 ZINC000896385662 693000999 /nfs/dbraw/zinc/00/09/99/693000999.db2.gz HZEGQHFFZZCKIS-SECBINFHSA-N 1 2 301.745 2.380 20 10 DECDLO CCOC[C@H]1Cn2nccc2C[N@H+](Cc2c(O)cccc2F)C1 ZINC001137836256 796144293 /nfs/dbraw/zinc/14/42/93/796144293.db2.gz XJGSHVHWAZZJBS-CYBMUJFWSA-N 1 2 319.380 2.396 20 10 DECDLO CCOC[C@H]1Cn2nccc2C[N@@H+](Cc2c(O)cccc2F)C1 ZINC001137836256 796144295 /nfs/dbraw/zinc/14/42/95/796144295.db2.gz XJGSHVHWAZZJBS-CYBMUJFWSA-N 1 2 319.380 2.396 20 10 DECDLO COc1ccc(CN2CC([NH+]3CCC(F)(F)CC3)C2)c(O)c1 ZINC001203627792 796325079 /nfs/dbraw/zinc/32/50/79/796325079.db2.gz PLZJNAOCTPXKDI-UHFFFAOYSA-N 1 2 312.360 2.316 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CC[C@]2(CCOC2)C1 ZINC001139125605 796326551 /nfs/dbraw/zinc/32/65/51/796326551.db2.gz XQMBHXZMRFLELN-SFHVURJKSA-N 1 2 315.369 2.419 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CC[C@]2(CCOC2)C1 ZINC001139125605 796326552 /nfs/dbraw/zinc/32/65/52/796326552.db2.gz XQMBHXZMRFLELN-SFHVURJKSA-N 1 2 315.369 2.419 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CCC[C@H](CO)C1 ZINC001139126871 796327823 /nfs/dbraw/zinc/32/78/23/796327823.db2.gz SQURNEBLSSRLLX-LBPRGKRZSA-N 1 2 303.358 2.011 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CCC[C@H](CO)C1 ZINC001139126871 796327827 /nfs/dbraw/zinc/32/78/27/796327827.db2.gz SQURNEBLSSRLLX-LBPRGKRZSA-N 1 2 303.358 2.011 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CCCC[C@H]1CO ZINC001139126752 796328142 /nfs/dbraw/zinc/32/81/42/796328142.db2.gz OYRXAZRLSOJZMK-LBPRGKRZSA-N 1 2 303.358 2.154 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CCCC[C@H]1CO ZINC001139126752 796328145 /nfs/dbraw/zinc/32/81/45/796328145.db2.gz OYRXAZRLSOJZMK-LBPRGKRZSA-N 1 2 303.358 2.154 20 10 DECDLO CCCOC1C[NH+](Cc2ccc(N3CCC(O)CC3)cc2)C1 ZINC001140286528 796502655 /nfs/dbraw/zinc/50/26/55/796502655.db2.gz MLFKLAAYMXAMMA-UHFFFAOYSA-N 1 2 304.434 2.259 20 10 DECDLO CCNC(=O)OC1CC[NH+](Cc2c(O)cc(F)cc2F)CC1 ZINC001140584264 796542191 /nfs/dbraw/zinc/54/21/91/796542191.db2.gz LALDQDDYLSUZDR-UHFFFAOYSA-N 1 2 314.332 2.381 20 10 DECDLO CCOC(=O)[C@@H]1CCC[N@@H+]1Cc1ccc2c(c1)OCCN2C ZINC001141143959 796639099 /nfs/dbraw/zinc/63/90/99/796639099.db2.gz PVQXFCYLXNZBFC-HNNXBMFYSA-N 1 2 304.390 2.043 20 10 DECDLO CCOC(=O)[C@@H]1CCC[N@H+]1Cc1ccc2c(c1)OCCN2C ZINC001141143959 796639101 /nfs/dbraw/zinc/63/91/01/796639101.db2.gz PVQXFCYLXNZBFC-HNNXBMFYSA-N 1 2 304.390 2.043 20 10 DECDLO CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](C1)[N@H+]2Cc1cc(O)ccc1O ZINC001141157257 796642375 /nfs/dbraw/zinc/64/23/75/796642375.db2.gz FIJHXEVHDOGFSD-BETUJISGSA-N 1 2 320.389 2.291 20 10 DECDLO CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](C1)[N@@H+]2Cc1cc(O)ccc1O ZINC001141157257 796642377 /nfs/dbraw/zinc/64/23/77/796642377.db2.gz FIJHXEVHDOGFSD-BETUJISGSA-N 1 2 320.389 2.291 20 10 DECDLO C[NH+]1CCN(C2CN(Cc3cccc(C(C)(C)C)c3O)C2)CC1 ZINC001143116486 796803560 /nfs/dbraw/zinc/80/35/60/796803560.db2.gz DLCROLIVEVWZLC-UHFFFAOYSA-N 1 2 317.477 2.121 20 10 DECDLO CCN(Cc1ccccc1O)c1ccc(Cn2cncn2)c[nH+]1 ZINC001154890523 797634432 /nfs/dbraw/zinc/63/44/32/797634432.db2.gz AHNYQTQPFWWOGK-UHFFFAOYSA-N 1 2 309.373 2.454 20 10 DECDLO CC(C)(C)OC(=O)N1CC2(C1)C[NH+](Cc1ccc(O)c(O)c1)C2 ZINC001203875712 798179769 /nfs/dbraw/zinc/17/97/69/798179769.db2.gz SWPYNVFUVOLPSB-UHFFFAOYSA-N 1 2 320.389 2.151 20 10 DECDLO C[NH+](C)C[C@@H]1COCCN1Cc1cc(Cl)cc(Cl)c1O ZINC001203581887 800083756 /nfs/dbraw/zinc/08/37/56/800083756.db2.gz CKLRMCFKQIDSAE-GFCCVEGCSA-N 1 2 319.232 2.461 20 10 DECDLO COc1ccc(C[N@@H+]2C[C@@H]3C[C@H]2[C@@H](C(F)(F)F)O3)c(O)c1 ZINC001203628488 800094015 /nfs/dbraw/zinc/09/40/15/800094015.db2.gz ARWTZIHFEBSWQH-GVXVVHGQSA-N 1 2 303.280 2.305 20 10 DECDLO COc1ccc(C[N@H+]2C[C@@H]3C[C@H]2[C@@H](C(F)(F)F)O3)c(O)c1 ZINC001203628488 800094021 /nfs/dbraw/zinc/09/40/21/800094021.db2.gz ARWTZIHFEBSWQH-GVXVVHGQSA-N 1 2 303.280 2.305 20 10 DECDLO OC[C@@H]1C[C@H](F)C[N@H+](Cc2cc(Br)ccc2O)C1 ZINC001203635643 800096636 /nfs/dbraw/zinc/09/66/36/800096636.db2.gz BVUDITBFRVHXJO-SKDRFNHKSA-N 1 2 318.186 2.307 20 10 DECDLO OC[C@@H]1C[C@H](F)C[N@@H+](Cc2cc(Br)ccc2O)C1 ZINC001203635643 800096645 /nfs/dbraw/zinc/09/66/45/800096645.db2.gz BVUDITBFRVHXJO-SKDRFNHKSA-N 1 2 318.186 2.307 20 10 DECDLO FC1(F)C[NH2+]CCN(Cc2cc3c4c(c2)CCCN4CCC3)C1 ZINC001211340921 801549676 /nfs/dbraw/zinc/54/96/76/801549676.db2.gz FKWJQRJTUQVEEM-UHFFFAOYSA-N 1 2 321.415 2.426 20 10 DECDLO CN(C)c1ccc(C[N@@H+]2C[C@@H]3C[C@H]2[C@@H](C(F)(F)F)O3)c(O)c1 ZINC001232838933 801969069 /nfs/dbraw/zinc/96/90/69/801969069.db2.gz DYXUGYZRHMOYPL-OBJOEFQTSA-N 1 2 316.323 2.362 20 10 DECDLO CN(C)c1ccc(C[N@H+]2C[C@@H]3C[C@H]2[C@@H](C(F)(F)F)O3)c(O)c1 ZINC001232838933 801969073 /nfs/dbraw/zinc/96/90/73/801969073.db2.gz DYXUGYZRHMOYPL-OBJOEFQTSA-N 1 2 316.323 2.362 20 10 DECDLO COc1cc(Cl)cc(C[N@@H+]2CCN(C(C)=O)[C@@H](C)C2)c1O ZINC001233290758 802063802 /nfs/dbraw/zinc/06/38/02/802063802.db2.gz UEBKFRFADZYJQT-JTQLQIEISA-N 1 2 312.797 2.107 20 10 DECDLO COc1cc(Cl)cc(C[N@H+]2CCN(C(C)=O)[C@@H](C)C2)c1O ZINC001233290758 802063808 /nfs/dbraw/zinc/06/38/08/802063808.db2.gz UEBKFRFADZYJQT-JTQLQIEISA-N 1 2 312.797 2.107 20 10 DECDLO COc1cc(Cl)cc(C[N@@H+]2CCc3cnn(C)c3C2)c1O ZINC001233290443 802064204 /nfs/dbraw/zinc/06/42/04/802064204.db2.gz CTEFMYMPDYIKJO-UHFFFAOYSA-N 1 2 307.781 2.346 20 10 DECDLO COc1cc(Cl)cc(C[N@H+]2CCc3cnn(C)c3C2)c1O ZINC001233290443 802064208 /nfs/dbraw/zinc/06/42/08/802064208.db2.gz CTEFMYMPDYIKJO-UHFFFAOYSA-N 1 2 307.781 2.346 20 10 DECDLO CCNC(=O)OC1CC[NH+](Cc2c(O)ccc(F)c2F)CC1 ZINC001233335905 802079643 /nfs/dbraw/zinc/07/96/43/802079643.db2.gz QIDTXLGNHZIECL-UHFFFAOYSA-N 1 2 314.332 2.381 20 10 DECDLO C[C@@H]([NH2+]C[C@@H](C)c1ccncc1)c1cccc(-c2nn[nH]n2)c1O ZINC001603551790 1069987267 /nfs/dbraw/zinc/98/72/67/1069987267.db2.gz GGXWVCHBZXVJJV-VXGBXAGGSA-N 1 2 324.388 2.422 20 10 DECDLO CCOC(=O)/C=C\C[NH+]1CCN(c2ccc(OCC)cc2)CC1 ZINC001644993465 1078870984 /nfs/dbraw/zinc/87/09/84/1078870984.db2.gz LFWGOSIQCUNRJP-WAYWQWQTSA-N 1 2 318.417 2.327 20 10 DECDLO C[C@@H]([NH2+][C@@H](C)c1cccc(-c2nn[nH]n2)c1O)c1cncs1 ZINC001589952113 1076533917 /nfs/dbraw/zinc/53/39/17/1076533917.db2.gz LIEIOYPEWAWEMY-DTWKUNHWSA-N 1 2 316.390 2.441 20 10 DECDLO CCC[C@H](C[NH2+][C@H](C)c1cccc(-c2nn[nH]n2)c1O)OCC ZINC001590556992 1076652000 /nfs/dbraw/zinc/65/20/00/1076652000.db2.gz DMKVSQDRYIFZAN-VXGBXAGGSA-N 1 2 319.409 2.428 20 10 DECDLO CO[C@@H]1CCC[C@H]1C[NH2+][C@H](C)c1cccc(-c2nn[nH]n2)c1O ZINC001591359492 1076733838 /nfs/dbraw/zinc/73/38/38/1076733838.db2.gz DBTUDPPCQTXZTQ-UHIISALHSA-N 1 2 317.393 2.038 20 10 DECDLO COc1cc(O)c(C[N@@H+]2C[C@H](CO)C[C@H](F)C2)c(Cl)c1 ZINC001236797347 1079943346 /nfs/dbraw/zinc/94/33/46/1079943346.db2.gz DMRJIVLDWFZWNV-ZJUUUORDSA-N 1 2 303.761 2.207 20 10 DECDLO O=c1cc(C[NH2+]Cc2cccc(Cl)c2O)nc2ccccn12 ZINC001665135780 1080993187 /nfs/dbraw/zinc/99/31/87/1080993187.db2.gz BPVODTSDQCVCCP-UHFFFAOYSA-N 1 2 315.760 2.343 20 10 DECDLO CC(C)c1ccc(O)c(CN2CC[NH+]([C@@H]3CCOC3)CC2)c1 ZINC001665185384 1080998191 /nfs/dbraw/zinc/99/81/91/1080998191.db2.gz HJOFVQRGFIYPMV-QGZVFWFLSA-N 1 2 304.434 2.422 20 10 DECDLO CCn1ccnc1C[N@H+]1C[C@H]2C[C@@H](C1)N2c1ccc(OC)cc1 ZINC001276926605 1083683762 /nfs/dbraw/zinc/68/37/62/1083683762.db2.gz GTYKCVOVQMEFHG-IYBDPMFKSA-N 1 2 312.417 2.375 20 10 DECDLO CCn1ccnc1C[N@@H+]1C[C@H]2C[C@@H](C1)N2c1ccc(OC)cc1 ZINC001276926605 1083683766 /nfs/dbraw/zinc/68/37/66/1083683766.db2.gz GTYKCVOVQMEFHG-IYBDPMFKSA-N 1 2 312.417 2.375 20 10 DECDLO COC[C@H]1C[N@H+](Cc2c(O)cccc2Br)CCO1 ZINC000707144716 1086658867 /nfs/dbraw/zinc/65/88/67/1086658867.db2.gz QSDOJWYPCCKRIU-SNVBAGLBSA-N 1 2 316.195 2.002 20 10 DECDLO COC[C@H]1C[N@@H+](Cc2c(O)cccc2Br)CCO1 ZINC000707144716 1086658870 /nfs/dbraw/zinc/65/88/70/1086658870.db2.gz QSDOJWYPCCKRIU-SNVBAGLBSA-N 1 2 316.195 2.002 20 10 DECDLO COc1ccc(C[NH+]2CCC(NC(C)=O)CC2)c(O)c1Cl ZINC001236803434 1138432785 /nfs/dbraw/zinc/43/27/85/1138432785.db2.gz UEHCNEKMQAXRLA-UHFFFAOYSA-N 1 2 312.797 2.155 20 10 DECDLO COc1cc(O)c(C[N@@H+]2CCc3nn(C)cc3C2)c(Cl)c1 ZINC001236802759 1138432941 /nfs/dbraw/zinc/43/29/41/1138432941.db2.gz KOKOCZGHCCZCTE-UHFFFAOYSA-N 1 2 307.781 2.346 20 10 DECDLO COc1cc(O)c(C[N@H+]2CCc3nn(C)cc3C2)c(Cl)c1 ZINC001236802759 1138432951 /nfs/dbraw/zinc/43/29/51/1138432951.db2.gz KOKOCZGHCCZCTE-UHFFFAOYSA-N 1 2 307.781 2.346 20 10 DECDLO COc1ccc(C[N@@H+]2CCC[C@H](NC(C)=O)C2)c(O)c1Cl ZINC001236810887 1138433474 /nfs/dbraw/zinc/43/34/74/1138433474.db2.gz AYDOXYVAXPPDNQ-LBPRGKRZSA-N 1 2 312.797 2.155 20 10 DECDLO COc1ccc(C[N@H+]2CCC[C@H](NC(C)=O)C2)c(O)c1Cl ZINC001236810887 1138433478 /nfs/dbraw/zinc/43/34/78/1138433478.db2.gz AYDOXYVAXPPDNQ-LBPRGKRZSA-N 1 2 312.797 2.155 20 10 DECDLO COc1ccc(C[N@@H+]2CC[C@H](N(C)C(C)=O)C2)c(O)c1Cl ZINC001236810664 1138437029 /nfs/dbraw/zinc/43/70/29/1138437029.db2.gz XDBISDOGTKAJCQ-LBPRGKRZSA-N 1 2 312.797 2.107 20 10 DECDLO COc1ccc(C[N@H+]2CC[C@H](N(C)C(C)=O)C2)c(O)c1Cl ZINC001236810664 1138437032 /nfs/dbraw/zinc/43/70/32/1138437032.db2.gz XDBISDOGTKAJCQ-LBPRGKRZSA-N 1 2 312.797 2.107 20 10 DECDLO CC(=O)NC1CC[NH+](Cc2cc(F)cc(Cl)c2O)CC1 ZINC001237808136 1138798465 /nfs/dbraw/zinc/79/84/65/1138798465.db2.gz RGKFEYWSEBIWDF-UHFFFAOYSA-N 1 2 300.761 2.285 20 10 DECDLO CCN1CC[N@H+](Cc2ccc3c(c2O)C=CC(C)(C)O3)CC1=O ZINC001249252753 1141865365 /nfs/dbraw/zinc/86/53/65/1141865365.db2.gz TUAYKZBNFLLPFF-UHFFFAOYSA-N 1 2 316.401 2.241 20 10 DECDLO CCN1CC[N@@H+](Cc2ccc3c(c2O)C=CC(C)(C)O3)CC1=O ZINC001249252753 1141865366 /nfs/dbraw/zinc/86/53/66/1141865366.db2.gz TUAYKZBNFLLPFF-UHFFFAOYSA-N 1 2 316.401 2.241 20 10 DECDLO O=C(NCC[NH2+]Cc1cc(F)cc(F)c1O)c1ccccc1F ZINC001308324297 1147466731 /nfs/dbraw/zinc/46/67/31/1147466731.db2.gz ICTOABYJTKQVAN-UHFFFAOYSA-N 1 2 324.302 2.329 20 10 DECDLO C[C@@H]([NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1O)C(=O)NC(C)(C)C ZINC000273361958 296158700 /nfs/dbraw/zinc/15/87/00/296158700.db2.gz APHPNMLZUSAUTA-NXEZZACHSA-N 1 2 309.366 2.254 20 10 DECDLO COc1cccc(C[N@@H+]2CCNC(=O)[C@@H]2c2cccs2)c1O ZINC000371334159 533482027 /nfs/dbraw/zinc/48/20/27/533482027.db2.gz XOQUOEIECUZWRY-AWEZNQCLSA-N 1 2 318.398 2.135 20 10 DECDLO COc1cccc(C[N@H+]2CCNC(=O)[C@@H]2c2cccs2)c1O ZINC000371334159 533482035 /nfs/dbraw/zinc/48/20/35/533482035.db2.gz XOQUOEIECUZWRY-AWEZNQCLSA-N 1 2 318.398 2.135 20 10 DECDLO COc1cc(Cl)cc(C[N@@H+]2CC[S@](=O)[C@H](C)[C@@H]2C)c1O ZINC000273706813 130156165 /nfs/dbraw/zinc/15/61/65/130156165.db2.gz FKTHWRQBMIANPT-AUKWLOTRSA-N 1 2 317.838 2.396 20 10 DECDLO COc1cc(Cl)cc(C[N@H+]2CC[S@](=O)[C@H](C)[C@@H]2C)c1O ZINC000273706813 130156168 /nfs/dbraw/zinc/15/61/68/130156168.db2.gz FKTHWRQBMIANPT-AUKWLOTRSA-N 1 2 317.838 2.396 20 10 DECDLO C[N@H+](Cc1cc(Cl)cc(Cl)c1O)[C@H]1CCS(=O)(=O)C1 ZINC000132399833 401866911 /nfs/dbraw/zinc/86/69/11/401866911.db2.gz KBZYJMXSUIDAPY-JTQLQIEISA-N 1 2 324.229 2.318 20 10 DECDLO C[N@@H+](Cc1cc(Cl)cc(Cl)c1O)[C@H]1CCS(=O)(=O)C1 ZINC000132399833 401866912 /nfs/dbraw/zinc/86/69/12/401866912.db2.gz KBZYJMXSUIDAPY-JTQLQIEISA-N 1 2 324.229 2.318 20 10 DECDLO C[N@H+](CC(=O)NC1CC1)Cc1cc(Cl)cc(Cl)c1O ZINC000120345511 401987342 /nfs/dbraw/zinc/98/73/42/401987342.db2.gz MUPNHPKNEOTOGB-UHFFFAOYSA-N 1 2 303.189 2.409 20 10 DECDLO C[N@@H+](CC(=O)NC1CC1)Cc1cc(Cl)cc(Cl)c1O ZINC000120345511 401987344 /nfs/dbraw/zinc/98/73/44/401987344.db2.gz MUPNHPKNEOTOGB-UHFFFAOYSA-N 1 2 303.189 2.409 20 10 DECDLO O=C(NCc1ccc(N2CCCC2)[nH+]c1)c1cccc(O)c1O ZINC000186884466 402469237 /nfs/dbraw/zinc/46/92/37/402469237.db2.gz QQWAUASREHDIAD-UHFFFAOYSA-N 1 2 313.357 2.023 20 10 DECDLO O=S1(=O)CC[C@@H]([N@H+](Cc2cccc(Cl)c2O)C2CC2)C1 ZINC000179710788 402598432 /nfs/dbraw/zinc/59/84/32/402598432.db2.gz XFUJDSNAIBXQFA-GFCCVEGCSA-N 1 2 315.822 2.197 20 10 DECDLO O=S1(=O)CC[C@@H]([N@@H+](Cc2cccc(Cl)c2O)C2CC2)C1 ZINC000179710788 402598434 /nfs/dbraw/zinc/59/84/34/402598434.db2.gz XFUJDSNAIBXQFA-GFCCVEGCSA-N 1 2 315.822 2.197 20 10 DECDLO OCC[C@@]1([NH2+]Cc2cc(Cl)cc(Cl)c2O)CCOC1 ZINC000278542696 402867966 /nfs/dbraw/zinc/86/79/66/402867966.db2.gz XQKQRDIUYXDTLM-CYBMUJFWSA-N 1 2 306.189 2.330 20 10 DECDLO CCOC(=O)[C@H](C)[N@H+](Cc1cc(OC)c(OC)cc1O)C1CC1 ZINC000276147114 403149163 /nfs/dbraw/zinc/14/91/63/403149163.db2.gz FUBLOSQGHBPZHG-NSHDSACASA-N 1 2 323.389 2.325 20 10 DECDLO CCOC(=O)[C@H](C)[N@@H+](Cc1cc(OC)c(OC)cc1O)C1CC1 ZINC000276147114 403149164 /nfs/dbraw/zinc/14/91/64/403149164.db2.gz FUBLOSQGHBPZHG-NSHDSACASA-N 1 2 323.389 2.325 20 10 DECDLO CC[C@H]([NH2+]CCCn1cc(CO)nn1)c1cccc(Cl)c1O ZINC000289627813 403989689 /nfs/dbraw/zinc/98/96/89/403989689.db2.gz FAOAXZQUVIASMR-AWEZNQCLSA-N 1 2 324.812 2.260 20 10 DECDLO O=S1(=O)C[C@@H]([NH2+]Cc2ccc3c(c2)CCO3)c2ccccc21 ZINC000267911966 527314747 /nfs/dbraw/zinc/31/47/47/527314747.db2.gz DZYFWVPQFDIPGX-OAHLLOKOSA-N 1 2 315.394 2.240 20 10 DECDLO CC(C)N1CC[NH+](Cc2ccc(N3CCOCC3)cc2)CC1 ZINC000120565098 622935287 /nfs/dbraw/zinc/93/52/87/622935287.db2.gz CMKKEKIYIMYRDQ-UHFFFAOYSA-N 1 2 303.450 2.049 20 10 DECDLO C[C@H](c1cccnc1)[NH+]1CCN(C(=O)Cc2ccc(N)cc2)CC1 ZINC000071700479 623526551 /nfs/dbraw/zinc/52/65/51/623526551.db2.gz ICKJIMSJZODSCN-OAHLLOKOSA-N 1 2 324.428 2.112 20 10 DECDLO CO[C@@H]1CC[C@@H]2OCC[N@H+](Cc3cc(F)cc(F)c3O)[C@H]2C1 ZINC000894096756 636113124 /nfs/dbraw/zinc/11/31/24/636113124.db2.gz ZOQYGRIGEWIXQF-SNPRPXQTSA-N 1 2 313.344 2.439 20 10 DECDLO CO[C@@H]1CC[C@@H]2OCC[N@@H+](Cc3cc(F)cc(F)c3O)[C@H]2C1 ZINC000894096756 636113127 /nfs/dbraw/zinc/11/31/27/636113127.db2.gz ZOQYGRIGEWIXQF-SNPRPXQTSA-N 1 2 313.344 2.439 20 10 DECDLO Cc1cc(Br)c(O)c(C[NH+]2CC(C)(CO)C2)c1 ZINC000839144886 637788782 /nfs/dbraw/zinc/78/87/82/637788782.db2.gz CCTSVEPTMGCDRW-UHFFFAOYSA-N 1 2 300.196 2.277 20 10 DECDLO CC(C)(O)C1C[NH+](Cc2cccc(Br)c2O)C1 ZINC000839140663 637803017 /nfs/dbraw/zinc/80/30/17/637803017.db2.gz SJYHGWALAACJIU-UHFFFAOYSA-N 1 2 300.196 2.357 20 10 DECDLO COCc1ncc2c(n1)CC[N@@H+](Cc1cc(F)ccc1O)C2 ZINC000895415173 638010991 /nfs/dbraw/zinc/01/09/91/638010991.db2.gz NOOHSHPFIMOHTJ-UHFFFAOYSA-N 1 2 303.337 2.026 20 10 DECDLO COCc1ncc2c(n1)CC[N@H+](Cc1cc(F)ccc1O)C2 ZINC000895415173 638010999 /nfs/dbraw/zinc/01/09/99/638010999.db2.gz NOOHSHPFIMOHTJ-UHFFFAOYSA-N 1 2 303.337 2.026 20 10 DECDLO COc1c(O)c(C[N@H+](C)Cc2ccns2)ccc1[N+](=O)[O-] ZINC000895452705 638032613 /nfs/dbraw/zinc/03/26/13/638032613.db2.gz SDQSMEFGPWEYTO-UHFFFAOYSA-N 1 2 309.347 2.398 20 10 DECDLO COc1c(O)c(C[N@@H+](C)Cc2ccns2)ccc1[N+](=O)[O-] ZINC000895452705 638032617 /nfs/dbraw/zinc/03/26/17/638032617.db2.gz SDQSMEFGPWEYTO-UHFFFAOYSA-N 1 2 309.347 2.398 20 10 DECDLO Cc1cc(O)c(C[NH2+]Cc2nnnn2CC2CC2)c(Cl)c1 ZINC000840939407 650390185 /nfs/dbraw/zinc/39/01/85/650390185.db2.gz XLYLOOPHFVJXCL-UHFFFAOYSA-N 1 2 307.785 2.040 20 10 DECDLO COC(=O)[C@H](CC1CCOCC1)[NH2+]Cc1ccc(C)cc1O ZINC000895592204 638106062 /nfs/dbraw/zinc/10/60/62/638106062.db2.gz NDHFQPQVEOWQDC-HNNXBMFYSA-N 1 2 307.390 2.149 20 10 DECDLO OC[C@H](C[C@@H]1CCCO1)[NH2+]Cc1cc(Cl)cc(F)c1O ZINC000895746093 638174744 /nfs/dbraw/zinc/17/47/44/638174744.db2.gz BNEGWNZKEAMFLK-RYUDHWBXSA-N 1 2 303.761 2.204 20 10 DECDLO COC(=O)C[N@H+](Cc1cc(Cl)ccc1O)CC1(C)COC1 ZINC000744402273 638217037 /nfs/dbraw/zinc/21/70/37/638217037.db2.gz LTZOTXUOQDGBSM-UHFFFAOYSA-N 1 2 313.781 2.057 20 10 DECDLO COC(=O)C[N@@H+](Cc1cc(Cl)ccc1O)CC1(C)COC1 ZINC000744402273 638217051 /nfs/dbraw/zinc/21/70/51/638217051.db2.gz LTZOTXUOQDGBSM-UHFFFAOYSA-N 1 2 313.781 2.057 20 10 DECDLO Oc1c(Cl)cccc1C[NH2+]C[C@@H]1CCN1C1CCOCC1 ZINC000897227136 639260789 /nfs/dbraw/zinc/26/07/89/639260789.db2.gz BPLWSLILPWOOIL-AWEZNQCLSA-N 1 2 310.825 2.389 20 10 DECDLO Cc1ccnc(C[N@H+](C)Cc2ccc(N3CCOCC3)cc2)n1 ZINC000756481190 639665142 /nfs/dbraw/zinc/66/51/42/639665142.db2.gz HSSKWHNEBIHYLB-UHFFFAOYSA-N 1 2 312.417 2.254 20 10 DECDLO Cc1ccnc(C[N@@H+](C)Cc2ccc(N3CCOCC3)cc2)n1 ZINC000756481190 639665144 /nfs/dbraw/zinc/66/51/44/639665144.db2.gz HSSKWHNEBIHYLB-UHFFFAOYSA-N 1 2 312.417 2.254 20 10 DECDLO Cn1nccc1[C@H]1C[N@H+](Cc2c(O)cccc2Cl)CCO1 ZINC000897558188 640798354 /nfs/dbraw/zinc/79/83/54/640798354.db2.gz FMPLIIPKYHGYPP-OAHLLOKOSA-N 1 2 307.781 2.353 20 10 DECDLO Cn1nccc1[C@H]1C[N@@H+](Cc2c(O)cccc2Cl)CCO1 ZINC000897558188 640798358 /nfs/dbraw/zinc/79/83/58/640798358.db2.gz FMPLIIPKYHGYPP-OAHLLOKOSA-N 1 2 307.781 2.353 20 10 DECDLO CCc1nc(C[N@H+](C)Cc2cc3c(cc2O)OC[C@H]3O)cs1 ZINC000768443211 641082205 /nfs/dbraw/zinc/08/22/05/641082205.db2.gz RIXSXXUYHCILGO-CQSZACIVSA-N 1 2 320.414 2.469 20 10 DECDLO CCc1nc(C[N@@H+](C)Cc2cc3c(cc2O)OC[C@H]3O)cs1 ZINC000768443211 641082208 /nfs/dbraw/zinc/08/22/08/641082208.db2.gz RIXSXXUYHCILGO-CQSZACIVSA-N 1 2 320.414 2.469 20 10 DECDLO C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1cccc2[nH+]ccn21 ZINC000773745949 641818823 /nfs/dbraw/zinc/81/88/23/641818823.db2.gz RELKJXPUYIVSCP-NSHDSACASA-N 1 2 311.341 2.107 20 10 DECDLO CCOC1CC(O)(C[NH2+][C@@H](C)c2cc(F)cc(F)c2O)C1 ZINC000774487085 641910067 /nfs/dbraw/zinc/91/00/67/641910067.db2.gz KQRRKYBGXVHIMC-IEBVAXJPSA-N 1 2 301.333 2.251 20 10 DECDLO COc1c(O)c(C[N@@H+]2C[C@H](C)O[C@H](C)[C@H]2C)ccc1[N+](=O)[O-] ZINC000775097981 642006104 /nfs/dbraw/zinc/00/61/04/642006104.db2.gz MZYHPYDOKTVONP-HBNTYKKESA-N 1 2 310.350 2.307 20 10 DECDLO COc1c(O)c(C[N@H+]2C[C@H](C)O[C@H](C)[C@H]2C)ccc1[N+](=O)[O-] ZINC000775097981 642006106 /nfs/dbraw/zinc/00/61/06/642006106.db2.gz MZYHPYDOKTVONP-HBNTYKKESA-N 1 2 310.350 2.307 20 10 DECDLO COc1c(O)c(C[N@@H+]2CCc3ncsc3C2)ccc1[N+](=O)[O-] ZINC000775098295 642006758 /nfs/dbraw/zinc/00/67/58/642006758.db2.gz UVMXNRVGGVVULP-UHFFFAOYSA-N 1 2 321.358 2.324 20 10 DECDLO COc1c(O)c(C[N@H+]2CCc3ncsc3C2)ccc1[N+](=O)[O-] ZINC000775098295 642006760 /nfs/dbraw/zinc/00/67/60/642006760.db2.gz UVMXNRVGGVVULP-UHFFFAOYSA-N 1 2 321.358 2.324 20 10 DECDLO CNC(=O)[C@@H]1CCC[C@@H]1[NH2+]Cc1cc(Cl)cc(F)c1O ZINC000776252591 642149343 /nfs/dbraw/zinc/14/93/43/642149343.db2.gz MPJIHJLDHQGBJE-PWSUYJOCSA-N 1 2 300.761 2.189 20 10 DECDLO Cc1ccc(C(=O)N2CCC[C@H](n3cc[nH+]c3)C2)c(O)c1O ZINC000780929497 642690900 /nfs/dbraw/zinc/69/09/00/642690900.db2.gz SBBNBQPGJUCPOB-LBPRGKRZSA-N 1 2 301.346 2.080 20 10 DECDLO CN(C)c1ccc(C[NH2+]Cc2cnn(C)n2)c(C(F)(F)F)c1 ZINC000808417678 643907039 /nfs/dbraw/zinc/90/70/39/643907039.db2.gz AEGSICBJHFWZFD-UHFFFAOYSA-N 1 2 313.327 2.190 20 10 DECDLO CC(C)C[C@H](C(=O)NCc1ccc(O)cc1O)n1cc[nH+]c1 ZINC000910942547 645598139 /nfs/dbraw/zinc/59/81/39/645598139.db2.gz FEPRMBORZMMZGP-CQSZACIVSA-N 1 2 303.362 2.198 20 10 DECDLO COc1ccc(C[NH2+]Cc2ncc(CN(C)C)s2)c(O)c1 ZINC000809658011 646259717 /nfs/dbraw/zinc/25/97/17/646259717.db2.gz ALCSRSPYYSTQHK-UHFFFAOYSA-N 1 2 307.419 2.209 20 10 DECDLO C[C@@H]([NH2+][C@H]1CCc2[nH+]c[nH]c2C1)c1cc([N+](=O)[O-])ccc1[O-] ZINC000810253845 646345530 /nfs/dbraw/zinc/34/55/30/646345530.db2.gz DYHRNPVIHQHPBU-ZJUUUORDSA-N 1 2 302.334 2.232 20 10 DECDLO CCc1nnc(C[NH2+][C@@H](C)c2cc(C(=O)OC)ccc2O)s1 ZINC000810260549 646345544 /nfs/dbraw/zinc/34/55/44/646345544.db2.gz LSBQJHIEIVPLMR-VIFPVBQESA-N 1 2 321.402 2.444 20 10 DECDLO Cc1cc(N(C)C)ccc1CNc1cc(NC[C@H](C)O)[nH+]cn1 ZINC000840264876 646690882 /nfs/dbraw/zinc/69/08/82/646690882.db2.gz ZXARVUXVNFUFPK-ZDUSSCGKSA-N 1 2 315.421 2.256 20 10 DECDLO Cc1cc(N(C)C)ccc1CNc1cc(NC[C@H](C)O)nc[nH+]1 ZINC000840264876 646690887 /nfs/dbraw/zinc/69/08/87/646690887.db2.gz ZXARVUXVNFUFPK-ZDUSSCGKSA-N 1 2 315.421 2.256 20 10 DECDLO Cc1cc(C[N@@H+]2CCO[C@H](C(=O)C3CC3)C2)ccc1N(C)C ZINC000815094360 646967744 /nfs/dbraw/zinc/96/77/44/646967744.db2.gz JZEODRYOTPZZHO-KRWDZBQOSA-N 1 2 302.418 2.241 20 10 DECDLO Cc1cc(C[N@H+]2CCO[C@H](C(=O)C3CC3)C2)ccc1N(C)C ZINC000815094360 646967746 /nfs/dbraw/zinc/96/77/46/646967746.db2.gz JZEODRYOTPZZHO-KRWDZBQOSA-N 1 2 302.418 2.241 20 10 DECDLO COCCN1CCC[C@@H]1C[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000816546516 647150063 /nfs/dbraw/zinc/15/00/63/647150063.db2.gz MNDOOMWOOUKNPS-GFCCVEGCSA-N 1 2 316.804 2.385 20 10 DECDLO O=C1NCC2(C[NH+](Cc3cc(-c4ccccc4)ccc3O)C2)O1 ZINC000817416939 647290315 /nfs/dbraw/zinc/29/03/15/647290315.db2.gz HAMKNTSIDNQUBD-UHFFFAOYSA-N 1 2 310.353 2.353 20 10 DECDLO O=[N+]([O-])c1cc(Cl)cc(C[NH+]2CCC3(CC[NH2+]3)CC2)c1[O-] ZINC000817866053 647369473 /nfs/dbraw/zinc/36/94/73/647369473.db2.gz UTXQEMQYPPTSLL-UHFFFAOYSA-N 1 2 311.769 2.282 20 10 DECDLO C[C@H](Cn1cc[nH+]c1)NC(=O)NCc1cc(Cl)ccc1O ZINC000844281701 651103993 /nfs/dbraw/zinc/10/39/93/651103993.db2.gz OZDKFXNPFJVOBY-SNVBAGLBSA-N 1 2 308.769 2.130 20 10 DECDLO CS(=O)(=O)C1CC[NH+](Cc2cc(Cl)ccc2O)CC1 ZINC000381748573 685402204 /nfs/dbraw/zinc/40/22/04/685402204.db2.gz QVFSAYHIWQEFEN-UHFFFAOYSA-N 1 2 303.811 2.055 20 10 DECDLO CC(=O)c1cc(Cl)cc(C[N@@H+]2CCSC[C@@H]2CO)c1O ZINC000388336105 685428151 /nfs/dbraw/zinc/42/81/51/685428151.db2.gz HBFVDZPMNMKVCM-LBPRGKRZSA-N 1 2 315.822 2.158 20 10 DECDLO CC(=O)c1cc(Cl)cc(C[N@H+]2CCSC[C@@H]2CO)c1O ZINC000388336105 685428155 /nfs/dbraw/zinc/42/81/55/685428155.db2.gz HBFVDZPMNMKVCM-LBPRGKRZSA-N 1 2 315.822 2.158 20 10 DECDLO CN(C)c1cc(F)c(C[N@@H+]2CCC[C@H]2C(=O)NC2CC2)cc1F ZINC000862223487 686258253 /nfs/dbraw/zinc/25/82/53/686258253.db2.gz QGNATOYBCBWNRD-HNNXBMFYSA-N 1 2 323.387 2.274 20 10 DECDLO CN(C)c1cc(F)c(C[N@H+]2CCC[C@H]2C(=O)NC2CC2)cc1F ZINC000862223487 686258256 /nfs/dbraw/zinc/25/82/56/686258256.db2.gz QGNATOYBCBWNRD-HNNXBMFYSA-N 1 2 323.387 2.274 20 10 DECDLO O=C1OCCN1C1CC[NH+](Cc2ccc(F)c(F)c2O)CC1 ZINC000864049498 686605805 /nfs/dbraw/zinc/60/58/05/686605805.db2.gz HWUVZQDFOXUWJI-UHFFFAOYSA-N 1 2 312.316 2.087 20 10 DECDLO O=C(C1=CC(=O)CS1)N1CC2(C1)C[NH+](Cc1ccccc1)C2 ZINC000869814168 688409581 /nfs/dbraw/zinc/40/95/81/688409581.db2.gz GPXLTUWFWUPQLK-UHFFFAOYSA-N 1 2 314.410 2.412 20 10 DECDLO Cc1nonc1C[NH2+][C@@H](C)c1ccc(N2CCOCC2)c(F)c1 ZINC000872135726 688933769 /nfs/dbraw/zinc/93/37/69/688933769.db2.gz IJRYSUJAWPMQLC-NSHDSACASA-N 1 2 320.368 2.205 20 10 DECDLO CCOC(=O)[C@@H]([NH2+]Cc1ccc(C)cc1O)[C@H]1CCCOC1 ZINC000877468211 690122314 /nfs/dbraw/zinc/12/23/14/690122314.db2.gz BOEPUBDQLHWSQL-HOCLYGCPSA-N 1 2 307.390 2.149 20 10 DECDLO O=C1CCCN1C[C@@H]1CC[N@@H+](Cc2ccc(F)c(F)c2O)C1 ZINC000877638955 690175391 /nfs/dbraw/zinc/17/53/91/690175391.db2.gz TZXUSCMKOVHSKY-LLVKDONJSA-N 1 2 310.344 2.115 20 10 DECDLO O=C1CCCN1C[C@@H]1CC[N@H+](Cc2ccc(F)c(F)c2O)C1 ZINC000877638955 690175392 /nfs/dbraw/zinc/17/53/92/690175392.db2.gz TZXUSCMKOVHSKY-LLVKDONJSA-N 1 2 310.344 2.115 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@H+]2CC[C@H]3[C@@H]2CCCN3C)c1O ZINC000880129750 690809037 /nfs/dbraw/zinc/80/90/37/690809037.db2.gz AIEZMPPJDNQSQT-HOTGVXAUSA-N 1 2 306.381 2.402 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@@H+]2CC[C@H]3[C@@H]2CCCN3C)c1O ZINC000880129750 690809040 /nfs/dbraw/zinc/80/90/40/690809040.db2.gz AIEZMPPJDNQSQT-HOTGVXAUSA-N 1 2 306.381 2.402 20 10 DECDLO C[C@@H]([NH2+]Cc1ccc(N2CCC(O)CC2)cc1)c1ncco1 ZINC000886272553 692041866 /nfs/dbraw/zinc/04/18/66/692041866.db2.gz TZPNHCVOXGMCIK-CYBMUJFWSA-N 1 2 301.390 2.487 20 10 DECDLO C[C@H]([NH2+][C@@H]1CCc2nnn(C)c2C1)c1cc(F)cc(F)c1O ZINC000927148955 693560907 /nfs/dbraw/zinc/56/09/07/693560907.db2.gz YXRMCJFTKZXKBS-WCBMZHEXSA-N 1 2 308.332 2.007 20 10 DECDLO Oc1ccc(C(F)(F)F)cc1CN1CC[NH2+]CC(F)(F)C1 ZINC001211347816 777037023 /nfs/dbraw/zinc/03/70/23/777037023.db2.gz UDLLFCYVLKGZLJ-UHFFFAOYSA-N 1 2 310.266 2.452 20 10 DECDLO C[C@@H]1C[C@@H](O)C[N@@H+]1Cc1cc(Br)c(F)cc1O ZINC001144299510 790848463 /nfs/dbraw/zinc/84/84/63/790848463.db2.gz YWSDSZCINKGSCC-VXNVDRBHSA-N 1 2 304.159 2.249 20 10 DECDLO C[C@@H]1C[C@@H](O)C[N@H+]1Cc1cc(Br)c(F)cc1O ZINC001144299510 790848480 /nfs/dbraw/zinc/84/84/80/790848480.db2.gz YWSDSZCINKGSCC-VXNVDRBHSA-N 1 2 304.159 2.249 20 10 DECDLO C[C@H](C(=O)NCc1cc(Br)ccc1O)n1cc[nH+]c1 ZINC001117460475 795071588 /nfs/dbraw/zinc/07/15/88/795071588.db2.gz WTWRRIMMYBBJAN-SECBINFHSA-N 1 2 324.178 2.229 20 10 DECDLO O=C(CCCn1cc[nH+]c1)Nc1c2nonc2ccc1Cl ZINC001117507913 795078458 /nfs/dbraw/zinc/07/84/58/795078458.db2.gz YTNLCUPWELBUEO-UHFFFAOYSA-N 1 2 305.725 2.492 20 10 DECDLO CCn1cc2c(n1)C[N@@H+](Cc1c(O)cccc1F)C[C@@H]2COC ZINC001137834914 796144382 /nfs/dbraw/zinc/14/43/82/796144382.db2.gz YIDYOUOZLMNBOQ-GFCCVEGCSA-N 1 2 319.380 2.494 20 10 DECDLO CCn1cc2c(n1)C[N@H+](Cc1c(O)cccc1F)C[C@@H]2COC ZINC001137834914 796144383 /nfs/dbraw/zinc/14/43/83/796144383.db2.gz YIDYOUOZLMNBOQ-GFCCVEGCSA-N 1 2 319.380 2.494 20 10 DECDLO CCn1ncc2c1[C@@H](COC)C[N@H+](Cc1c(O)cccc1F)C2 ZINC001137834446 796144414 /nfs/dbraw/zinc/14/44/14/796144414.db2.gz HFIZPYWFWHFSKE-CYBMUJFWSA-N 1 2 319.380 2.494 20 10 DECDLO CCn1ncc2c1[C@@H](COC)C[N@@H+](Cc1c(O)cccc1F)C2 ZINC001137834446 796144417 /nfs/dbraw/zinc/14/44/17/796144417.db2.gz HFIZPYWFWHFSKE-CYBMUJFWSA-N 1 2 319.380 2.494 20 10 DECDLO O=C(NC1CC[NH+](Cc2cccc(F)c2O)CC1)C(F)(F)F ZINC001138128714 796167694 /nfs/dbraw/zinc/16/76/94/796167694.db2.gz WEYUNPCSRXBDKU-UHFFFAOYSA-N 1 2 320.286 2.174 20 10 DECDLO COc1ccc(C[N@@H+]2CC[C@@](O)(C(F)(F)F)[C@H](F)C2)c(O)c1 ZINC001203620964 796293822 /nfs/dbraw/zinc/29/38/22/796293822.db2.gz LGTIDXXOVMDTHR-OLZOCXBDSA-N 1 2 323.286 2.238 20 10 DECDLO COc1ccc(C[N@H+]2CC[C@@](O)(C(F)(F)F)[C@H](F)C2)c(O)c1 ZINC001203620964 796293827 /nfs/dbraw/zinc/29/38/27/796293827.db2.gz LGTIDXXOVMDTHR-OLZOCXBDSA-N 1 2 323.286 2.238 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[NH+]1CC2(C1)CCOC2 ZINC001139126570 796328010 /nfs/dbraw/zinc/32/80/10/796328010.db2.gz LBGXEHNUSOUBLX-UHFFFAOYSA-N 1 2 301.342 2.029 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CCC[C@@H](O)CC1 ZINC001139127475 796328602 /nfs/dbraw/zinc/32/86/02/796328602.db2.gz WQSLEKVIWXBTLI-GFCCVEGCSA-N 1 2 303.358 2.154 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CCC[C@@H](O)CC1 ZINC001139127475 796328606 /nfs/dbraw/zinc/32/86/06/796328606.db2.gz WQSLEKVIWXBTLI-GFCCVEGCSA-N 1 2 303.358 2.154 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CCOC(C)(C)C1 ZINC001139127574 796329301 /nfs/dbraw/zinc/32/93/01/796329301.db2.gz YBAALDZFYVTGED-UHFFFAOYSA-N 1 2 303.358 2.418 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CCOC(C)(C)C1 ZINC001139127574 796329305 /nfs/dbraw/zinc/32/93/05/796329305.db2.gz YBAALDZFYVTGED-UHFFFAOYSA-N 1 2 303.358 2.418 20 10 DECDLO Oc1ccc(F)cc1CN1CC([NH+]2CCC(F)(F)CC2)C1 ZINC001140055412 796471522 /nfs/dbraw/zinc/47/15/22/796471522.db2.gz WRAUXBZVOAKWIF-UHFFFAOYSA-N 1 2 300.324 2.447 20 10 DECDLO Oc1cc(F)cc(F)c1C[N@@H+]1CC[C@H](Oc2cnccn2)C1 ZINC001140585450 796541995 /nfs/dbraw/zinc/54/19/95/796541995.db2.gz IZOLORVWSWOSMV-NSHDSACASA-N 1 2 307.300 2.114 20 10 DECDLO Oc1cc(F)cc(F)c1C[N@H+]1CC[C@H](Oc2cnccn2)C1 ZINC001140585450 796542001 /nfs/dbraw/zinc/54/20/01/796542001.db2.gz IZOLORVWSWOSMV-NSHDSACASA-N 1 2 307.300 2.114 20 10 DECDLO Cc1c(O)ccc(C[N@@H+]2CC[C@@](O)(C(F)(F)F)[C@H](F)C2)c1O ZINC001140742224 796565614 /nfs/dbraw/zinc/56/56/14/796565614.db2.gz KRLFRSFHDRJYRB-YPMHNXCESA-N 1 2 323.286 2.243 20 10 DECDLO Cc1c(O)ccc(C[N@H+]2CC[C@@](O)(C(F)(F)F)[C@H](F)C2)c1O ZINC001140742224 796565618 /nfs/dbraw/zinc/56/56/18/796565618.db2.gz KRLFRSFHDRJYRB-YPMHNXCESA-N 1 2 323.286 2.243 20 10 DECDLO COc1ccc(O)c(CN2CC([NH+]3CCC(F)(F)CC3)C2)c1 ZINC001203678657 800105152 /nfs/dbraw/zinc/10/51/52/800105152.db2.gz QDNAAWMVOPFUHO-UHFFFAOYSA-N 1 2 312.360 2.316 20 10 DECDLO COC(=O)c1ccc(C[N@@H+]2CCCc3cc(O)c(O)cc3C2)[nH]1 ZINC001232078386 801787098 /nfs/dbraw/zinc/78/70/98/801787098.db2.gz UYCAEYXHYLBGPL-UHFFFAOYSA-N 1 2 316.357 2.161 20 10 DECDLO COC(=O)c1ccc(C[N@H+]2CCCc3cc(O)c(O)cc3C2)[nH]1 ZINC001232078386 801787102 /nfs/dbraw/zinc/78/71/02/801787102.db2.gz UYCAEYXHYLBGPL-UHFFFAOYSA-N 1 2 316.357 2.161 20 10 DECDLO OC[C@H]1CCC[N@@H+]1Cc1c(O)cc(Br)cc1F ZINC001233027973 802005915 /nfs/dbraw/zinc/00/59/15/802005915.db2.gz HTXMFYNQOHFNJC-SECBINFHSA-N 1 2 304.159 2.251 20 10 DECDLO OC[C@H]1CCC[N@H+]1Cc1c(O)cc(Br)cc1F ZINC001233027973 802005922 /nfs/dbraw/zinc/00/59/22/802005922.db2.gz HTXMFYNQOHFNJC-SECBINFHSA-N 1 2 304.159 2.251 20 10 DECDLO C[C@@H]1CN(Cc2c(O)cc(Br)cc2F)CC[N@@H+]1C ZINC001233032130 802009746 /nfs/dbraw/zinc/00/97/46/802009746.db2.gz VAKYOCXBOCHMAT-SECBINFHSA-N 1 2 317.202 2.430 20 10 DECDLO C[C@@H]1CN(Cc2c(O)cc(Br)cc2F)CC[N@H+]1C ZINC001233032130 802009750 /nfs/dbraw/zinc/00/97/50/802009750.db2.gz VAKYOCXBOCHMAT-SECBINFHSA-N 1 2 317.202 2.430 20 10 DECDLO COC(=O)C1C[NH+](Cc2cc(Br)cc(C)c2O)C1 ZINC001233107103 802027908 /nfs/dbraw/zinc/02/79/08/802027908.db2.gz TVQUQMUBFVJLLP-UHFFFAOYSA-N 1 2 314.179 2.068 20 10 DECDLO CCOC(=O)NC1CC[NH+](Cc2c(O)ccc(F)c2F)CC1 ZINC001233336211 802079062 /nfs/dbraw/zinc/07/90/62/802079062.db2.gz CNKFUVDCTJISPU-UHFFFAOYSA-N 1 2 314.332 2.381 20 10 DECDLO Cc1cc(N(C)C)ccc1CNC(=O)CCc1[nH+]ccn1C ZINC001351213753 1151493774 /nfs/dbraw/zinc/49/37/74/1151493774.db2.gz VDBSSPJSMBWIII-UHFFFAOYSA-N 1 2 300.406 2.044 20 10 DECDLO O=C(N[C@@H](Cn1cc[nH+]c1)c1ccccc1)c1cccc(O)c1O ZINC001636676919 1078486632 /nfs/dbraw/zinc/48/66/32/1078486632.db2.gz LQHHCXVXPKUEOA-HNNXBMFYSA-N 1 2 323.352 2.466 20 10 DECDLO COc1ccccc1[C@@H]([NH3+])C(=O)NCc1cccc(Cl)c1O ZINC001579302455 1067296787 /nfs/dbraw/zinc/29/67/87/1067296787.db2.gz WSCBJLBHJBWIOV-CQSZACIVSA-N 1 2 320.776 2.370 20 10 DECDLO CS(=O)(=O)[C@H]1CCC[N@H+](Cc2cc(F)c(F)cc2O)CC1 ZINC001560783528 1075146288 /nfs/dbraw/zinc/14/62/88/1075146288.db2.gz GZTSVHHARMRREH-NSHDSACASA-N 1 2 319.373 2.070 20 10 DECDLO CS(=O)(=O)[C@H]1CCC[N@@H+](Cc2cc(F)c(F)cc2O)CC1 ZINC001560783528 1075146291 /nfs/dbraw/zinc/14/62/91/1075146291.db2.gz GZTSVHHARMRREH-NSHDSACASA-N 1 2 319.373 2.070 20 10 DECDLO O=C(NCc1ccccc1O)c1cc(-n2cc[nH+]c2)ccc1O ZINC001566374051 1075242026 /nfs/dbraw/zinc/24/20/26/1075242026.db2.gz RPCOSMAYQMTSTB-UHFFFAOYSA-N 1 2 309.325 2.214 20 10 DECDLO C[C@@H]([NH2+]CC[C@@H]1CC1(F)F)c1cccc(-c2nn[nH]n2)c1O ZINC001589962919 1076536732 /nfs/dbraw/zinc/53/67/32/1076536732.db2.gz VFIAUTCVZMGHEW-RKDXNWHRSA-N 1 2 309.320 2.268 20 10 DECDLO CC[C@@H]1C[C@H]([NH2+][C@H](C)c2cccc(-c3nn[nH]n3)c2O)CCO1 ZINC001590504773 1076642399 /nfs/dbraw/zinc/64/23/99/1076642399.db2.gz KZNLOWHIUDYQSG-IJLUTSLNSA-N 1 2 317.393 2.181 20 10 DECDLO CC[C@@H]1C[C@@H]([NH2+][C@H](C)c2cccc(-c3nn[nH]n3)c2O)CCO1 ZINC001590504772 1076642774 /nfs/dbraw/zinc/64/27/74/1076642774.db2.gz KZNLOWHIUDYQSG-GRYCIOLGSA-N 1 2 317.393 2.181 20 10 DECDLO Cc1ncc(C[NH2+][C@@H](C)c2cccc(-c3nn[nH]n3)c2O)s1 ZINC001592411420 1076911110 /nfs/dbraw/zinc/91/11/10/1076911110.db2.gz SGISHDQTPPGNBL-QMMMGPOBSA-N 1 2 316.390 2.188 20 10 DECDLO CC(C)c1ccc(O)c(CN2CC[NH+]([C@H]3CCOC3)CC2)c1 ZINC001665185383 1080998116 /nfs/dbraw/zinc/99/81/16/1080998116.db2.gz HJOFVQRGFIYPMV-KRWDZBQOSA-N 1 2 304.434 2.422 20 10 DECDLO C[N@@H+]1CCC12CN(Cc1ccc(OCC(F)(F)F)cc1O)C2 ZINC001276814643 1083627089 /nfs/dbraw/zinc/62/70/89/1083627089.db2.gz IVELYEGUUGKZDK-UHFFFAOYSA-N 1 2 316.323 2.223 20 10 DECDLO C[N@H+]1CCC12CN(Cc1ccc(OCC(F)(F)F)cc1O)C2 ZINC001276814643 1083627096 /nfs/dbraw/zinc/62/70/96/1083627096.db2.gz IVELYEGUUGKZDK-UHFFFAOYSA-N 1 2 316.323 2.223 20 10 DECDLO Oc1c(Br)cc(Cl)cc1CN1CC[NH2+][C@H]2C[C@H]21 ZINC001235287470 1084374342 /nfs/dbraw/zinc/37/43/42/1084374342.db2.gz CRYVROQFJVSBFS-WDEREUQCSA-N 1 2 317.614 2.354 20 10 DECDLO COc1ccc(C[N@@H+]2CCC[C@]23CCN(C)C3=O)c(O)c1Cl ZINC001274657479 1091356262 /nfs/dbraw/zinc/35/62/62/1091356262.db2.gz YAIBOBZOTVVKJT-MRXNPFEDSA-N 1 2 324.808 2.251 20 10 DECDLO COc1ccc(C[N@H+]2CCC[C@]23CCN(C)C3=O)c(O)c1Cl ZINC001274657479 1091356272 /nfs/dbraw/zinc/35/62/72/1091356272.db2.gz YAIBOBZOTVVKJT-MRXNPFEDSA-N 1 2 324.808 2.251 20 10 DECDLO Oc1cc(Cl)ccc1C[NH+]1CC2(CN(Cc3cn[nH]c3)C2)C1 ZINC001275272523 1091646367 /nfs/dbraw/zinc/64/63/67/1091646367.db2.gz VABPATHNBGNTBC-UHFFFAOYSA-N 1 2 318.808 2.087 20 10 DECDLO C[N@H+]1C[C@H]2CN(Cc3ccc(C(C)(C)C)cc3O)C[C@@H](C1)O2 ZINC001276287411 1091766133 /nfs/dbraw/zinc/76/61/33/1091766133.db2.gz TUXPMCQRVQQZBK-IYBDPMFKSA-N 1 2 304.434 2.205 20 10 DECDLO C[N@@H+]1C[C@H]2CN(Cc3ccc(C(C)(C)C)cc3O)C[C@@H](C1)O2 ZINC001276287411 1091766140 /nfs/dbraw/zinc/76/61/40/1091766140.db2.gz TUXPMCQRVQQZBK-IYBDPMFKSA-N 1 2 304.434 2.205 20 10 DECDLO COc1ccc(C[N@@H+]2CCC[C@@H](n3cncn3)C2)c(O)c1Cl ZINC001236805601 1138432760 /nfs/dbraw/zinc/43/27/60/1138432760.db2.gz ASSDWJJXMQYVLX-GFCCVEGCSA-N 1 2 322.796 2.483 20 10 DECDLO COc1ccc(C[N@H+]2CCC[C@@H](n3cncn3)C2)c(O)c1Cl ZINC001236805601 1138432764 /nfs/dbraw/zinc/43/27/64/1138432764.db2.gz ASSDWJJXMQYVLX-GFCCVEGCSA-N 1 2 322.796 2.483 20 10 DECDLO C[C@]1(CO)C[N@H+](Cc2c(O)ccc(Cl)c2Cl)CC[C@@H]1O ZINC001237077301 1138500602 /nfs/dbraw/zinc/50/06/02/1138500602.db2.gz FJDRKJULCWHFGR-GXTWGEPZSA-N 1 2 320.216 2.264 20 10 DECDLO C[C@]1(CO)C[N@@H+](Cc2c(O)ccc(Cl)c2Cl)CC[C@@H]1O ZINC001237077301 1138500610 /nfs/dbraw/zinc/50/06/10/1138500610.db2.gz FJDRKJULCWHFGR-GXTWGEPZSA-N 1 2 320.216 2.264 20 10 DECDLO COC[C@]12COC[C@H]1C[N@H+](Cc1cc(Cl)cc(F)c1O)C2 ZINC001237619072 1138718523 /nfs/dbraw/zinc/71/85/23/1138718523.db2.gz MNPGSDGSELFYCM-IAQYHMDHSA-N 1 2 315.772 2.280 20 10 DECDLO COC[C@]12COC[C@H]1C[N@@H+](Cc1cc(Cl)cc(F)c1O)C2 ZINC001237619072 1138718537 /nfs/dbraw/zinc/71/85/37/1138718537.db2.gz MNPGSDGSELFYCM-IAQYHMDHSA-N 1 2 315.772 2.280 20 10 DECDLO Oc1cc(Cl)c(F)cc1C[NH+]1CCN(c2ccncn2)CC1 ZINC001237949976 1138812170 /nfs/dbraw/zinc/81/21/70/1138812170.db2.gz PRGKLWGDPKQMJE-UHFFFAOYSA-N 1 2 322.771 2.297 20 10 DECDLO OC[C@@H](c1nnc(-c2ccc(-n3cccc3)cc2)o1)n1cc[nH+]c1 ZINC001256956861 1143876664 /nfs/dbraw/zinc/87/66/64/1143876664.db2.gz ATNPGPDABZGVLA-HNNXBMFYSA-N 1 2 321.340 2.306 20 10 DECDLO CCOc1ccc(N2CC[NH+](CCN(C#N)CC)CC2)cc1 ZINC001262013552 1144285985 /nfs/dbraw/zinc/28/59/85/1144285985.db2.gz GEXBSIQQTFULEL-UHFFFAOYSA-N 1 2 302.422 2.010 20 10 DECDLO CC(C)C[C@H](C[NH3+])[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001325321376 1147892492 /nfs/dbraw/zinc/89/24/92/1147892492.db2.gz VWZWDEYXDGUPAZ-MRXNPFEDSA-N 1 2 322.472 2.041 20 10 DECDLO CN(C)c1ccc2c(c1)OCCN2C(=O)CCCn1cc[nH+]c1 ZINC000608250451 361188282 /nfs/dbraw/zinc/18/82/82/361188282.db2.gz HEDPGTRZTAXTHN-UHFFFAOYSA-N 1 2 314.389 2.155 20 10 DECDLO COC(=O)[C@@H]([NH2+]Cc1cc(Cl)cc(C(C)=O)c1O)C1CC1 ZINC000285169729 131144459 /nfs/dbraw/zinc/14/44/59/131144459.db2.gz VBAJAPRSKUYEST-ZDUSSCGKSA-N 1 2 311.765 2.289 20 10 DECDLO Oc1cc(F)c(Cl)cc1C[NH2+]CCCO[C@H]1CCOC1 ZINC000293734736 131763488 /nfs/dbraw/zinc/76/34/88/131763488.db2.gz WRUMOEAAKOSFEF-NSHDSACASA-N 1 2 303.761 2.470 20 10 DECDLO CN(C)c1ccc(C[N@@H+]2CC(=O)N[C@H]3CCCC[C@@H]32)cc1F ZINC000123591103 402136463 /nfs/dbraw/zinc/13/64/63/402136463.db2.gz GDZKPQCQFAJLCY-HOCLYGCPSA-N 1 2 305.397 2.135 20 10 DECDLO CN(C)c1ccc(C[N@H+]2CC(=O)N[C@H]3CCCC[C@@H]32)cc1F ZINC000123591103 402136466 /nfs/dbraw/zinc/13/64/66/402136466.db2.gz GDZKPQCQFAJLCY-HOCLYGCPSA-N 1 2 305.397 2.135 20 10 DECDLO C[C@H]1CCNC(=O)[C@@H]1[NH2+]Cc1cc(Cl)cc(Cl)c1O ZINC000193700553 402775830 /nfs/dbraw/zinc/77/58/30/402775830.db2.gz VJGXZDILKXXHMT-WRWORJQWSA-N 1 2 303.189 2.313 20 10 DECDLO COc1c(O)c(C[NH2+][C@@H](CCO)c2ccco2)ccc1[N+](=O)[O-] ZINC000278292601 402862395 /nfs/dbraw/zinc/86/23/95/402862395.db2.gz BVDZDIMAHLSCMP-NSHDSACASA-N 1 2 322.317 2.115 20 10 DECDLO COc1c(O)c(CNc2ccc(N(C)C)c[nH+]2)ccc1[N+](=O)[O-] ZINC000278528048 402867315 /nfs/dbraw/zinc/86/73/15/402867315.db2.gz UGDVNRZJSSWLKD-UHFFFAOYSA-N 1 2 318.333 2.382 20 10 DECDLO CC[N@@H+](CC(=O)OC)Cc1cc(Br)cc(C)c1O ZINC000271735378 402883575 /nfs/dbraw/zinc/88/35/75/402883575.db2.gz OMBUPXDVAVCSLU-UHFFFAOYSA-N 1 2 316.195 2.458 20 10 DECDLO CCOC(=O)[C@@H](C)[N@H+](Cc1cc(OC)c(OC)cc1O)C1CC1 ZINC000276147111 403149123 /nfs/dbraw/zinc/14/91/23/403149123.db2.gz FUBLOSQGHBPZHG-LLVKDONJSA-N 1 2 323.389 2.325 20 10 DECDLO CCOC(=O)[C@@H](C)[N@@H+](Cc1cc(OC)c(OC)cc1O)C1CC1 ZINC000276147111 403149125 /nfs/dbraw/zinc/14/91/25/403149125.db2.gz FUBLOSQGHBPZHG-LLVKDONJSA-N 1 2 323.389 2.325 20 10 DECDLO Oc1cc(F)c(Cl)cc1C[NH+]1CCN(c2cnccn2)CC1 ZINC000295425102 403916361 /nfs/dbraw/zinc/91/63/61/403916361.db2.gz SPGTUIPVFPVVPO-UHFFFAOYSA-N 1 2 322.771 2.297 20 10 DECDLO C[C@H]1C[N@H+](Cc2c(O)ccc(Cl)c2F)CC[S@@](=O)C1 ZINC000365446207 404663190 /nfs/dbraw/zinc/66/31/90/404663190.db2.gz HKFIVWIKUXAVBY-ZRNGKTOUSA-N 1 2 305.802 2.385 20 10 DECDLO C[C@H]1C[N@@H+](Cc2c(O)ccc(Cl)c2F)CC[S@@](=O)C1 ZINC000365446207 404663194 /nfs/dbraw/zinc/66/31/94/404663194.db2.gz HKFIVWIKUXAVBY-ZRNGKTOUSA-N 1 2 305.802 2.385 20 10 DECDLO COCC[C@@H]1COCC[N@@H+]1Cc1c(O)ccc(Cl)c1F ZINC000365795375 404721730 /nfs/dbraw/zinc/72/17/30/404721730.db2.gz AQUUWBKBVXQXCC-SNVBAGLBSA-N 1 2 303.761 2.422 20 10 DECDLO COCC[C@@H]1COCC[N@H+]1Cc1c(O)ccc(Cl)c1F ZINC000365795375 404721732 /nfs/dbraw/zinc/72/17/32/404721732.db2.gz AQUUWBKBVXQXCC-SNVBAGLBSA-N 1 2 303.761 2.422 20 10 DECDLO CN(C)c1ccc(C[N@@H+]2CCO[C@H]([C@@H]3CCCO3)C2)cc1F ZINC000367546202 405079626 /nfs/dbraw/zinc/07/96/26/405079626.db2.gz DRXFEPWLICLCBE-IRXDYDNUSA-N 1 2 308.397 2.272 20 10 DECDLO CN(C)c1ccc(C[N@H+]2CCO[C@H]([C@@H]3CCCO3)C2)cc1F ZINC000367546202 405079632 /nfs/dbraw/zinc/07/96/32/405079632.db2.gz DRXFEPWLICLCBE-IRXDYDNUSA-N 1 2 308.397 2.272 20 10 DECDLO CCC[C@@H]1C(=O)NCC[N@H+]1C/C=C\c1ccc(N(C)C)cc1 ZINC000835028041 649868480 /nfs/dbraw/zinc/86/84/80/649868480.db2.gz IRBRESNNHOOHHF-XTKXOIQPSA-N 1 2 301.434 2.366 20 10 DECDLO CCC[C@@H]1C(=O)NCC[N@@H+]1C/C=C\c1ccc(N(C)C)cc1 ZINC000835028041 649868482 /nfs/dbraw/zinc/86/84/82/649868482.db2.gz IRBRESNNHOOHHF-XTKXOIQPSA-N 1 2 301.434 2.366 20 10 DECDLO CCN1CCC[N@H+](Cc2cc(Cl)cc(C(C)=O)c2O)CC1=O ZINC000190198164 521612396 /nfs/dbraw/zinc/61/23/96/521612396.db2.gz ZJXRZOWZHYQSND-UHFFFAOYSA-N 1 2 324.808 2.302 20 10 DECDLO CCN1CCC[N@@H+](Cc2cc(Cl)cc(C(C)=O)c2O)CC1=O ZINC000190198164 521612399 /nfs/dbraw/zinc/61/23/99/521612399.db2.gz ZJXRZOWZHYQSND-UHFFFAOYSA-N 1 2 324.808 2.302 20 10 DECDLO COc1cc(N(C)CCCn2cc[nH+]c2)cc(OC)c1OC ZINC000182796469 522618788 /nfs/dbraw/zinc/61/87/88/522618788.db2.gz JWJNIKCSHFURTA-UHFFFAOYSA-N 1 2 305.378 2.435 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@@H+]2CCC[C@@H]2C2OCCO2)c1O ZINC000933905894 624651484 /nfs/dbraw/zinc/65/14/84/624651484.db2.gz VBXMIFPSYKEUSE-CQSZACIVSA-N 1 2 309.337 2.071 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@H+]2CCC[C@@H]2C2OCCO2)c1O ZINC000933905894 624651487 /nfs/dbraw/zinc/65/14/87/624651487.db2.gz VBXMIFPSYKEUSE-CQSZACIVSA-N 1 2 309.337 2.071 20 10 DECDLO Oc1c(F)cc(Br)cc1C[N@H+]1CCC[C@@H](O)C1 ZINC000893872884 636051671 /nfs/dbraw/zinc/05/16/71/636051671.db2.gz XFCBZSISAVXUID-SNVBAGLBSA-N 1 2 304.159 2.251 20 10 DECDLO Oc1c(F)cc(Br)cc1C[N@@H+]1CCC[C@@H](O)C1 ZINC000893872884 636051675 /nfs/dbraw/zinc/05/16/75/636051675.db2.gz XFCBZSISAVXUID-SNVBAGLBSA-N 1 2 304.159 2.251 20 10 DECDLO OC[C@]12C[C@H]1C[N@H+](Cc1cc(Br)cc(F)c1O)C2 ZINC000894534890 637094835 /nfs/dbraw/zinc/09/48/35/637094835.db2.gz RILUEPJMCALLTB-TVQRCGJNSA-N 1 2 316.170 2.108 20 10 DECDLO OC[C@]12C[C@H]1C[N@@H+](Cc1cc(Br)cc(F)c1O)C2 ZINC000894534890 637094840 /nfs/dbraw/zinc/09/48/40/637094840.db2.gz RILUEPJMCALLTB-TVQRCGJNSA-N 1 2 316.170 2.108 20 10 DECDLO CC[C@H](C[NH2+]Cc1cccc(Br)c1O)C(=O)OC ZINC000895120683 637599245 /nfs/dbraw/zinc/59/92/45/637599245.db2.gz QSAWMALHGKEOOL-SECBINFHSA-N 1 2 316.195 2.444 20 10 DECDLO COc1ccc(N2CC[NH+](Cc3cn4cccnc4n3)CC2)cc1 ZINC000004192478 650355082 /nfs/dbraw/zinc/35/50/82/650355082.db2.gz AZVAWPIQLRRPBY-UHFFFAOYSA-N 1 2 323.400 2.060 20 10 DECDLO CC(C)(CN1CCOCC1)[NH2+]Cc1cc(Cl)cc(F)c1O ZINC000840962819 650395884 /nfs/dbraw/zinc/39/58/84/650395884.db2.gz JVHGNDFTVZPTGX-UHFFFAOYSA-N 1 2 316.804 2.385 20 10 DECDLO C[C@@H]([NH2+]Cc1nnnn1-c1ccccc1)c1ccc(F)cc1O ZINC000756492002 639665968 /nfs/dbraw/zinc/66/59/68/639665968.db2.gz YQYDZENVCOPXSQ-LLVKDONJSA-N 1 2 313.336 2.358 20 10 DECDLO COCCN1CC[C@H]([NH2+][C@@H](C)c2cc(F)cc(F)c2O)C1 ZINC000756549754 639672849 /nfs/dbraw/zinc/67/28/49/639672849.db2.gz HFNDBIREWZUFAJ-JQWIXIFHSA-N 1 2 300.349 2.042 20 10 DECDLO COC[C@](C)(CC(=O)OC)[NH2+]Cc1cccc(Cl)c1O ZINC000757922517 639895807 /nfs/dbraw/zinc/89/58/07/639895807.db2.gz CFCFRXAWMROCFE-AWEZNQCLSA-N 1 2 301.770 2.103 20 10 DECDLO Cc1ccc(O)c(CNC(=O)c2cc([C@@H]3CCC[N@H+]3C)n[nH]2)c1 ZINC000899133225 641950225 /nfs/dbraw/zinc/95/02/25/641950225.db2.gz JBMMXNTXZOJGKP-HNNXBMFYSA-N 1 2 314.389 2.120 20 10 DECDLO Cc1ccc(O)c(CNC(=O)c2cc([C@@H]3CCC[N@@H+]3C)n[nH]2)c1 ZINC000899133225 641950227 /nfs/dbraw/zinc/95/02/27/641950227.db2.gz JBMMXNTXZOJGKP-HNNXBMFYSA-N 1 2 314.389 2.120 20 10 DECDLO C[NH+]1CCC([N@H+](CCO)Cc2cc(Cl)cc(F)c2[O-])CC1 ZINC000775634522 642070493 /nfs/dbraw/zinc/07/04/93/642070493.db2.gz STEPLZQRHOFCOY-UHFFFAOYSA-N 1 2 316.804 2.073 20 10 DECDLO C[NH+]1CCC([N@@H+](CCO)Cc2cc(Cl)cc(F)c2[O-])CC1 ZINC000775634522 642070496 /nfs/dbraw/zinc/07/04/96/642070496.db2.gz STEPLZQRHOFCOY-UHFFFAOYSA-N 1 2 316.804 2.073 20 10 DECDLO C[C@@H]1C[C@H]1N1C[C@@H]([NH2+]Cc2cc(Cl)cc(F)c2O)CC1=O ZINC000776221812 642145679 /nfs/dbraw/zinc/14/56/79/642145679.db2.gz ULSYXSZCYCQMET-YDEJPDAXSA-N 1 2 312.772 2.284 20 10 DECDLO COc1ccc(O)c([C@@H](C)NC(=O)[C@H]2CCc3[nH+]ccn3C2)c1 ZINC000787131908 643457202 /nfs/dbraw/zinc/45/72/02/643457202.db2.gz UHFZVMKKLSTCHH-NEPJUHHUSA-N 1 2 315.373 2.037 20 10 DECDLO CCOC(=O)[C@@H]([NH2+]Cc1cccc(C)c1O)[C@@H]1CCCOC1 ZINC000789579022 643750871 /nfs/dbraw/zinc/75/08/71/643750871.db2.gz DSKGNPLVUVCZCE-CABCVRRESA-N 1 2 307.390 2.149 20 10 DECDLO C[N@@H+](Cc1c(O)ccc(Cl)c1F)C[C@H]1CCS(=O)(=O)C1 ZINC000792166958 644082324 /nfs/dbraw/zinc/08/23/24/644082324.db2.gz WNUBLGDOTZYQLN-SECBINFHSA-N 1 2 321.801 2.051 20 10 DECDLO C[N@H+](Cc1c(O)ccc(Cl)c1F)C[C@H]1CCS(=O)(=O)C1 ZINC000792166958 644082330 /nfs/dbraw/zinc/08/23/30/644082330.db2.gz WNUBLGDOTZYQLN-SECBINFHSA-N 1 2 321.801 2.051 20 10 DECDLO CC1(C)CN(Cc2c(O)ccc(Cl)c2F)CC[N@@H+]1CCO ZINC000792179760 644085364 /nfs/dbraw/zinc/08/53/64/644085364.db2.gz MOWNEOCHJMECQE-UHFFFAOYSA-N 1 2 316.804 2.073 20 10 DECDLO CC1(C)CN(Cc2c(O)ccc(Cl)c2F)CC[N@H+]1CCO ZINC000792179760 644085370 /nfs/dbraw/zinc/08/53/70/644085370.db2.gz MOWNEOCHJMECQE-UHFFFAOYSA-N 1 2 316.804 2.073 20 10 DECDLO CCC[N@H+](Cc1cn(CCC(C)=O)nn1)Cc1ccccc1O ZINC000906274591 644184018 /nfs/dbraw/zinc/18/40/18/644184018.db2.gz WKAYSJCPSSAFGI-UHFFFAOYSA-N 1 2 316.405 2.375 20 10 DECDLO CCC[N@@H+](Cc1cn(CCC(C)=O)nn1)Cc1ccccc1O ZINC000906274591 644184022 /nfs/dbraw/zinc/18/40/22/644184022.db2.gz WKAYSJCPSSAFGI-UHFFFAOYSA-N 1 2 316.405 2.375 20 10 DECDLO O=C1N=NCN1C1CC[NH+](Cc2cccc(Cl)c2O)CC1 ZINC000798182622 644980184 /nfs/dbraw/zinc/98/01/84/644980184.db2.gz IHNYRDIPYWXZTO-UHFFFAOYSA-N 1 2 308.769 2.180 20 10 DECDLO NC(=O)[C@H]1CCC[C@@H]([NH2+]Cc2cc(Cl)c(F)cc2O)C1 ZINC000816553542 647151708 /nfs/dbraw/zinc/15/17/08/647151708.db2.gz ZBBRFAQJFQYOAD-WCBMZHEXSA-N 1 2 300.761 2.318 20 10 DECDLO COc1cccnc1C[NH2+]Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000825250101 648730550 /nfs/dbraw/zinc/73/05/50/648730550.db2.gz VACFUGRKKXIGHP-UHFFFAOYSA-N 1 2 319.317 2.002 20 10 DECDLO CC(=O)c1cc(Cl)cc(C[N@@H+]2CC[C@@](O)(C(F)F)C2)c1O ZINC000831175008 649548938 /nfs/dbraw/zinc/54/89/38/649548938.db2.gz CCUULUDYZNUUCI-AWEZNQCLSA-N 1 2 319.735 2.450 20 10 DECDLO CC(=O)c1cc(Cl)cc(C[N@H+]2CC[C@@](O)(C(F)F)C2)c1O ZINC000831175008 649548940 /nfs/dbraw/zinc/54/89/40/649548940.db2.gz CCUULUDYZNUUCI-AWEZNQCLSA-N 1 2 319.735 2.450 20 10 DECDLO COC(=O)[C@@H]1C[N@H+](C/C=C/c2ccc(N(C)C)cc2)C[C@H](C)O1 ZINC000846060410 651305156 /nfs/dbraw/zinc/30/51/56/651305156.db2.gz NDXOMONHQXBWBN-WVBURXTLSA-N 1 2 318.417 2.028 20 10 DECDLO COC(=O)[C@@H]1C[N@@H+](C/C=C/c2ccc(N(C)C)cc2)C[C@H](C)O1 ZINC000846060410 651305158 /nfs/dbraw/zinc/30/51/58/651305158.db2.gz NDXOMONHQXBWBN-WVBURXTLSA-N 1 2 318.417 2.028 20 10 DECDLO C[C@H]([NH2+]Cc1nc([C@H]2CCCO2)n[nH]1)c1cc(F)ccc1O ZINC000848558176 651470659 /nfs/dbraw/zinc/47/06/59/651470659.db2.gz OSBJQFGGHMIWAY-TVQRCGJNSA-N 1 2 306.341 2.352 20 10 DECDLO C[C@@H]([NH2+]C[C@H]1CN(C2CC2)C(=O)O1)c1cc(F)cc(F)c1O ZINC000848572807 651473148 /nfs/dbraw/zinc/47/31/48/651473148.db2.gz VYPYPIUOSHSVJN-KCJUWKMLSA-N 1 2 312.316 2.304 20 10 DECDLO C[C@@H]([NH2+]Cc1c(O)cccc1Br)c1ncnn1C ZINC000858160138 652268983 /nfs/dbraw/zinc/26/89/83/652268983.db2.gz OKBFCRLHBVXAFH-MRVPVSSYSA-N 1 2 311.183 2.134 20 10 DECDLO CC(=O)c1cc(Cl)cc(C[N@@H+]2CCSC[C@H]2CO)c1O ZINC000388336104 685427823 /nfs/dbraw/zinc/42/78/23/685427823.db2.gz HBFVDZPMNMKVCM-GFCCVEGCSA-N 1 2 315.822 2.158 20 10 DECDLO CC(=O)c1cc(Cl)cc(C[N@H+]2CCSC[C@H]2CO)c1O ZINC000388336104 685427827 /nfs/dbraw/zinc/42/78/27/685427827.db2.gz HBFVDZPMNMKVCM-GFCCVEGCSA-N 1 2 315.822 2.158 20 10 DECDLO CN(C)c1cc(F)c(C[N@H+](C)[C@@H]2CCCCNC2=O)cc1F ZINC000862236956 686261282 /nfs/dbraw/zinc/26/12/82/686261282.db2.gz FTANQFKSGKKRAY-CQSZACIVSA-N 1 2 311.376 2.131 20 10 DECDLO CN(C)c1cc(F)c(C[N@@H+](C)[C@@H]2CCCCNC2=O)cc1F ZINC000862236956 686261285 /nfs/dbraw/zinc/26/12/85/686261285.db2.gz FTANQFKSGKKRAY-CQSZACIVSA-N 1 2 311.376 2.131 20 10 DECDLO CCOC(=O)/C=C\C[NH+]1CCN(c2ccc(OC)c(F)c2)CC1 ZINC000929823933 694035753 /nfs/dbraw/zinc/03/57/53/694035753.db2.gz VGNZPHZGVZWYEW-PLNGDYQASA-N 1 2 322.380 2.076 20 10 DECDLO C[C@H]1OCC[C@]12C[N@H+](Cc1ccc(F)c(F)c1O)C[C@@H](C)O2 ZINC000877485722 690127831 /nfs/dbraw/zinc/12/78/31/690127831.db2.gz DVZYWNPMBTVJCE-UVWXRNBGSA-N 1 2 313.344 2.439 20 10 DECDLO C[C@H]1OCC[C@]12C[N@@H+](Cc1ccc(F)c(F)c1O)C[C@@H](C)O2 ZINC000877485722 690127833 /nfs/dbraw/zinc/12/78/33/690127833.db2.gz DVZYWNPMBTVJCE-UVWXRNBGSA-N 1 2 313.344 2.439 20 10 DECDLO COCCO[C@H]1CCC[N@H+](Cc2ccc(F)c(F)c2O)C1 ZINC000877502651 690133492 /nfs/dbraw/zinc/13/34/92/690133492.db2.gz OZVUILCHDFMMPN-LBPRGKRZSA-N 1 2 301.333 2.298 20 10 DECDLO COCCO[C@H]1CCC[N@@H+](Cc2ccc(F)c(F)c2O)C1 ZINC000877502651 690133493 /nfs/dbraw/zinc/13/34/93/690133493.db2.gz OZVUILCHDFMMPN-LBPRGKRZSA-N 1 2 301.333 2.298 20 10 DECDLO CNC(=O)OC[C@H]1CCCC[N@@H+]1Cc1ccc(F)c(F)c1O ZINC000877533829 690143769 /nfs/dbraw/zinc/14/37/69/690143769.db2.gz XEPVNBLIQZWNNX-LLVKDONJSA-N 1 2 314.332 2.381 20 10 DECDLO CNC(=O)OC[C@H]1CCCC[N@H+]1Cc1ccc(F)c(F)c1O ZINC000877533829 690143771 /nfs/dbraw/zinc/14/37/71/690143771.db2.gz XEPVNBLIQZWNNX-LLVKDONJSA-N 1 2 314.332 2.381 20 10 DECDLO O=C1NCCC12CC[NH+](Cc1cc(Cl)cc(F)c1O)CC2 ZINC000877782638 690226733 /nfs/dbraw/zinc/22/67/33/690226733.db2.gz HBAJNBARZHQAHJ-UHFFFAOYSA-N 1 2 312.772 2.287 20 10 DECDLO C[C@@H]1CN(CCC[NH2+]Cc2cc(F)cc(F)c2O)C[C@@H](C)O1 ZINC000882882108 691378244 /nfs/dbraw/zinc/37/82/44/691378244.db2.gz UMEDKXMBYRZTHZ-VXGBXAGGSA-N 1 2 314.376 2.259 20 10 DECDLO CN(C)C1(C[NH2+]Cc2cc(Br)cc(F)c2O)CC1 ZINC000715770971 792510836 /nfs/dbraw/zinc/51/08/36/792510836.db2.gz QPSCEWDNDSRBDC-UHFFFAOYSA-N 1 2 317.202 2.478 20 10 DECDLO O=C(CCc1ccc(O)c(O)c1)NCc1c[nH+]cn1C1CCC1 ZINC001182157023 795615332 /nfs/dbraw/zinc/61/53/32/795615332.db2.gz FDZSTVUZBWTATE-UHFFFAOYSA-N 1 2 315.373 2.268 20 10 DECDLO CCN(CC)c1ccc(C[N@@H+]2CCn3nncc3C2)c(OC)c1 ZINC001138388955 796211314 /nfs/dbraw/zinc/21/13/14/796211314.db2.gz CIHBWSUITYXIJZ-UHFFFAOYSA-N 1 2 315.421 2.149 20 10 DECDLO CCN(CC)c1ccc(C[N@H+]2CCn3nncc3C2)c(OC)c1 ZINC001138388955 796211317 /nfs/dbraw/zinc/21/13/17/796211317.db2.gz CIHBWSUITYXIJZ-UHFFFAOYSA-N 1 2 315.421 2.149 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CC[C@@H](C)[C@@](C)(O)C1 ZINC001139126878 796327472 /nfs/dbraw/zinc/32/74/72/796327472.db2.gz SUKQKNWUYGJYMS-XIKOKIGWSA-N 1 2 317.385 2.400 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CC[C@@H](C)[C@@](C)(O)C1 ZINC001139126878 796327479 /nfs/dbraw/zinc/32/74/79/796327479.db2.gz SUKQKNWUYGJYMS-XIKOKIGWSA-N 1 2 317.385 2.400 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CC[C@@H](C)[C@H](O)C1 ZINC001139126684 796328320 /nfs/dbraw/zinc/32/83/20/796328320.db2.gz MQIFTXDOLOVNEC-MEBBXXQBSA-N 1 2 303.358 2.010 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CC[C@@H](C)[C@H](O)C1 ZINC001139126684 796328322 /nfs/dbraw/zinc/32/83/22/796328322.db2.gz MQIFTXDOLOVNEC-MEBBXXQBSA-N 1 2 303.358 2.010 20 10 DECDLO O=C(NC1CC[NH+](Cc2cc(F)ccc2O)CC1)C(F)(F)F ZINC001140054982 796471563 /nfs/dbraw/zinc/47/15/63/796471563.db2.gz CJYPOJHOGJCXEH-UHFFFAOYSA-N 1 2 320.286 2.174 20 10 DECDLO COC[C@@H]1Cn2ccnc2C[N@H+](Cc2cc(F)ccc2O)C1 ZINC001140063694 796472157 /nfs/dbraw/zinc/47/21/57/796472157.db2.gz WEQSGCYYTDCRNM-LBPRGKRZSA-N 1 2 305.353 2.006 20 10 DECDLO COC[C@@H]1Cn2ccnc2C[N@@H+](Cc2cc(F)ccc2O)C1 ZINC001140063694 796472160 /nfs/dbraw/zinc/47/21/60/796472160.db2.gz WEQSGCYYTDCRNM-LBPRGKRZSA-N 1 2 305.353 2.006 20 10 DECDLO O=C(NCc1[nH+]cn2ccccc12)c1cc(O)c(O)c(Cl)c1 ZINC001193633651 797597786 /nfs/dbraw/zinc/59/77/86/797597786.db2.gz CXKLCYWSWQCCIA-UHFFFAOYSA-N 1 2 317.732 2.329 20 10 DECDLO Oc1ccc(C[NH+]2CCN(c3ccc(Cl)cn3)CC2)cc1O ZINC001203880025 800139733 /nfs/dbraw/zinc/13/97/33/800139733.db2.gz MHOVGGZZUNOMTK-UHFFFAOYSA-N 1 2 319.792 2.468 20 10 DECDLO COc1cc(C[N@@H+]2CCc3c(O)cccc3C2)cc(O)c1O ZINC001204341340 800206488 /nfs/dbraw/zinc/20/64/88/800206488.db2.gz ABYQCHQSXUZFAR-UHFFFAOYSA-N 1 2 301.342 2.370 20 10 DECDLO COc1cc(C[N@H+]2CCc3c(O)cccc3C2)cc(O)c1O ZINC001204341340 800206489 /nfs/dbraw/zinc/20/64/89/800206489.db2.gz ABYQCHQSXUZFAR-UHFFFAOYSA-N 1 2 301.342 2.370 20 10 DECDLO COc1cc(C[N@@H+]2CCC[C@@H]2c2cnccn2)cc(O)c1O ZINC001204344303 800207384 /nfs/dbraw/zinc/20/73/84/800207384.db2.gz FZARSTPWNAAMAY-CYBMUJFWSA-N 1 2 301.346 2.234 20 10 DECDLO COc1cc(C[N@H+]2CCC[C@@H]2c2cnccn2)cc(O)c1O ZINC001204344303 800207386 /nfs/dbraw/zinc/20/73/86/800207386.db2.gz FZARSTPWNAAMAY-CYBMUJFWSA-N 1 2 301.346 2.234 20 10 DECDLO CCOC(=O)CC[N@@H+]1CCc2c(c3cc(OC)ccc3n2C)C1 ZINC001209037602 801118511 /nfs/dbraw/zinc/11/85/11/801118511.db2.gz UUORAMCFYZJKRT-UHFFFAOYSA-N 1 2 316.401 2.498 20 10 DECDLO CCOC(=O)CC[N@H+]1CCc2c(c3cc(OC)ccc3n2C)C1 ZINC001209037602 801118512 /nfs/dbraw/zinc/11/85/12/801118512.db2.gz UUORAMCFYZJKRT-UHFFFAOYSA-N 1 2 316.401 2.498 20 10 DECDLO CCOC(=O)c1nc2c(o1)CC[N@H+](Cc1cccc(C)c1O)C2 ZINC001231593908 801692549 /nfs/dbraw/zinc/69/25/49/801692549.db2.gz OEGABOAAVSAPNL-UHFFFAOYSA-N 1 2 316.357 2.424 20 10 DECDLO CCOC(=O)c1nc2c(o1)CC[N@@H+](Cc1cccc(C)c1O)C2 ZINC001231593908 801692552 /nfs/dbraw/zinc/69/25/52/801692552.db2.gz OEGABOAAVSAPNL-UHFFFAOYSA-N 1 2 316.357 2.424 20 10 DECDLO Oc1c(Cl)cccc1C[NH+]1CCN(c2ccncn2)CC1 ZINC001231915073 801749893 /nfs/dbraw/zinc/74/98/93/801749893.db2.gz XJGPFQJUZITYLP-UHFFFAOYSA-N 1 2 304.781 2.158 20 10 DECDLO Oc1cc(Br)cc(F)c1C[N@@H+]1C[C@@H]2COC[C@@H]2C1 ZINC001233027535 802005621 /nfs/dbraw/zinc/00/56/21/802005621.db2.gz BFTCBXIFYFGEPF-DTORHVGOSA-N 1 2 316.170 2.372 20 10 DECDLO COC(=O)NC1C[NH+](Cc2cc(OC)cc(C(C)(C)C)c2O)C1 ZINC001330808094 1149301296 /nfs/dbraw/zinc/30/12/96/1149301296.db2.gz JTTKARAAMWEXMQ-UHFFFAOYSA-N 1 2 322.405 2.239 20 10 DECDLO C[C@H]([NH2+]CC[C@H]1CCSC1)c1cccc(-c2nn[nH]n2)c1O ZINC001603661907 1070030438 /nfs/dbraw/zinc/03/04/38/1070030438.db2.gz DDNMAHXYXQSYKT-QWRGUYRKSA-N 1 2 319.434 2.366 20 10 DECDLO CC[C@@H]([NH2+]C[C@@H]1CCCOC1)c1cccc(-c2nn[nH]n2)c1O ZINC001604056255 1070189372 /nfs/dbraw/zinc/18/93/72/1070189372.db2.gz RLNSFKDYIUOPDM-SMDDNHRTSA-N 1 2 317.393 2.040 20 10 DECDLO NC(=O)[C@H](F)C1CC[NH+](Cc2cc(Cl)cc(F)c2O)CC1 ZINC001474691946 1060916057 /nfs/dbraw/zinc/91/60/57/1060916057.db2.gz XBQYHATXWUEVGE-GFCCVEGCSA-N 1 2 318.751 2.220 20 10 DECDLO CN(C)C(=O)O[C@H]1CCC[N@H+](Cc2cc(F)c(F)cc2O)C1 ZINC001621345428 1078173002 /nfs/dbraw/zinc/17/30/02/1078173002.db2.gz STKWYFRYGGYRAQ-NSHDSACASA-N 1 2 314.332 2.333 20 10 DECDLO CN(C)C(=O)O[C@H]1CCC[N@@H+](Cc2cc(F)c(F)cc2O)C1 ZINC001621345428 1078173003 /nfs/dbraw/zinc/17/30/03/1078173003.db2.gz STKWYFRYGGYRAQ-NSHDSACASA-N 1 2 314.332 2.333 20 10 DECDLO C[C@@H](CO[C@@H]1CCOC1)[NH2+]Cc1cc(Cl)cc(F)c1O ZINC001657545905 1080177153 /nfs/dbraw/zinc/17/71/53/1080177153.db2.gz YQEJKTFPYPZMEF-JOYOIKCWSA-N 1 2 303.761 2.468 20 10 DECDLO O=C(N1CCCC1)N1CC[NH+](Cc2ccc(Cl)cc2O)CC1 ZINC001657630815 1080180661 /nfs/dbraw/zinc/18/06/61/1080180661.db2.gz ZXNHCTVSVABDTL-UHFFFAOYSA-N 1 2 323.824 2.379 20 10 DECDLO C[C@H]1CC[N@H+](Cc2cc(Br)cc(F)c2O)C[C@H]1O ZINC001659120734 1080231635 /nfs/dbraw/zinc/23/16/35/1080231635.db2.gz YQXRKKWWIUOLKW-QPUJVOFHSA-N 1 2 318.186 2.497 20 10 DECDLO C[C@H]1CC[N@@H+](Cc2cc(Br)cc(F)c2O)C[C@H]1O ZINC001659120734 1080231645 /nfs/dbraw/zinc/23/16/45/1080231645.db2.gz YQXRKKWWIUOLKW-QPUJVOFHSA-N 1 2 318.186 2.497 20 10 DECDLO C[N@@H+]1CCC12CN(Cc1ccc3c(c1O)C=CC(C)(C)O3)C2 ZINC001277422840 1083960999 /nfs/dbraw/zinc/96/09/99/1083960999.db2.gz NPUICAJIFPCCTF-UHFFFAOYSA-N 1 2 300.402 2.466 20 10 DECDLO C[N@H+]1CCC12CN(Cc1ccc3c(c1O)C=CC(C)(C)O3)C2 ZINC001277422840 1083961014 /nfs/dbraw/zinc/96/10/14/1083961014.db2.gz NPUICAJIFPCCTF-UHFFFAOYSA-N 1 2 300.402 2.466 20 10 DECDLO C[C@@H]1CN(Cc2cc(F)cc(Br)c2O)CC[N@H+]1C ZINC001235303590 1084379733 /nfs/dbraw/zinc/37/97/33/1084379733.db2.gz OQBNCDYUEULHMU-SECBINFHSA-N 1 2 317.202 2.430 20 10 DECDLO COc1cccnc1N1CC[NH+](Cc2c(O)cccc2F)CC1 ZINC001137840059 1086653955 /nfs/dbraw/zinc/65/39/55/1086653955.db2.gz QJPFXIBPCMBBFJ-UHFFFAOYSA-N 1 2 317.364 2.257 20 10 DECDLO COCC[NH+]1CCN(Cc2cc(Cl)c(Cl)cc2O)CC1 ZINC001236790473 1138428335 /nfs/dbraw/zinc/42/83/35/1138428335.db2.gz OVFOFQDACXMIGM-UHFFFAOYSA-N 1 2 319.232 2.463 20 10 DECDLO COc1ccc(C[N@@H+]2CCC[C@H](n3ccnn3)C2)c(O)c1Cl ZINC001236809296 1138435101 /nfs/dbraw/zinc/43/51/01/1138435101.db2.gz KTQNMUUOLCDQBU-LBPRGKRZSA-N 1 2 322.796 2.483 20 10 DECDLO COc1ccc(C[N@H+]2CCC[C@H](n3ccnn3)C2)c(O)c1Cl ZINC001236809296 1138435109 /nfs/dbraw/zinc/43/51/09/1138435109.db2.gz KTQNMUUOLCDQBU-LBPRGKRZSA-N 1 2 322.796 2.483 20 10 DECDLO COC(=O)C[N@H+](C)Cc1cc(Br)c(C)cc1O ZINC001237680954 1138756742 /nfs/dbraw/zinc/75/67/42/1138756742.db2.gz GBUUSQWIRDYTIJ-UHFFFAOYSA-N 1 2 302.168 2.068 20 10 DECDLO COC(=O)C[N@@H+](C)Cc1cc(Br)c(C)cc1O ZINC001237680954 1138756765 /nfs/dbraw/zinc/75/67/65/1138756765.db2.gz GBUUSQWIRDYTIJ-UHFFFAOYSA-N 1 2 302.168 2.068 20 10 DECDLO CN(C)c1ccc(CNC(=O)C[N@H+](C)CCC(F)(F)F)cc1 ZINC001319534496 1140611058 /nfs/dbraw/zinc/61/10/58/1140611058.db2.gz LTUCUVODYYHMJS-UHFFFAOYSA-N 1 2 317.355 2.253 20 10 DECDLO CN(C)c1ccc(CNC(=O)C[N@@H+](C)CCC(F)(F)F)cc1 ZINC001319534496 1140611062 /nfs/dbraw/zinc/61/10/62/1140611062.db2.gz LTUCUVODYYHMJS-UHFFFAOYSA-N 1 2 317.355 2.253 20 10 DECDLO COc1ccc(N2CC[NH+](C[C@H](O)C(F)(F)F)CC2)c(C)c1 ZINC001250975116 1142359353 /nfs/dbraw/zinc/35/93/53/1142359353.db2.gz RWYMIXLUFDDDNT-AWEZNQCLSA-N 1 2 318.339 2.049 20 10 DECDLO Cc1cccc(C(=O)NCC[NH2+]Cc2cc(F)cc(F)c2O)c1 ZINC001308222417 1147456775 /nfs/dbraw/zinc/45/67/75/1147456775.db2.gz BDMQQTCAONNECO-UHFFFAOYSA-N 1 2 320.339 2.498 20 10 DECDLO CNC(=O)[C@H]1CCCC[N@@H+]1Cc1cc(Cl)cc(C(C)=O)c1O ZINC000194805197 529921351 /nfs/dbraw/zinc/92/13/51/529921351.db2.gz FOZNIIADARKISL-CQSZACIVSA-N 1 2 324.808 2.349 20 10 DECDLO CNC(=O)[C@H]1CCCC[N@H+]1Cc1cc(Cl)cc(C(C)=O)c1O ZINC000194805197 529921352 /nfs/dbraw/zinc/92/13/52/529921352.db2.gz FOZNIIADARKISL-CQSZACIVSA-N 1 2 324.808 2.349 20 10 DECDLO CCc1nnc(C[N@@H+]2CCCN(c3ccc(OC)cc3)CC2)o1 ZINC000052465795 354403817 /nfs/dbraw/zinc/40/38/17/354403817.db2.gz MLHJYOHLAXRBCS-UHFFFAOYSA-N 1 2 316.405 2.353 20 10 DECDLO CCc1nnc(C[N@H+]2CCCN(c3ccc(OC)cc3)CC2)o1 ZINC000052465795 354403825 /nfs/dbraw/zinc/40/38/25/354403825.db2.gz MLHJYOHLAXRBCS-UHFFFAOYSA-N 1 2 316.405 2.353 20 10 DECDLO COC(=O)[C@@H]1C[C@@H](OC)CC[N@@H+]1Cc1cc(Cl)ccc1O ZINC000370365388 533043550 /nfs/dbraw/zinc/04/35/50/533043550.db2.gz FOXYHWYKEXZLSB-STQMWFEESA-N 1 2 313.781 2.198 20 10 DECDLO COC(=O)[C@@H]1C[C@@H](OC)CC[N@H+]1Cc1cc(Cl)ccc1O ZINC000370365388 533043554 /nfs/dbraw/zinc/04/35/54/533043554.db2.gz FOXYHWYKEXZLSB-STQMWFEESA-N 1 2 313.781 2.198 20 10 DECDLO C[C@H]([NH2+]C[C@@](C)(O)C(F)(F)F)c1cc([N+](=O)[O-])ccc1O ZINC000273546781 130134783 /nfs/dbraw/zinc/13/47/83/130134783.db2.gz ZOAPDUGXTKRXKN-WRWORJQWSA-N 1 2 308.256 2.264 20 10 DECDLO C[C@H]([NH2+][C@H]1C[N@@H+](C2CC2)C[C@H]1C)c1cc([N+](=O)[O-])ccc1[O-] ZINC000273568024 130138592 /nfs/dbraw/zinc/13/85/92/130138592.db2.gz KCFJENGABHAMTK-ZETOZRRWSA-N 1 2 305.378 2.434 20 10 DECDLO C[C@H]([NH2+][C@H]1C[N@H+](C2CC2)C[C@H]1C)c1cc([N+](=O)[O-])ccc1[O-] ZINC000273568024 130138595 /nfs/dbraw/zinc/13/85/95/130138595.db2.gz KCFJENGABHAMTK-ZETOZRRWSA-N 1 2 305.378 2.434 20 10 DECDLO C[C@H](CO[C@H]1CCOC1)[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1O ZINC000273612516 130144860 /nfs/dbraw/zinc/14/48/60/130144860.db2.gz WNOMRYQSVSTJCQ-WZRBSPASSA-N 1 2 310.350 2.145 20 10 DECDLO CCC[N@H+](CC(=O)N(C)C)Cc1cc(F)cc(C(C)=O)c1O ZINC000122713062 402091506 /nfs/dbraw/zinc/09/15/06/402091506.db2.gz ATEWUPSFBDNPKN-UHFFFAOYSA-N 1 2 310.369 2.034 20 10 DECDLO CCC[N@@H+](CC(=O)N(C)C)Cc1cc(F)cc(C(C)=O)c1O ZINC000122713062 402091510 /nfs/dbraw/zinc/09/15/10/402091510.db2.gz ATEWUPSFBDNPKN-UHFFFAOYSA-N 1 2 310.369 2.034 20 10 DECDLO Cc1noc(C[N@@H+](Cc2ccccc2O)C[C@H]2CCCO2)n1 ZINC000109761481 402275964 /nfs/dbraw/zinc/27/59/64/402275964.db2.gz LOQZYQTVGTUHSP-CQSZACIVSA-N 1 2 303.362 2.265 20 10 DECDLO Cc1noc(C[N@H+](Cc2ccccc2O)C[C@H]2CCCO2)n1 ZINC000109761481 402275967 /nfs/dbraw/zinc/27/59/67/402275967.db2.gz LOQZYQTVGTUHSP-CQSZACIVSA-N 1 2 303.362 2.265 20 10 DECDLO CC[N@H+](Cc1cccc(Cl)c1O)[C@@H]1CCS(=O)(=O)C1 ZINC000179562416 402594525 /nfs/dbraw/zinc/59/45/25/402594525.db2.gz LHQRUKCLNNSPIW-LLVKDONJSA-N 1 2 303.811 2.055 20 10 DECDLO CC[N@@H+](Cc1cccc(Cl)c1O)[C@@H]1CCS(=O)(=O)C1 ZINC000179562416 402594529 /nfs/dbraw/zinc/59/45/29/402594529.db2.gz LHQRUKCLNNSPIW-LLVKDONJSA-N 1 2 303.811 2.055 20 10 DECDLO O=C1NCC[N@H+](Cc2cc(F)ccc2O)[C@H]1c1ccccc1 ZINC000180014549 402604809 /nfs/dbraw/zinc/60/48/09/402604809.db2.gz UMKXBKULBKQFDT-INIZCTEOSA-N 1 2 300.333 2.204 20 10 DECDLO COc1c(O)c(C[N@@H+]2CCO[C@@H]3CCC[C@H]32)ccc1[N+](=O)[O-] ZINC000278247136 402862409 /nfs/dbraw/zinc/86/24/09/402862409.db2.gz OTKOAGVQTVOMQI-DGCLKSJQSA-N 1 2 308.334 2.062 20 10 DECDLO COc1c(O)c(C[N@H+]2CCO[C@@H]3CCC[C@H]32)ccc1[N+](=O)[O-] ZINC000278247136 402862410 /nfs/dbraw/zinc/86/24/10/402862410.db2.gz OTKOAGVQTVOMQI-DGCLKSJQSA-N 1 2 308.334 2.062 20 10 DECDLO COc1c(O)c(C[N@H+](C)Cc2cccnc2)ccc1[N+](=O)[O-] ZINC000278516089 402867514 /nfs/dbraw/zinc/86/75/14/402867514.db2.gz QYEFIIBWJZHZJH-UHFFFAOYSA-N 1 2 303.318 2.336 20 10 DECDLO COc1c(O)c(C[N@@H+](C)Cc2cccnc2)ccc1[N+](=O)[O-] ZINC000278516089 402867516 /nfs/dbraw/zinc/86/75/16/402867516.db2.gz QYEFIIBWJZHZJH-UHFFFAOYSA-N 1 2 303.318 2.336 20 10 DECDLO CCN(CC)c1ccc(C[NH2+][C@@H](C(N)=O)c2ccccn2)cc1 ZINC000295110343 403763543 /nfs/dbraw/zinc/76/35/43/403763543.db2.gz LOTAZBABVBKLJN-QGZVFWFLSA-N 1 2 312.417 2.244 20 10 DECDLO C[C@@H]([NH2+]C[C@@H]1COCCN1)c1ccc(Cl)c(Cl)c1O ZINC000530228242 335971287 /nfs/dbraw/zinc/97/12/87/335971287.db2.gz ZFIRQHSEUGJKDI-RKDXNWHRSA-N 1 2 305.205 2.338 20 10 DECDLO CCOCCN1CC[NH+](C/C=C/c2ccc(N(C)C)cc2)CC1 ZINC000835025614 649867890 /nfs/dbraw/zinc/86/78/90/649867890.db2.gz LLODVQUOGJEODB-AATRIKPKSA-N 1 2 317.477 2.420 20 10 DECDLO CCN(CC)c1ccc(CNC(=O)Cc2ccc(N)cc2)c[nH+]1 ZINC000236911235 520898961 /nfs/dbraw/zinc/89/89/61/520898961.db2.gz ZUOKMOAWKUCGDB-UHFFFAOYSA-N 1 2 312.417 2.369 20 10 DECDLO CC[N@@H+](Cc1cc(F)cc(C(C)=O)c1O)C[C@H](O)C(F)(F)F ZINC000189525584 521293755 /nfs/dbraw/zinc/29/37/55/521293755.db2.gz JWTUFBZLUNPDOM-LBPRGKRZSA-N 1 2 323.286 2.479 20 10 DECDLO CC[N@H+](Cc1cc(F)cc(C(C)=O)c1O)C[C@H](O)C(F)(F)F ZINC000189525584 521293764 /nfs/dbraw/zinc/29/37/64/521293764.db2.gz JWTUFBZLUNPDOM-LBPRGKRZSA-N 1 2 323.286 2.479 20 10 DECDLO C[C@@H](O)C[NH+]1CCN(Cc2cc(Cl)cc(Cl)c2O)CC1 ZINC000188734523 525796754 /nfs/dbraw/zinc/79/67/54/525796754.db2.gz IUJSLUCPDVDDNA-SNVBAGLBSA-N 1 2 319.232 2.197 20 10 DECDLO CC(=O)N1CCC[N@H+](Cc2c(O)ccc(Cl)c2F)CC1 ZINC000191199092 526561466 /nfs/dbraw/zinc/56/14/66/526561466.db2.gz QQLMZKNWHSADHE-UHFFFAOYSA-N 1 2 300.761 2.239 20 10 DECDLO CC(=O)N1CCC[N@@H+](Cc2c(O)ccc(Cl)c2F)CC1 ZINC000191199092 526561470 /nfs/dbraw/zinc/56/14/70/526561470.db2.gz QQLMZKNWHSADHE-UHFFFAOYSA-N 1 2 300.761 2.239 20 10 DECDLO COc1cc(O)c(C[NH2+]C(C)(C)c2nc(C)no2)cc1OC ZINC000285318611 536856902 /nfs/dbraw/zinc/85/69/02/536856902.db2.gz WWXUKYYQQZPTRX-UHFFFAOYSA-N 1 2 307.350 2.126 20 10 DECDLO O=C(NCc1cccc(Cl)c1O)[C@@H]1CCc2c[nH+]cn2C1 ZINC000890759158 623197414 /nfs/dbraw/zinc/19/74/14/623197414.db2.gz FGQGOSJPGHMFKS-LLVKDONJSA-N 1 2 305.765 2.121 20 10 DECDLO CS(=O)(=O)[C@@H]1CCCC[N@H+](Cc2cc(F)cc(F)c2O)C1 ZINC000894572945 637111909 /nfs/dbraw/zinc/11/19/09/637111909.db2.gz MHJCKHWQRJQLBU-GFCCVEGCSA-N 1 2 319.373 2.070 20 10 DECDLO CS(=O)(=O)[C@@H]1CCCC[N@@H+](Cc2cc(F)cc(F)c2O)C1 ZINC000894572945 637111913 /nfs/dbraw/zinc/11/19/13/637111913.db2.gz MHJCKHWQRJQLBU-GFCCVEGCSA-N 1 2 319.373 2.070 20 10 DECDLO CCn1ncc(C[NH2+]Cc2cccc(Br)c2O)n1 ZINC000839054204 637763947 /nfs/dbraw/zinc/76/39/47/637763947.db2.gz AWGGGMZPFJQITB-UHFFFAOYSA-N 1 2 311.183 2.056 20 10 DECDLO CC[NH+]1CCN(C(=O)c2cc3cc(O)c(O)cc3s2)CC1 ZINC000895430393 638017242 /nfs/dbraw/zinc/01/72/42/638017242.db2.gz DGCMTODTDJHCDN-UHFFFAOYSA-N 1 2 306.387 2.090 20 10 DECDLO Cc1cc(O)c(C[N@@H+]2CCC[C@H](S(C)(=O)=O)C2)c(Cl)c1 ZINC000840938245 650388928 /nfs/dbraw/zinc/38/89/28/650388928.db2.gz AABZUMHGSDSJTG-NSHDSACASA-N 1 2 317.838 2.363 20 10 DECDLO Cc1cc(O)c(C[N@H+]2CCC[C@H](S(C)(=O)=O)C2)c(Cl)c1 ZINC000840938245 650388930 /nfs/dbraw/zinc/38/89/30/650388930.db2.gz AABZUMHGSDSJTG-NSHDSACASA-N 1 2 317.838 2.363 20 10 DECDLO CS(=O)(=O)CC1(C[NH2+]Cc2cccc(Cl)c2O)CCC1 ZINC000840975419 650399039 /nfs/dbraw/zinc/39/90/39/650399039.db2.gz NJVNXUPYSFTMQQ-UHFFFAOYSA-N 1 2 317.838 2.350 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@@H+]2CCCC[C@@H]2C2OCCO2)c1O ZINC000748049483 638503196 /nfs/dbraw/zinc/50/31/96/638503196.db2.gz CTLWTZGCMMAAHA-OAHLLOKOSA-N 1 2 323.364 2.461 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@H+]2CCCC[C@@H]2C2OCCO2)c1O ZINC000748049483 638503202 /nfs/dbraw/zinc/50/32/02/638503202.db2.gz CTLWTZGCMMAAHA-OAHLLOKOSA-N 1 2 323.364 2.461 20 10 DECDLO Cn1cc(C[NH2+]Cc2c(O)cccc2F)c(Br)n1 ZINC000896639017 638621316 /nfs/dbraw/zinc/62/13/16/638621316.db2.gz DCQZFXLCDFUWFG-UHFFFAOYSA-N 1 2 314.158 2.317 20 10 DECDLO C[C@H]([NH2+]CCN1CCO[C@H](C)C1)c1cc(F)cc(F)c1O ZINC000756544440 639671078 /nfs/dbraw/zinc/67/10/78/639671078.db2.gz IKAXNEBHWCNSSW-MNOVXSKESA-N 1 2 300.349 2.042 20 10 DECDLO COCCCN(C)CC[NH2+][C@H](C)c1cc(F)cc(F)c1O ZINC000756613808 639679723 /nfs/dbraw/zinc/67/97/23/639679723.db2.gz RALHZJXOQOMDGE-LLVKDONJSA-N 1 2 302.365 2.289 20 10 DECDLO C[C@@H]([NH2+]Cc1cccc(Cl)c1O)C1CCS(=O)(=O)CC1 ZINC000898219169 641051594 /nfs/dbraw/zinc/05/15/94/641051594.db2.gz WAEUXUMYNPSGIM-SNVBAGLBSA-N 1 2 317.838 2.349 20 10 DECDLO C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cccc2[nH+]ccn21 ZINC000773745947 641819186 /nfs/dbraw/zinc/81/91/86/641819186.db2.gz RELKJXPUYIVSCP-LLVKDONJSA-N 1 2 311.341 2.107 20 10 DECDLO COc1c(O)c(C[N@@H+]2CCOC(C)(C)[C@H]2C)ccc1[N+](=O)[O-] ZINC000774904288 641979012 /nfs/dbraw/zinc/97/90/12/641979012.db2.gz GDRMRLCQPMMUND-SNVBAGLBSA-N 1 2 310.350 2.308 20 10 DECDLO COc1c(O)c(C[N@H+]2CCOC(C)(C)[C@H]2C)ccc1[N+](=O)[O-] ZINC000774904288 641979017 /nfs/dbraw/zinc/97/90/17/641979017.db2.gz GDRMRLCQPMMUND-SNVBAGLBSA-N 1 2 310.350 2.308 20 10 DECDLO Cc1ccc(C(=O)N2CCC[C@@H](n3cc[nH+]c3)C2)c(O)c1O ZINC000780929496 642691014 /nfs/dbraw/zinc/69/10/14/642691014.db2.gz SBBNBQPGJUCPOB-GFCCVEGCSA-N 1 2 301.346 2.080 20 10 DECDLO CC[C@H]([NH2+]CCCc1nnnn1C)c1cccc(Cl)c1O ZINC000903348803 643323251 /nfs/dbraw/zinc/32/32/51/643323251.db2.gz LEHRNLWRPPWLTD-LBPRGKRZSA-N 1 2 309.801 2.243 20 10 DECDLO C[C@H](NC(=O)[C@@H]1CCc2[nH+]ccn2C1)c1ccc(N(C)C)cc1 ZINC000787299542 643478365 /nfs/dbraw/zinc/47/83/65/643478365.db2.gz IZMNPVAVHAFVDO-DZGCQCFKSA-N 1 2 312.417 2.389 20 10 DECDLO CCOC(=O)[C@@H]([NH2+]Cc1cc(C)c(C)cc1O)C1CCOCC1 ZINC000789580810 643751326 /nfs/dbraw/zinc/75/13/26/643751326.db2.gz LNNDVNTYAJHEFS-KRWDZBQOSA-N 1 2 321.417 2.457 20 10 DECDLO C[C@H]([NH2+][C@@H](C)c1cc(F)cc(F)c1O)c1nnnn1C1CC1 ZINC000790758148 643888950 /nfs/dbraw/zinc/88/89/50/643888950.db2.gz XGFGURMEDPOMSG-YUMQZZPRSA-N 1 2 309.320 2.404 20 10 DECDLO CC(C)(C)[C@@H](O)C[C@@H](CO)[NH2+]Cc1cc(Cl)cc(F)c1O ZINC000793608504 644279089 /nfs/dbraw/zinc/27/90/89/644279089.db2.gz JRRFKWVXEKTKTG-AAEUAGOBSA-N 1 2 319.804 2.432 20 10 DECDLO C[C@H]([NH2+]Cc1cccc(Cl)c1O)C1(S(C)(=O)=O)CC1 ZINC000809704334 646266256 /nfs/dbraw/zinc/26/62/56/646266256.db2.gz ZPYHFPWJOKEVJX-VIFPVBQESA-N 1 2 303.811 2.101 20 10 DECDLO Cc1nonc1C[NH2+]Cc1cc(C)cc(Br)c1O ZINC000809745080 646274707 /nfs/dbraw/zinc/27/47/07/646274707.db2.gz LTBPFGZWSHSKNT-UHFFFAOYSA-N 1 2 312.167 2.444 20 10 DECDLO COC(=O)c1cc(C(C)(C)[NH2+]Cc2ccc3c(c2)CCO3)no1 ZINC000810165911 646333247 /nfs/dbraw/zinc/33/32/47/646333247.db2.gz HGYIOSXQYGIIAY-UHFFFAOYSA-N 1 2 316.357 2.421 20 10 DECDLO COCCc1noc(C[N@H+](C)Cc2cc(C)cc(C)c2O)n1 ZINC000164490441 646447895 /nfs/dbraw/zinc/44/78/95/646447895.db2.gz DUTQGKXPEZSWDB-UHFFFAOYSA-N 1 2 305.378 2.213 20 10 DECDLO COCCc1noc(C[N@@H+](C)Cc2cc(C)cc(C)c2O)n1 ZINC000164490441 646447901 /nfs/dbraw/zinc/44/79/01/646447901.db2.gz DUTQGKXPEZSWDB-UHFFFAOYSA-N 1 2 305.378 2.213 20 10 DECDLO CN(C)c1ccc(CNc2[nH+]cnc3c2cnn3C)cc1F ZINC000058545508 646554444 /nfs/dbraw/zinc/55/44/44/646554444.db2.gz JGUMVXQMYXBXGO-UHFFFAOYSA-N 1 2 300.341 2.181 20 10 DECDLO Oc1ccc(CCNc2cc(NCC3CC3)[nH+]cn2)cc1O ZINC000811811085 646580696 /nfs/dbraw/zinc/58/06/96/646580696.db2.gz LAIYORPECRDUQB-UHFFFAOYSA-N 1 2 300.362 2.364 20 10 DECDLO Oc1ccc(CCNc2cc(NCC3CC3)nc[nH+]2)cc1O ZINC000811811085 646580698 /nfs/dbraw/zinc/58/06/98/646580698.db2.gz LAIYORPECRDUQB-UHFFFAOYSA-N 1 2 300.362 2.364 20 10 DECDLO Cn1ccc(CC[NH2+]Cc2cccc(Br)c2O)n1 ZINC000230880494 646750585 /nfs/dbraw/zinc/75/05/85/646750585.db2.gz RGXJZNPVYNCSOK-UHFFFAOYSA-N 1 2 310.195 2.221 20 10 DECDLO NC(=O)[C@@H]1CCC[C@@H]([NH2+]Cc2cc(Cl)c(F)cc2O)C1 ZINC000816553540 647151349 /nfs/dbraw/zinc/15/13/49/647151349.db2.gz ZBBRFAQJFQYOAD-PSASIEDQSA-N 1 2 300.761 2.318 20 10 DECDLO O=C(NCC[N@@H+]1CCc2ccccc2C1)C1=CC(=O)CS1 ZINC000732267708 647554764 /nfs/dbraw/zinc/55/47/64/647554764.db2.gz RTHWTONKCARDMC-UHFFFAOYSA-N 1 2 302.399 2.242 20 10 DECDLO O=C(NCC[N@H+]1CCc2ccccc2C1)C1=CC(=O)CS1 ZINC000732267708 647554767 /nfs/dbraw/zinc/55/47/67/647554767.db2.gz RTHWTONKCARDMC-UHFFFAOYSA-N 1 2 302.399 2.242 20 10 DECDLO C[C@H]1OCC[C@H]1[N@H+](CCO)Cc1cc(Cl)cc(F)c1O ZINC000825129877 648708412 /nfs/dbraw/zinc/70/84/12/648708412.db2.gz HGZYEUBXJYUSIT-NOZJJQNGSA-N 1 2 303.761 2.156 20 10 DECDLO C[C@H]1OCC[C@H]1[N@@H+](CCO)Cc1cc(Cl)cc(F)c1O ZINC000825129877 648708414 /nfs/dbraw/zinc/70/84/14/648708414.db2.gz HGZYEUBXJYUSIT-NOZJJQNGSA-N 1 2 303.761 2.156 20 10 DECDLO COc1cc(C[N@@H+]2CCN(C)C(=O)[C@H]2C)c(O)c(C(C)(C)C)c1 ZINC000825568201 648782319 /nfs/dbraw/zinc/78/23/19/648782319.db2.gz UCEBDQLATSPSDA-GFCCVEGCSA-N 1 2 320.433 2.361 20 10 DECDLO COc1cc(C[N@H+]2CCN(C)C(=O)[C@H]2C)c(O)c(C(C)(C)C)c1 ZINC000825568201 648782324 /nfs/dbraw/zinc/78/23/24/648782324.db2.gz UCEBDQLATSPSDA-GFCCVEGCSA-N 1 2 320.433 2.361 20 10 DECDLO COC(=O)[C@H]1C[C@@H]([NH2+]Cc2cccc(Br)c2O)C1 ZINC000827500527 649043718 /nfs/dbraw/zinc/04/37/18/649043718.db2.gz BZECPESIGWTVST-AOOOYVTPSA-N 1 2 314.179 2.196 20 10 DECDLO CN(C)C(=O)N(C)[C@@H]1CC[N@H+](Cc2cccc(Cl)c2O)C1 ZINC000827545223 649049255 /nfs/dbraw/zinc/04/92/55/649049255.db2.gz XJAGGODUPJCVRN-GFCCVEGCSA-N 1 2 311.813 2.233 20 10 DECDLO CN(C)C(=O)N(C)[C@@H]1CC[N@@H+](Cc2cccc(Cl)c2O)C1 ZINC000827545223 649049259 /nfs/dbraw/zinc/04/92/59/649049259.db2.gz XJAGGODUPJCVRN-GFCCVEGCSA-N 1 2 311.813 2.233 20 10 DECDLO CC[C@@H]1C[N@H+](Cc2ccc([N+](=O)[O-])c(OC)c2O)[C@H](C)CO1 ZINC000846042213 651303862 /nfs/dbraw/zinc/30/38/62/651303862.db2.gz AMCSOEURZPEJDV-ZYHUDNBSSA-N 1 2 310.350 2.308 20 10 DECDLO CC[C@@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])c(OC)c2O)[C@H](C)CO1 ZINC000846042213 651303865 /nfs/dbraw/zinc/30/38/65/651303865.db2.gz AMCSOEURZPEJDV-ZYHUDNBSSA-N 1 2 310.350 2.308 20 10 DECDLO C[C@H]([NH2+]CC[C@@]1(O)CCCOC1)c1cc(F)cc(F)c1O ZINC000846210647 651315403 /nfs/dbraw/zinc/31/54/03/651315403.db2.gz AOLIYYMSMRYYPH-BONVTDFDSA-N 1 2 301.333 2.253 20 10 DECDLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)N(C)Cc1ccc(N(C)C)cc1 ZINC000847304604 651387782 /nfs/dbraw/zinc/38/77/82/651387782.db2.gz WTWUKIDNIUQSIK-ZDUSSCGKSA-N 1 2 300.406 2.313 20 10 DECDLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)N(C)Cc1ccc(N(C)C)cc1 ZINC000847304604 651387784 /nfs/dbraw/zinc/38/77/84/651387784.db2.gz WTWUKIDNIUQSIK-ZDUSSCGKSA-N 1 2 300.406 2.313 20 10 DECDLO Cn1c[nH+]cc1[C@@H]1C[C@H]1C(=O)NCc1cc(Cl)ccc1O ZINC000855022906 651611643 /nfs/dbraw/zinc/61/16/43/651611643.db2.gz MDHHMSCLNAICRX-VXGBXAGGSA-N 1 2 305.765 2.199 20 10 DECDLO COCc1n[nH]c(C[NH2+][C@@H](C)c2cc(Cl)cc(C)c2O)n1 ZINC000850513763 651942846 /nfs/dbraw/zinc/94/28/46/651942846.db2.gz JCNUDUQGPLIMHG-VIFPVBQESA-N 1 2 310.785 2.469 20 10 DECDLO C[C@@H]([NH2+][C@H]1C[C@H](O)C1)c1cc(Br)cc(F)c1O ZINC000850578239 651956444 /nfs/dbraw/zinc/95/64/44/651956444.db2.gz IEEZHZKOBNHZGX-FTLITQJKSA-N 1 2 304.159 2.468 20 10 DECDLO C[C@@H]([NH2+]CC(=O)NCc1ccc(N(C)C)cc1)c1cscn1 ZINC000852418220 652398238 /nfs/dbraw/zinc/39/82/38/652398238.db2.gz RLRSUDGNIZUQLM-GFCCVEGCSA-N 1 2 318.446 2.176 20 10 DECDLO CC1(C)[C@H](O)C[C@H]1[NH2+]Cc1cccc(Br)c1O ZINC000128201587 684169447 /nfs/dbraw/zinc/16/94/47/684169447.db2.gz IRTOGYAZYGITKP-GHMZBOCLSA-N 1 2 300.196 2.404 20 10 DECDLO CN(C)c1ccc(CNC(=O)N(C)CCCn2cc[nH+]c2)cc1 ZINC000134378420 684227826 /nfs/dbraw/zinc/22/78/26/684227826.db2.gz IRVAZOHXIADZLF-UHFFFAOYSA-N 1 2 315.421 2.181 20 10 DECDLO CCN(CC)c1ccc(CNC(=O)Cc2c[nH+]cn2C)cc1F ZINC000188453855 684356907 /nfs/dbraw/zinc/35/69/07/684356907.db2.gz MUASWKMJRWHMHJ-UHFFFAOYSA-N 1 2 318.396 2.264 20 10 DECDLO Cc1nc(C[N@@H+](C)Cc2ccc(N3CCOCC3)cc2)[nH]c1C ZINC000862214153 686255699 /nfs/dbraw/zinc/25/56/99/686255699.db2.gz HWGMGSZYTCLDBC-UHFFFAOYSA-N 1 2 314.433 2.495 20 10 DECDLO Cc1nc(C[N@H+](C)Cc2ccc(N3CCOCC3)cc2)[nH]c1C ZINC000862214153 686255704 /nfs/dbraw/zinc/25/57/04/686255704.db2.gz HWGMGSZYTCLDBC-UHFFFAOYSA-N 1 2 314.433 2.495 20 10 DECDLO Cc1[nH]c(CN(C)Cc2ccc(N3CCOCC3)cc2)[nH+]c1C ZINC000862214153 686255708 /nfs/dbraw/zinc/25/57/08/686255708.db2.gz HWGMGSZYTCLDBC-UHFFFAOYSA-N 1 2 314.433 2.495 20 10 DECDLO CONC(=O)C1CC[NH+](Cc2c(O)ccc(Cl)c2F)CC1 ZINC000877786072 690228315 /nfs/dbraw/zinc/22/83/15/690228315.db2.gz SSQZMRDJIJECJL-UHFFFAOYSA-N 1 2 316.760 2.074 20 10 DECDLO CCOC(=O)c1cc(C[NH2+]Cc2cc(F)cc(F)c2O)on1 ZINC000883197636 691454866 /nfs/dbraw/zinc/45/48/66/691454866.db2.gz PPGQTIQUYXMNNO-UHFFFAOYSA-N 1 2 312.272 2.125 20 10 DECDLO C[C@H]([NH2+]Cc1nnc(C2CCOCC2)[nH]1)c1c(O)cccc1F ZINC000886645192 692145957 /nfs/dbraw/zinc/14/59/57/692145957.db2.gz SPDYCXYBSLHDBW-JTQLQIEISA-N 1 2 320.368 2.394 20 10 DECDLO COc1cccc([C@H](C)[NH2+]Cc2nc(CSC)n[nH]2)c1O ZINC000886759748 692184129 /nfs/dbraw/zinc/18/41/29/692184129.db2.gz OFQHHHWDTACRMU-VIFPVBQESA-N 1 2 308.407 2.233 20 10 DECDLO C[C@@H]([NH2+][C@@H]1CCc2nnn(C)c2C1)c1cc(F)cc(F)c1O ZINC000927148951 693560675 /nfs/dbraw/zinc/56/06/75/693560675.db2.gz YXRMCJFTKZXKBS-PSASIEDQSA-N 1 2 308.332 2.007 20 10 DECDLO C[C@@H]1CN(C2C[NH+](Cc3ccc(Cl)cc3O)C2)C[C@H](C)O1 ZINC001140468380 777201591 /nfs/dbraw/zinc/20/15/91/777201591.db2.gz ISXMOIBGFAJEIF-TXEJJXNPSA-N 1 2 310.825 2.339 20 10 DECDLO Oc1c(F)cc(Br)cc1C[NH2+]C[C@H]1C[C@@H](O)C1 ZINC000715744677 792509507 /nfs/dbraw/zinc/50/95/07/792509507.db2.gz IADLOQLUTWSENO-WKFQBHICSA-N 1 2 304.159 2.154 20 10 DECDLO CC(C)[C@@H](O)C[NH2+]Cc1cc(Br)cc(F)c1O ZINC000715778856 792512023 /nfs/dbraw/zinc/51/20/23/792512023.db2.gz NBXZXCWXGOXKOW-NSHDSACASA-N 1 2 306.175 2.400 20 10 DECDLO COc1ccc(C[N@@H+]2CC[C@@H]([NH3+])[C@H](F)CC2)c([O-])c1Cl ZINC001206201586 793733854 /nfs/dbraw/zinc/73/38/54/793733854.db2.gz XXOHHHZBHMNSPE-GHMZBOCLSA-N 1 2 302.777 2.315 20 10 DECDLO COc1ccc(C[N@H+]2CC[C@@H]([NH3+])[C@H](F)CC2)c([O-])c1Cl ZINC001206201586 793733861 /nfs/dbraw/zinc/73/38/61/793733861.db2.gz XXOHHHZBHMNSPE-GHMZBOCLSA-N 1 2 302.777 2.315 20 10 DECDLO CCOC(=O)[C@@H]1C[N@H+](Cc2ccc(N3CCCC3)cc2)CCO1 ZINC001119959428 795379585 /nfs/dbraw/zinc/37/95/85/795379585.db2.gz KYFJGEBIBCRLGM-KRWDZBQOSA-N 1 2 318.417 2.051 20 10 DECDLO CCOC(=O)[C@@H]1C[N@@H+](Cc2ccc(N3CCCC3)cc2)CCO1 ZINC001119959428 795379593 /nfs/dbraw/zinc/37/95/93/795379593.db2.gz KYFJGEBIBCRLGM-KRWDZBQOSA-N 1 2 318.417 2.051 20 10 DECDLO CO[C@H](C)C1C[NH+](Cc2c(O)ccc3c(C)cc(=O)oc32)C1 ZINC001139132914 796330542 /nfs/dbraw/zinc/33/05/42/796330542.db2.gz CMEMIAQONNKGOJ-LLVKDONJSA-N 1 2 303.358 2.274 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CCOC[C@@H]1C1CC1 ZINC001139133610 796330567 /nfs/dbraw/zinc/33/05/67/796330567.db2.gz JBGBAWMUWDEWDM-OAHLLOKOSA-N 1 2 315.369 2.418 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CCOC[C@@H]1C1CC1 ZINC001139133610 796330571 /nfs/dbraw/zinc/33/05/71/796330571.db2.gz JBGBAWMUWDEWDM-OAHLLOKOSA-N 1 2 315.369 2.418 20 10 DECDLO CCOCc1nnn2c1C[N@H+](Cc1cc(F)ccc1O)CCC2 ZINC001140054411 796471115 /nfs/dbraw/zinc/47/11/15/796471115.db2.gz PRQLIMNAEPOKRA-UHFFFAOYSA-N 1 2 320.368 2.065 20 10 DECDLO CCOCc1nnn2c1C[N@@H+](Cc1cc(F)ccc1O)CCC2 ZINC001140054411 796471120 /nfs/dbraw/zinc/47/11/20/796471120.db2.gz PRQLIMNAEPOKRA-UHFFFAOYSA-N 1 2 320.368 2.065 20 10 DECDLO CCN(CC)c1ccc(C[N@@H+]2CCO[C@H](C(C)=O)C2)c(O)c1 ZINC001140856897 796584086 /nfs/dbraw/zinc/58/40/86/796584086.db2.gz PKWRFKLQNLPWBQ-KRWDZBQOSA-N 1 2 306.406 2.028 20 10 DECDLO CCN(CC)c1ccc(C[N@H+]2CCO[C@H](C(C)=O)C2)c(O)c1 ZINC001140856897 796584089 /nfs/dbraw/zinc/58/40/89/796584089.db2.gz PKWRFKLQNLPWBQ-KRWDZBQOSA-N 1 2 306.406 2.028 20 10 DECDLO C[C@@H]1C(=O)N(C)CC[N@H+]1Cc1cc2c3c(c1)CCCN3CCC2 ZINC001141077835 796633086 /nfs/dbraw/zinc/63/30/86/796633086.db2.gz BRBZCOGBAHMWIL-CQSZACIVSA-N 1 2 313.445 2.048 20 10 DECDLO C[C@@H]1C(=O)N(C)CC[N@@H+]1Cc1cc2c3c(c1)CCCN3CCC2 ZINC001141077835 796633088 /nfs/dbraw/zinc/63/30/88/796633088.db2.gz BRBZCOGBAHMWIL-CQSZACIVSA-N 1 2 313.445 2.048 20 10 DECDLO CN1CCOc2cc(C[N@H+](C)Cc3nnc4ccccn43)ccc21 ZINC001141140756 796638523 /nfs/dbraw/zinc/63/85/23/796638523.db2.gz PAWSIXLICCWOQY-UHFFFAOYSA-N 1 2 323.400 2.190 20 10 DECDLO CN1CCOc2cc(C[N@@H+](C)Cc3nnc4ccccn43)ccc21 ZINC001141140756 796638529 /nfs/dbraw/zinc/63/85/29/796638529.db2.gz PAWSIXLICCWOQY-UHFFFAOYSA-N 1 2 323.400 2.190 20 10 DECDLO CCN(Cc1ccccc1O)c1cc(N2CCOCC2)[nH+]cn1 ZINC001154890356 797634359 /nfs/dbraw/zinc/63/43/59/797634359.db2.gz WUQUKXGZWRBVAQ-UHFFFAOYSA-N 1 2 314.389 2.045 20 10 DECDLO CCN(Cc1ccccc1O)c1cc(N2CCOCC2)nc[nH+]1 ZINC001154890356 797634363 /nfs/dbraw/zinc/63/43/63/797634363.db2.gz WUQUKXGZWRBVAQ-UHFFFAOYSA-N 1 2 314.389 2.045 20 10 DECDLO COc1ccc(C[N@@H+]2C[C@@H]3C[C@H]2[C@H](C(F)(F)F)O3)c(O)c1 ZINC001203628487 800093976 /nfs/dbraw/zinc/09/39/76/800093976.db2.gz ARWTZIHFEBSWQH-GMXVVIOVSA-N 1 2 303.280 2.305 20 10 DECDLO COc1ccc(C[N@H+]2C[C@@H]3C[C@H]2[C@H](C(F)(F)F)O3)c(O)c1 ZINC001203628487 800093986 /nfs/dbraw/zinc/09/39/86/800093986.db2.gz ARWTZIHFEBSWQH-GMXVVIOVSA-N 1 2 303.280 2.305 20 10 DECDLO CN(C)c1ccc(C[NH+]2CC(NC(=O)OC(C)(C)C)C2)cc1 ZINC001203929945 800148053 /nfs/dbraw/zinc/14/80/53/800148053.db2.gz KRFJAZRTLOPFDQ-UHFFFAOYSA-N 1 2 305.422 2.462 20 10 DECDLO CC(C)(C)OC(=O)N1CC[N@H+](Cc2ccc(O)cc2O)[C@@H]2C[C@@H]21 ZINC001204276786 800199372 /nfs/dbraw/zinc/19/93/72/800199372.db2.gz RHJYEMWERDUWAB-KGLIPLIRSA-N 1 2 320.389 2.291 20 10 DECDLO CC(C)(C)OC(=O)N1CC[N@@H+](Cc2ccc(O)cc2O)[C@@H]2C[C@@H]21 ZINC001204276786 800199373 /nfs/dbraw/zinc/19/93/73/800199373.db2.gz RHJYEMWERDUWAB-KGLIPLIRSA-N 1 2 320.389 2.291 20 10 DECDLO O=C([O-])c1ccc(C[N@@H+]2CC[C@@H](Oc3cc[nH+]cc3)C2)c(O)c1 ZINC001231455509 801669346 /nfs/dbraw/zinc/66/93/46/801669346.db2.gz QLDRDTSSVVDZQH-OAHLLOKOSA-N 1 2 314.341 2.139 20 10 DECDLO O=C([O-])c1ccc(C[N@H+]2CC[C@@H](Oc3cc[nH+]cc3)C2)c(O)c1 ZINC001231455509 801669350 /nfs/dbraw/zinc/66/93/50/801669350.db2.gz QLDRDTSSVVDZQH-OAHLLOKOSA-N 1 2 314.341 2.139 20 10 DECDLO COc1cc(O)c(C[N@@H+]2CCc3cnn(C)c3C2)cc1Cl ZINC001232268541 801833594 /nfs/dbraw/zinc/83/35/94/801833594.db2.gz OUYSSPBAYZGEIL-UHFFFAOYSA-N 1 2 307.781 2.346 20 10 DECDLO COc1cc(O)c(C[N@H+]2CCc3cnn(C)c3C2)cc1Cl ZINC001232268541 801833603 /nfs/dbraw/zinc/83/36/03/801833603.db2.gz OUYSSPBAYZGEIL-UHFFFAOYSA-N 1 2 307.781 2.346 20 10 DECDLO OC[C@@H]1CCC[N@H+](Cc2c(O)cc(Br)cc2F)C1 ZINC001233027365 802007166 /nfs/dbraw/zinc/00/71/66/802007166.db2.gz QLNCUSOSQZSVNC-SECBINFHSA-N 1 2 318.186 2.498 20 10 DECDLO OC[C@@H]1CCC[N@@H+](Cc2c(O)cc(Br)cc2F)C1 ZINC001233027365 802007175 /nfs/dbraw/zinc/00/71/75/802007175.db2.gz QLNCUSOSQZSVNC-SECBINFHSA-N 1 2 318.186 2.498 20 10 DECDLO C[C@H]1C[C@@H](CO)[N@H+](Cc2c(O)cc(Br)cc2F)C1 ZINC001233028952 802008438 /nfs/dbraw/zinc/00/84/38/802008438.db2.gz WXELDFMJHAGDOF-WPRPVWTQSA-N 1 2 318.186 2.497 20 10 DECDLO C[C@H]1C[C@@H](CO)[N@@H+](Cc2c(O)cc(Br)cc2F)C1 ZINC001233028952 802008445 /nfs/dbraw/zinc/00/84/45/802008445.db2.gz WXELDFMJHAGDOF-WPRPVWTQSA-N 1 2 318.186 2.497 20 10 DECDLO COc1cc(Cl)cc(C[N@H+]2C[C@H](CO)C[C@H](F)C2)c1O ZINC001233287946 802064081 /nfs/dbraw/zinc/06/40/81/802064081.db2.gz OJOBIYOQFKXEQY-SKDRFNHKSA-N 1 2 303.761 2.207 20 10 DECDLO COc1cc(Cl)cc(C[N@@H+]2C[C@H](CO)C[C@H](F)C2)c1O ZINC001233287946 802064087 /nfs/dbraw/zinc/06/40/87/802064087.db2.gz OJOBIYOQFKXEQY-SKDRFNHKSA-N 1 2 303.761 2.207 20 10 DECDLO CC(=O)N1CC[N@@H+](Cc2cccc(C(F)(F)F)c2O)C[C@@H]1C ZINC001233419460 802112998 /nfs/dbraw/zinc/11/29/98/802112998.db2.gz YFNOSFWXIXKESD-JTQLQIEISA-N 1 2 316.323 2.464 20 10 DECDLO CC(=O)N1CC[N@H+](Cc2cccc(C(F)(F)F)c2O)C[C@@H]1C ZINC001233419460 802113000 /nfs/dbraw/zinc/11/30/00/802113000.db2.gz YFNOSFWXIXKESD-JTQLQIEISA-N 1 2 316.323 2.464 20 10 DECDLO CC(C)(C)OC(=O)[C@H]1CCCC[N@@H+]1Cc1cc(O)c(O)cc1O ZINC001233485958 802126866 /nfs/dbraw/zinc/12/68/66/802126866.db2.gz RTIOUCWVRAEKNQ-GFCCVEGCSA-N 1 2 323.389 2.500 20 10 DECDLO CC(C)(C)OC(=O)[C@H]1CCCC[N@H+]1Cc1cc(O)c(O)cc1O ZINC001233485958 802126870 /nfs/dbraw/zinc/12/68/70/802126870.db2.gz RTIOUCWVRAEKNQ-GFCCVEGCSA-N 1 2 323.389 2.500 20 10 DECDLO CC(C)(C)OC(=O)[C@@H]1CCC[N@@H+]1Cc1cc(O)c(O)cc1O ZINC001233485924 802127591 /nfs/dbraw/zinc/12/75/91/802127591.db2.gz QJMMONJYHPYXNU-NSHDSACASA-N 1 2 309.362 2.110 20 10 DECDLO CC(C)(C)OC(=O)[C@@H]1CCC[N@H+]1Cc1cc(O)c(O)cc1O ZINC001233485924 802127594 /nfs/dbraw/zinc/12/75/94/802127594.db2.gz QJMMONJYHPYXNU-NSHDSACASA-N 1 2 309.362 2.110 20 10 DECDLO C[C@H]([NH2+][C@H]1CCCSC1)c1cccc(-c2nn[nH]n2)c1O ZINC001603659301 1070027337 /nfs/dbraw/zinc/02/73/37/1070027337.db2.gz ZXUAUHDMUXHQFO-UWVGGRQHSA-N 1 2 305.407 2.119 20 10 DECDLO C[C@@H]([NH2+]CC(C)(C)C[C@H](C)O)c1cccc(-c2nn[nH]n2)c1O ZINC001603697351 1070049122 /nfs/dbraw/zinc/04/91/22/1070049122.db2.gz YJACPSJDHCWSJZ-WDEREUQCSA-N 1 2 319.409 2.020 20 10 DECDLO CC[C@H]([NH2+]CCCCCOC)c1cccc(-c2nn[nH]n2)c1O ZINC001604057210 1070190703 /nfs/dbraw/zinc/19/07/03/1070190703.db2.gz YMFPGHOOMMPVQS-AWEZNQCLSA-N 1 2 319.409 2.430 20 10 DECDLO CC[C@H]([NH2+]CCC[C@@H](C)CO)c1cccc(-c2nn[nH]n2)c1O ZINC001604056592 1070190739 /nfs/dbraw/zinc/19/07/39/1070190739.db2.gz VCQNXUCEMMUBQM-RISCZKNCSA-N 1 2 319.409 2.022 20 10 DECDLO CNc1cc(CNC(=O)NCc2cc(Cl)ccc2O)cc[nH+]1 ZINC001479598104 1061513445 /nfs/dbraw/zinc/51/34/45/1061513445.db2.gz YXOHAYBCWHRTLX-UHFFFAOYSA-N 1 2 320.780 2.482 20 10 DECDLO C[C@@H]([NH2+][C@@H](C)Cc1ccccn1)c1cccc(-c2nn[nH]n2)c1O ZINC001589901503 1076526502 /nfs/dbraw/zinc/52/65/02/1076526502.db2.gz POUXEPNGJYFVJN-NWDGAFQWSA-N 1 2 324.388 2.249 20 10 DECDLO C[C@@H]([NH2+]C1C[C@@H](C)O[C@H](C)C1)c1cccc(-c2nn[nH]n2)c1O ZINC001590203868 1076583382 /nfs/dbraw/zinc/58/33/82/1076583382.db2.gz XEEXSDBEPCTWQQ-GMTAPVOTSA-N 1 2 317.393 2.179 20 10 DECDLO CC[C@H]([NH2+]CCCSC)c1cccc(-c2nn[nH]n2)c1O ZINC001590464800 1076632130 /nfs/dbraw/zinc/63/21/30/1076632130.db2.gz FBRCINFUYORPFK-LBPRGKRZSA-N 1 2 307.423 2.366 20 10 DECDLO CC[C@@H]([NH2+]C1CC(F)(F)C1)c1cccc(-c2nn[nH]n2)c1O ZINC001590467774 1076634164 /nfs/dbraw/zinc/63/41/64/1076634164.db2.gz UABGDIIJUZIYLH-LLVKDONJSA-N 1 2 309.320 2.411 20 10 DECDLO CC[C@@H]([NH2+]CCc1ccco1)c1cccc(-c2nn[nH]n2)c1O ZINC001590471020 1076635098 /nfs/dbraw/zinc/63/50/98/1076635098.db2.gz UOQBXZKPXYVDRS-CQSZACIVSA-N 1 2 313.361 2.449 20 10 DECDLO Cc1cc(O)c(C[NH2+][C@H](C(N)=O)c2ccccn2)cc1Cl ZINC001652520457 1079881702 /nfs/dbraw/zinc/88/17/02/1079881702.db2.gz ZZLYCDWSNYHLKC-AWEZNQCLSA-N 1 2 305.765 2.065 20 10 DECDLO C[C@@H](C(=O)NC(C)(C)C)[N@H+](C)Cc1cc(F)c(F)cc1O ZINC001659497560 1080242616 /nfs/dbraw/zinc/24/26/16/1080242616.db2.gz KFNVUEHNLMOZLL-VIFPVBQESA-N 1 2 300.349 2.405 20 10 DECDLO C[C@@H](C(=O)NC(C)(C)C)[N@@H+](C)Cc1cc(F)c(F)cc1O ZINC001659497560 1080242630 /nfs/dbraw/zinc/24/26/30/1080242630.db2.gz KFNVUEHNLMOZLL-VIFPVBQESA-N 1 2 300.349 2.405 20 10 DECDLO O=C(N1CCCCO1)[C@]12C[C@H]1CC[N@H+]2Cc1c(O)cccc1F ZINC001277492847 1084000819 /nfs/dbraw/zinc/00/08/19/1084000819.db2.gz FFRMBZVTWFEDEJ-PXAZEXFGSA-N 1 2 320.364 2.050 20 10 DECDLO O=C(N1CCCCO1)[C@]12C[C@H]1CC[N@@H+]2Cc1c(O)cccc1F ZINC001277492847 1084000832 /nfs/dbraw/zinc/00/08/32/1084000832.db2.gz FFRMBZVTWFEDEJ-PXAZEXFGSA-N 1 2 320.364 2.050 20 10 DECDLO OC[C@H]1CC[N@H+](Cc2cc(F)cc(Br)c2O)C1 ZINC001235301838 1084379046 /nfs/dbraw/zinc/37/90/46/1084379046.db2.gz JKTXDTXQBKECIG-QMMMGPOBSA-N 1 2 304.159 2.108 20 10 DECDLO OC[C@H]1CC[N@@H+](Cc2cc(F)cc(Br)c2O)C1 ZINC001235301838 1084379053 /nfs/dbraw/zinc/37/90/53/1084379053.db2.gz JKTXDTXQBKECIG-QMMMGPOBSA-N 1 2 304.159 2.108 20 10 DECDLO Oc1cccc(F)c1C[NH+]1CC2(CN(Cc3ccc[nH]3)C2)C1 ZINC001276354297 1089227974 /nfs/dbraw/zinc/22/79/74/1089227974.db2.gz PVKTXOATJGTHNT-UHFFFAOYSA-N 1 2 301.365 2.177 20 10 DECDLO Oc1cc(Cl)c(F)cc1C[N@@H+]1CCO[C@@]2(CCOC2)C1 ZINC001237933417 1138811161 /nfs/dbraw/zinc/81/11/61/1138811161.db2.gz BNDKIPTXDLCPMY-AWEZNQCLSA-N 1 2 301.745 2.176 20 10 DECDLO Oc1cc(Cl)c(F)cc1C[N@H+]1CCO[C@@]2(CCOC2)C1 ZINC001237933417 1138811164 /nfs/dbraw/zinc/81/11/64/1138811164.db2.gz BNDKIPTXDLCPMY-AWEZNQCLSA-N 1 2 301.745 2.176 20 10 DECDLO C[C@H]([NH2+]CCN1CCOC[C@@H]1C)c1cc(F)cc(F)c1O ZINC001320249387 1140841246 /nfs/dbraw/zinc/84/12/46/1140841246.db2.gz YXPVYBDAALZWOA-QWRGUYRKSA-N 1 2 300.349 2.042 20 10 DECDLO CS(=O)(=O)CC[N@H+](Cc1ccc(N2CCCC2)cc1)C1CC1 ZINC001254019372 1143026818 /nfs/dbraw/zinc/02/68/18/1143026818.db2.gz RQTUHZWVQNEZCO-UHFFFAOYSA-N 1 2 322.474 2.296 20 10 DECDLO CS(=O)(=O)CC[N@@H+](Cc1ccc(N2CCCC2)cc1)C1CC1 ZINC001254019372 1143026829 /nfs/dbraw/zinc/02/68/29/1143026829.db2.gz RQTUHZWVQNEZCO-UHFFFAOYSA-N 1 2 322.474 2.296 20 10 DECDLO C[C@H]1C[C@@H]1c1nnc(-c2ccc(O)c(C[NH+]3CCOCC3)c2)o1 ZINC001256774284 1143866713 /nfs/dbraw/zinc/86/67/13/1143866713.db2.gz RHWJIDOYHFMTTG-FZMZJTMJSA-N 1 2 315.373 2.398 20 10 DECDLO OC[C@H](c1nnc(-c2ccc(-n3cccc3)cc2)o1)n1cc[nH+]c1 ZINC001256956862 1143876630 /nfs/dbraw/zinc/87/66/30/1143876630.db2.gz ATNPGPDABZGVLA-OAHLLOKOSA-N 1 2 321.340 2.306 20 10 DECDLO C[C@@H]([NH2+]CC1(CO)CCOCC1)c1ccc(F)c(F)c1O ZINC000187801765 296117830 /nfs/dbraw/zinc/11/78/30/296117830.db2.gz BTOUVDTUVFKKKT-SNVBAGLBSA-N 1 2 301.333 2.110 20 10 DECDLO Cc1nnc([C@@H](C)[NH2+]Cc2ccc(N3CCOCC3)cc2)o1 ZINC001354604125 1151906966 /nfs/dbraw/zinc/90/69/66/1151906966.db2.gz ONPUTTXTCKKEME-GFCCVEGCSA-N 1 2 302.378 2.065 20 10 DECDLO CC(=O)c1cc(Cl)cc(C[NH2+][C@@H](C)c2ncn(C)n2)c1O ZINC000275476288 130325202 /nfs/dbraw/zinc/32/52/02/130325202.db2.gz DFASZTOZBBQLMZ-QMMMGPOBSA-N 1 2 308.769 2.228 20 10 DECDLO CCOCc1cc(C[NH2+][C@H](C)c2ncn(C)n2)ccc1OC ZINC000275768991 130381832 /nfs/dbraw/zinc/38/18/32/130381832.db2.gz GUJQZVZARFIXKS-GFCCVEGCSA-N 1 2 304.394 2.211 20 10 DECDLO CCN(C)c1ccc([C@@H](C)[NH2+][C@H](C(N)=O)c2ccccn2)cc1 ZINC000297348332 132011206 /nfs/dbraw/zinc/01/12/06/132011206.db2.gz OZTLROFZBALJKI-DYVFJYSZSA-N 1 2 312.417 2.415 20 10 DECDLO CC(C)[C@H](C(=O)Nc1ccc(N)cc1)[NH+]1C[C@@H](C)O[C@H](C)C1 ZINC000251777962 402649923 /nfs/dbraw/zinc/64/99/23/402649923.db2.gz VVTAOQQDEBYPQH-XJKCOSOUSA-N 1 2 305.422 2.341 20 10 DECDLO COc1c(O)c(C[NH2+]CCN(C)C2CCCC2)ccc1[N+](=O)[O-] ZINC000278876258 402880736 /nfs/dbraw/zinc/88/07/36/402880736.db2.gz NJXQRQBYIMCMAU-UHFFFAOYSA-N 1 2 323.393 2.273 20 10 DECDLO C[C@@H]1CCN(C(=O)c2c(F)ccc(O)c2O)C[C@H]1n1cc[nH+]c1 ZINC000295161955 403779301 /nfs/dbraw/zinc/77/93/01/403779301.db2.gz QRPITMRKRDZIED-ZYHUDNBSSA-N 1 2 319.336 2.157 20 10 DECDLO C[C@@H]1CCN(C(=O)c2c(F)ccc(O)c2O)C[C@@H]1n1cc[nH+]c1 ZINC000295161954 403779929 /nfs/dbraw/zinc/77/99/29/403779929.db2.gz QRPITMRKRDZIED-PWSUYJOCSA-N 1 2 319.336 2.157 20 10 DECDLO CCN1CCC[N@H+](Cc2c(O)ccc(Cl)c2F)CC1=O ZINC000364584128 404457930 /nfs/dbraw/zinc/45/79/30/404457930.db2.gz QHKVLWDUAPAARC-UHFFFAOYSA-N 1 2 300.761 2.239 20 10 DECDLO CCN1CCC[N@@H+](Cc2c(O)ccc(Cl)c2F)CC1=O ZINC000364584128 404457936 /nfs/dbraw/zinc/45/79/36/404457936.db2.gz QHKVLWDUAPAARC-UHFFFAOYSA-N 1 2 300.761 2.239 20 10 DECDLO C[C@@H]([NH2+][C@H]1CCCN(CCCO)C1)c1cc(F)cc(F)c1O ZINC000834849557 649854185 /nfs/dbraw/zinc/85/41/85/649854185.db2.gz BYTQORKBYHGXCC-YPMHNXCESA-N 1 2 314.376 2.168 20 10 DECDLO CO[C@@H]1COCC[C@H]1C[NH2+][C@@H](C)c1cc(F)cc(F)c1O ZINC000834881005 649857241 /nfs/dbraw/zinc/85/72/41/649857241.db2.gz XVUXIUHDTOINOK-PKFCDNJMSA-N 1 2 301.333 2.373 20 10 DECDLO CCS(=O)(=O)C[C@@H](C)[N@H+](C)Cc1ccc(N(C)C)c(F)c1 ZINC000126483075 521647058 /nfs/dbraw/zinc/64/70/58/521647058.db2.gz HQXLSSHWGAFRSV-GFCCVEGCSA-N 1 2 316.442 2.147 20 10 DECDLO CCS(=O)(=O)C[C@@H](C)[N@@H+](C)Cc1ccc(N(C)C)c(F)c1 ZINC000126483075 521647065 /nfs/dbraw/zinc/64/70/65/521647065.db2.gz HQXLSSHWGAFRSV-GFCCVEGCSA-N 1 2 316.442 2.147 20 10 DECDLO CN(C)c1ccc(CN(C)C(=O)[C@@H]2CCn3cc[nH+]c3C2)cc1 ZINC000157954197 522169536 /nfs/dbraw/zinc/16/95/36/522169536.db2.gz CPDPCXHVTGUSGI-OAHLLOKOSA-N 1 2 312.417 2.170 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@@H+]2CCO[C@@H]([C@H]3CCCO3)C2)c1O ZINC000246860950 527211870 /nfs/dbraw/zinc/21/18/70/527211870.db2.gz FOSLZQKSWAXSGY-HZPDHXFCSA-N 1 2 323.364 2.114 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@H+]2CCO[C@@H]([C@H]3CCCO3)C2)c1O ZINC000246860950 527211876 /nfs/dbraw/zinc/21/18/76/527211876.db2.gz FOSLZQKSWAXSGY-HZPDHXFCSA-N 1 2 323.364 2.114 20 10 DECDLO CCO[C@@H]1C[C@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2O)[C@]12CCCO2 ZINC000272721499 535506620 /nfs/dbraw/zinc/50/66/20/535506620.db2.gz XOVPTQVBOZDCID-ARFHVFGLSA-N 1 2 322.361 2.117 20 10 DECDLO CCc1nnc([C@H](C)[NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2O)[nH]1 ZINC000273539526 536153626 /nfs/dbraw/zinc/15/36/26/536153626.db2.gz YADLURKEKVBIHJ-IUCAKERBSA-N 1 2 305.338 2.393 20 10 DECDLO CN(C)c1ccc(/C=C/C[N@@H+]2CCC[C@@H](S(C)(=O)=O)C2)cc1 ZINC000835048056 649871450 /nfs/dbraw/zinc/87/14/50/649871450.db2.gz YZCRRQSHAJDIQZ-UKINESCASA-N 1 2 322.474 2.275 20 10 DECDLO CN(C)c1ccc(/C=C/C[N@H+]2CCC[C@@H](S(C)(=O)=O)C2)cc1 ZINC000835048056 649871453 /nfs/dbraw/zinc/87/14/53/649871453.db2.gz YZCRRQSHAJDIQZ-UKINESCASA-N 1 2 322.474 2.275 20 10 DECDLO COC(=O)C[C@H]1COCC[N@@H+]1C/C=C\c1ccc(N(C)C)cc1 ZINC000835053625 649872140 /nfs/dbraw/zinc/87/21/40/649872140.db2.gz ONGGLPGNOZCIHG-CHYADLBTSA-N 1 2 318.417 2.030 20 10 DECDLO COC(=O)C[C@H]1COCC[N@H+]1C/C=C\c1ccc(N(C)C)cc1 ZINC000835053625 649872141 /nfs/dbraw/zinc/87/21/41/649872141.db2.gz ONGGLPGNOZCIHG-CHYADLBTSA-N 1 2 318.417 2.030 20 10 DECDLO O=C(NCc1cccc(Cl)c1O)[C@H]1CCc2c[nH+]cn2C1 ZINC000890759159 623197578 /nfs/dbraw/zinc/19/75/78/623197578.db2.gz FGQGOSJPGHMFKS-NSHDSACASA-N 1 2 305.765 2.121 20 10 DECDLO Oc1c(Br)cccc1C[NH2+][C@H]1CCN(C2CC2)C1 ZINC000044687827 623690373 /nfs/dbraw/zinc/69/03/73/623690373.db2.gz RMPJFNIIUOLXGP-NSHDSACASA-N 1 2 311.223 2.481 20 10 DECDLO CC[C@H](CO)Nc1cc(N(C)Cc2ccccc2O)nc[nH+]1 ZINC000893019539 625055014 /nfs/dbraw/zinc/05/50/14/625055014.db2.gz VJRVCNJBLFBLGO-CYBMUJFWSA-N 1 2 302.378 2.001 20 10 DECDLO CC[C@H](CO)Nc1cc(N(C)Cc2ccccc2O)[nH+]cn1 ZINC000893019539 625055021 /nfs/dbraw/zinc/05/50/21/625055021.db2.gz VJRVCNJBLFBLGO-CYBMUJFWSA-N 1 2 302.378 2.001 20 10 DECDLO COC1(c2ccccc2)C[NH+](Cc2cc3c(cc2O)OCO3)C1 ZINC000839100509 637780183 /nfs/dbraw/zinc/78/01/83/637780183.db2.gz XDXFYFQWXRSTQN-UHFFFAOYSA-N 1 2 313.353 2.478 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@@H+]2CCCC[C@H]2C2OCCO2)c1O ZINC000748049482 638502818 /nfs/dbraw/zinc/50/28/18/638502818.db2.gz CTLWTZGCMMAAHA-HNNXBMFYSA-N 1 2 323.364 2.461 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@H+]2CCCC[C@H]2C2OCCO2)c1O ZINC000748049482 638502820 /nfs/dbraw/zinc/50/28/20/638502820.db2.gz CTLWTZGCMMAAHA-HNNXBMFYSA-N 1 2 323.364 2.461 20 10 DECDLO CC[C@H](CN1CCOCC1)[NH2+]Cc1cc(Cl)cc(F)c1O ZINC000896619212 638609593 /nfs/dbraw/zinc/60/95/93/638609593.db2.gz FGXYWJVUBDCECZ-CYBMUJFWSA-N 1 2 316.804 2.385 20 10 DECDLO Oc1c(F)cc(Cl)cc1C[NH2+]CC1CC2(C1)OCCO2 ZINC000896911812 639067543 /nfs/dbraw/zinc/06/75/43/639067543.db2.gz KNANDHAIMJZMLD-UHFFFAOYSA-N 1 2 301.745 2.427 20 10 DECDLO C[C@@H](CN1CCOCC1)[NH2+][C@@H](C)c1cc(F)cc(F)c1O ZINC000756412996 639659998 /nfs/dbraw/zinc/65/99/98/639659998.db2.gz BDDRRRPBXPAOGA-QWRGUYRKSA-N 1 2 300.349 2.042 20 10 DECDLO COCCN1CC[C@@H]([NH2+][C@@H](C)c2cc(F)cc(F)c2O)C1 ZINC000756549753 639673156 /nfs/dbraw/zinc/67/31/56/639673156.db2.gz HFNDBIREWZUFAJ-CMPLNLGQSA-N 1 2 300.349 2.042 20 10 DECDLO CCS(=O)(=O)C[C@@H](C)[NH2+][C@@H](C)c1cc(F)cc(F)c1O ZINC000756707115 639688569 /nfs/dbraw/zinc/68/85/69/639688569.db2.gz URNFOWJUCQQVNB-BDAKNGLRSA-N 1 2 307.362 2.144 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@@H+]2CC[C@@H](c3nnc(C)[nH]3)C2)c1O ZINC000839660107 639783937 /nfs/dbraw/zinc/78/39/37/639783937.db2.gz SCRKUYQABJGPKJ-LLVKDONJSA-N 1 2 318.352 2.150 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@H+]2CC[C@@H](c3nnc(C)[nH]3)C2)c1O ZINC000839660107 639783940 /nfs/dbraw/zinc/78/39/40/639783940.db2.gz SCRKUYQABJGPKJ-LLVKDONJSA-N 1 2 318.352 2.150 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@@H+]2CC[C@@H](c3nc(C)n[nH]3)C2)c1O ZINC000839660107 639783944 /nfs/dbraw/zinc/78/39/44/639783944.db2.gz SCRKUYQABJGPKJ-LLVKDONJSA-N 1 2 318.352 2.150 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@H+]2CC[C@@H](c3nc(C)n[nH]3)C2)c1O ZINC000839660107 639783948 /nfs/dbraw/zinc/78/39/48/639783948.db2.gz SCRKUYQABJGPKJ-LLVKDONJSA-N 1 2 318.352 2.150 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@@H+]2CC[C@@H](c3n[nH]c(C)n3)C2)c1O ZINC000839660107 639783949 /nfs/dbraw/zinc/78/39/49/639783949.db2.gz SCRKUYQABJGPKJ-LLVKDONJSA-N 1 2 318.352 2.150 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@H+]2CC[C@@H](c3n[nH]c(C)n3)C2)c1O ZINC000839660107 639783950 /nfs/dbraw/zinc/78/39/50/639783950.db2.gz SCRKUYQABJGPKJ-LLVKDONJSA-N 1 2 318.352 2.150 20 10 DECDLO C[C@@H]([NH2+][C@@H](CO)C1CCOCC1)c1cc(F)cc(F)c1O ZINC000757656538 639864956 /nfs/dbraw/zinc/86/49/56/639864956.db2.gz BAIQEZUWWVPVFQ-OTYXRUKQSA-N 1 2 301.333 2.109 20 10 DECDLO C[C@H]([NH2+][C@H](CCO)C1CCOCC1)c1cc(F)cc(F)c1O ZINC000763557846 640552419 /nfs/dbraw/zinc/55/24/19/640552419.db2.gz FTDHLBGCFOZCIB-ZUZCIYMTSA-N 1 2 315.360 2.499 20 10 DECDLO Cc1noc([C@H](C)[N@H+](C)Cc2ccc(N3CCOCC3)cc2)n1 ZINC000764142703 640610875 /nfs/dbraw/zinc/61/08/75/640610875.db2.gz OLHWQMMVXONKPN-ZDUSSCGKSA-N 1 2 316.405 2.408 20 10 DECDLO Cc1noc([C@H](C)[N@@H+](C)Cc2ccc(N3CCOCC3)cc2)n1 ZINC000764142703 640610877 /nfs/dbraw/zinc/61/08/77/640610877.db2.gz OLHWQMMVXONKPN-ZDUSSCGKSA-N 1 2 316.405 2.408 20 10 DECDLO C[C@@H]1C[N@H+](CCO)[C@H](C)CN1Cc1c(O)ccc(Cl)c1F ZINC000841891202 650594537 /nfs/dbraw/zinc/59/45/37/650594537.db2.gz KIAJBGOJFSYESD-GHMZBOCLSA-N 1 2 316.804 2.072 20 10 DECDLO C[C@@H]1C[N@@H+](CCO)[C@H](C)CN1Cc1c(O)ccc(Cl)c1F ZINC000841891202 650594538 /nfs/dbraw/zinc/59/45/38/650594538.db2.gz KIAJBGOJFSYESD-GHMZBOCLSA-N 1 2 316.804 2.072 20 10 DECDLO Cc1cc(Br)cc(C[N@@H+]2CC[C@@H](O)[C@@H](F)C2)c1O ZINC000898188859 641054726 /nfs/dbraw/zinc/05/47/26/641054726.db2.gz VBCNJKUEAVIFMC-NWDGAFQWSA-N 1 2 318.186 2.368 20 10 DECDLO Cc1cc(Br)cc(C[N@H+]2CC[C@@H](O)[C@@H](F)C2)c1O ZINC000898188859 641054727 /nfs/dbraw/zinc/05/47/27/641054727.db2.gz VBCNJKUEAVIFMC-NWDGAFQWSA-N 1 2 318.186 2.368 20 10 DECDLO COc1cccc(O)c1C[NH+]1CCN([C@H](C)C(F)(F)F)CC1 ZINC000769555440 641259303 /nfs/dbraw/zinc/25/93/03/641259303.db2.gz UIMXIUMWVVOYDT-LLVKDONJSA-N 1 2 318.339 2.469 20 10 DECDLO CC[C@@H]1C(=O)NCCC[N@H+]1Cc1cc(Cl)c(F)cc1O ZINC000898548108 641701454 /nfs/dbraw/zinc/70/14/54/641701454.db2.gz QJGKSRBWLGJNCC-GFCCVEGCSA-N 1 2 300.761 2.285 20 10 DECDLO CC[C@@H]1C(=O)NCCC[N@@H+]1Cc1cc(Cl)c(F)cc1O ZINC000898548108 641701460 /nfs/dbraw/zinc/70/14/60/641701460.db2.gz QJGKSRBWLGJNCC-GFCCVEGCSA-N 1 2 300.761 2.285 20 10 DECDLO OCC[C@@H]1CSCC[N@@H+]1Cc1cc(Cl)cc(F)c1O ZINC000775738033 642088029 /nfs/dbraw/zinc/08/80/29/642088029.db2.gz YIWHGBWHRKPHIK-LLVKDONJSA-N 1 2 305.802 2.485 20 10 DECDLO OCC[C@@H]1CSCC[N@H+]1Cc1cc(Cl)cc(F)c1O ZINC000775738033 642088037 /nfs/dbraw/zinc/08/80/37/642088037.db2.gz YIWHGBWHRKPHIK-LLVKDONJSA-N 1 2 305.802 2.485 20 10 DECDLO C[C@@H]1C[C@@H]1N1C[C@@H]([NH2+]Cc2cc(Cl)cc(F)c2O)CC1=O ZINC000776221810 642145459 /nfs/dbraw/zinc/14/54/59/642145459.db2.gz ULSYXSZCYCQMET-WLTAIBSBSA-N 1 2 312.772 2.284 20 10 DECDLO O=C(C=Cc1ccc(O)c(O)c1)N1CCC(c2c[nH]c[nH+]2)CC1 ZINC000779527562 642508021 /nfs/dbraw/zinc/50/80/21/642508021.db2.gz GPYUMKRXEWYXJR-RQOWECAXSA-N 1 2 313.357 2.240 20 10 DECDLO O=C(C=Cc1ccc(O)c(O)c1)N1CCC(c2c[nH+]c[nH]2)CC1 ZINC000779527562 642508025 /nfs/dbraw/zinc/50/80/25/642508025.db2.gz GPYUMKRXEWYXJR-RQOWECAXSA-N 1 2 313.357 2.240 20 10 DECDLO O=C1NC2(CO1)CC[NH+](Cc1c(O)ccc(Cl)c1F)CC2 ZINC000792174269 644084295 /nfs/dbraw/zinc/08/42/95/644084295.db2.gz POVKKOHRRNBKHM-UHFFFAOYSA-N 1 2 314.744 2.259 20 10 DECDLO Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)CCc1c[nH]c[nH+]1 ZINC000839922481 645309422 /nfs/dbraw/zinc/30/94/22/645309422.db2.gz VVUPNYJPQZOOGU-CQSZACIVSA-N 1 2 314.433 2.464 20 10 DECDLO Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)CCc1c[nH+]c[nH]1 ZINC000839922481 645309426 /nfs/dbraw/zinc/30/94/26/645309426.db2.gz VVUPNYJPQZOOGU-CQSZACIVSA-N 1 2 314.433 2.464 20 10 DECDLO Cc1cc(N(C)C)ccc1CNc1cc(NC[C@@H](C)O)[nH+]cn1 ZINC000840264874 646690677 /nfs/dbraw/zinc/69/06/77/646690677.db2.gz ZXARVUXVNFUFPK-CYBMUJFWSA-N 1 2 315.421 2.256 20 10 DECDLO Cc1cc(N(C)C)ccc1CNc1cc(NC[C@@H](C)O)nc[nH+]1 ZINC000840264874 646690680 /nfs/dbraw/zinc/69/06/80/646690680.db2.gz ZXARVUXVNFUFPK-CYBMUJFWSA-N 1 2 315.421 2.256 20 10 DECDLO CCOC(=O)c1c(C)n[nH]c1C[N@H+](C)Cc1ccccc1O ZINC000821391371 648051811 /nfs/dbraw/zinc/05/18/11/648051811.db2.gz JYEKIOSYOPQHHD-UHFFFAOYSA-N 1 2 303.362 2.232 20 10 DECDLO CCOC(=O)c1c(C)n[nH]c1C[N@@H+](C)Cc1ccccc1O ZINC000821391371 648051815 /nfs/dbraw/zinc/05/18/15/648051815.db2.gz JYEKIOSYOPQHHD-UHFFFAOYSA-N 1 2 303.362 2.232 20 10 DECDLO Cc1ccc(C(=O)NC[C@H]2c3ccccc3C[N@H+]2C)c(O)c1O ZINC000826708531 648912451 /nfs/dbraw/zinc/91/24/51/648912451.db2.gz CWQYMIHYTWLKAQ-HNNXBMFYSA-N 1 2 312.369 2.323 20 10 DECDLO Cc1ccc(C(=O)NC[C@H]2c3ccccc3C[N@@H+]2C)c(O)c1O ZINC000826708531 648912454 /nfs/dbraw/zinc/91/24/54/648912454.db2.gz CWQYMIHYTWLKAQ-HNNXBMFYSA-N 1 2 312.369 2.323 20 10 DECDLO CO[C@@]1(CO)CCC[N@H+](Cc2c(O)ccc(Cl)c2F)C1 ZINC000826951689 648951881 /nfs/dbraw/zinc/95/18/81/648951881.db2.gz BIPIBXCYTOCIFJ-AWEZNQCLSA-N 1 2 303.761 2.158 20 10 DECDLO CO[C@@]1(CO)CCC[N@@H+](Cc2c(O)ccc(Cl)c2F)C1 ZINC000826951689 648951884 /nfs/dbraw/zinc/95/18/84/648951884.db2.gz BIPIBXCYTOCIFJ-AWEZNQCLSA-N 1 2 303.761 2.158 20 10 DECDLO C[C@@H]1CC[C@@H]([NH2+]Cc2cccc(Cl)c2O)CS1(=O)=O ZINC000827173749 648986745 /nfs/dbraw/zinc/98/67/45/648986745.db2.gz ZZXSZDNDMSZEHS-MWLCHTKSSA-N 1 2 303.811 2.101 20 10 DECDLO COc1ccc2ccc(O)c(C[N@@H+]3CCn4nncc4C3)c2c1 ZINC000848491323 651463024 /nfs/dbraw/zinc/46/30/24/651463024.db2.gz KLTPSYSDNUHDNQ-UHFFFAOYSA-N 1 2 310.357 2.161 20 10 DECDLO COc1ccc2ccc(O)c(C[N@H+]3CCn4nncc4C3)c2c1 ZINC000848491323 651463025 /nfs/dbraw/zinc/46/30/25/651463025.db2.gz KLTPSYSDNUHDNQ-UHFFFAOYSA-N 1 2 310.357 2.161 20 10 DECDLO CC[C@@H]([NH2+]Cc1nc(COC)n[nH]1)c1ccc(N(C)C)cc1 ZINC000850515543 651942947 /nfs/dbraw/zinc/94/29/47/651942947.db2.gz YFAHGMPOTRVHMB-CQSZACIVSA-N 1 2 303.410 2.258 20 10 DECDLO C[C@@H]1CO[C@@H](C)C[N@@H+]1Cc1ccc(N2CCOCC2)c(F)c1 ZINC000092017735 684040904 /nfs/dbraw/zinc/04/09/04/684040904.db2.gz NJQFATQLCSGNDR-KGLIPLIRSA-N 1 2 308.397 2.272 20 10 DECDLO C[C@@H]1CO[C@@H](C)C[N@H+]1Cc1ccc(N2CCOCC2)c(F)c1 ZINC000092017735 684040907 /nfs/dbraw/zinc/04/09/07/684040907.db2.gz NJQFATQLCSGNDR-KGLIPLIRSA-N 1 2 308.397 2.272 20 10 DECDLO COc1ccc(N2CC[NH+](Cc3cnoc3C)CC2)cc1F ZINC000128875115 684174175 /nfs/dbraw/zinc/17/41/75/684174175.db2.gz BZQYZEVYANGUCV-UHFFFAOYSA-N 1 2 305.353 2.453 20 10 DECDLO O=C(NCc1ccc2cccnc2c1O)[C@H]1CCn2c[nH+]cc2C1 ZINC000862027022 686225661 /nfs/dbraw/zinc/22/56/61/686225661.db2.gz GZNXFNJHQJRMCR-ZDUSSCGKSA-N 1 2 322.368 2.016 20 10 DECDLO COC[C@@]1(C)C[N@H+](Cc2cc(Cl)cc(OC)c2O)CCO1 ZINC000862552124 686321839 /nfs/dbraw/zinc/32/18/39/686321839.db2.gz TXVPPAKICYXEQS-OAHLLOKOSA-N 1 2 315.797 2.292 20 10 DECDLO COC[C@@]1(C)C[N@@H+](Cc2cc(Cl)cc(OC)c2O)CCO1 ZINC000862552124 686321847 /nfs/dbraw/zinc/32/18/47/686321847.db2.gz TXVPPAKICYXEQS-OAHLLOKOSA-N 1 2 315.797 2.292 20 10 DECDLO O=C(N[C@@H]1CCN(c2cccc[nH+]2)C1)N1Cc2cccc(O)c2C1 ZINC000875419970 689622742 /nfs/dbraw/zinc/62/27/42/689622742.db2.gz MYYBTDWDJAZXBD-CQSZACIVSA-N 1 2 324.384 2.091 20 10 DECDLO O=C1CCCN1C[C@H]1CC[N@@H+](Cc2ccc(F)c(F)c2O)C1 ZINC000877638956 690175430 /nfs/dbraw/zinc/17/54/30/690175430.db2.gz TZXUSCMKOVHSKY-NSHDSACASA-N 1 2 310.344 2.115 20 10 DECDLO O=C1CCCN1C[C@H]1CC[N@H+](Cc2ccc(F)c(F)c2O)C1 ZINC000877638956 690175432 /nfs/dbraw/zinc/17/54/32/690175432.db2.gz TZXUSCMKOVHSKY-NSHDSACASA-N 1 2 310.344 2.115 20 10 DECDLO CCOC(=O)C[N@H+](CC[C@H](O)C(C)C)Cc1ccccc1O ZINC000878728448 690487239 /nfs/dbraw/zinc/48/72/39/690487239.db2.gz MYWGCBCJHBYPBZ-HNNXBMFYSA-N 1 2 309.406 2.164 20 10 DECDLO CCOC(=O)C[N@@H+](CC[C@H](O)C(C)C)Cc1ccccc1O ZINC000878728448 690487242 /nfs/dbraw/zinc/48/72/42/690487242.db2.gz MYWGCBCJHBYPBZ-HNNXBMFYSA-N 1 2 309.406 2.164 20 10 DECDLO O=C(Cc1[nH]cc[nH+]1)N(Cc1ccco1)Cc1ccccc1O ZINC001445639634 1183948819 /nfs/dbraw/zinc/94/88/19/1183948819.db2.gz ZHKNDIKYMUSIFI-UHFFFAOYSA-N 1 2 311.341 2.480 20 10 DECDLO Oc1ccc(F)cc1C[NH+]1CCN(c2nccnc2Cl)CC1 ZINC001140058154 776738266 /nfs/dbraw/zinc/73/82/66/776738266.db2.gz TUHWPOHUKMATEY-UHFFFAOYSA-N 1 2 322.771 2.297 20 10 DECDLO CC(=O)NCCC1=CCN(c2cc(C)[nH+]c(C3CC3)n2)CC1 ZINC001089802849 783457819 /nfs/dbraw/zinc/45/78/19/783457819.db2.gz ZHYSBGQHZGVRND-UHFFFAOYSA-N 1 2 300.406 2.325 20 10 DECDLO C[NH+](C)/C=C/c1ccncc1NCC(=O)c1ccc(O)c(O)c1 ZINC001170320478 786907904 /nfs/dbraw/zinc/90/79/04/786907904.db2.gz CKISITLIVBHUQC-SOFGYWHQSA-N 1 2 313.357 2.320 20 10 DECDLO O=C(c1cccc(O)c1O)N1CC[N@@H+]2CCc3ccccc3[C@@H]2C1 ZINC001148218423 791713279 /nfs/dbraw/zinc/71/32/79/791713279.db2.gz CGWBJLGOUQCACN-INIZCTEOSA-N 1 2 324.380 2.153 20 10 DECDLO O=C(c1cccc(O)c1O)N1CC[N@H+]2CCc3ccccc3[C@@H]2C1 ZINC001148218423 791713288 /nfs/dbraw/zinc/71/32/88/791713288.db2.gz CGWBJLGOUQCACN-INIZCTEOSA-N 1 2 324.380 2.153 20 10 DECDLO CCOC[C@H]1C[N@H+](Cc2c(O)cccc2F)Cc2ncn(C)c21 ZINC001137834285 796144428 /nfs/dbraw/zinc/14/44/28/796144428.db2.gz AUSWYDLLTYYBBO-GFCCVEGCSA-N 1 2 319.380 2.401 20 10 DECDLO CCOC[C@H]1C[N@@H+](Cc2c(O)cccc2F)Cc2ncn(C)c21 ZINC001137834285 796144429 /nfs/dbraw/zinc/14/44/29/796144429.db2.gz AUSWYDLLTYYBBO-GFCCVEGCSA-N 1 2 319.380 2.401 20 10 DECDLO CC(=O)[C@@H]1C[N@H+](Cc2ccc(N3CCCCC3)cc2)CCO1 ZINC001138222081 796185038 /nfs/dbraw/zinc/18/50/38/796185038.db2.gz GDWKZAJHJLOAOO-SFHVURJKSA-N 1 2 302.418 2.467 20 10 DECDLO CC(=O)[C@@H]1C[N@@H+](Cc2ccc(N3CCCCC3)cc2)CCO1 ZINC001138222081 796185040 /nfs/dbraw/zinc/18/50/40/796185040.db2.gz GDWKZAJHJLOAOO-SFHVURJKSA-N 1 2 302.418 2.467 20 10 DECDLO CCNC(=O)C[N@H+](C)Cc1ccc(N(CC)CC)cc1OC ZINC001138385837 796209167 /nfs/dbraw/zinc/20/91/67/796209167.db2.gz AMEBLNZNVRMWBQ-UHFFFAOYSA-N 1 2 307.438 2.109 20 10 DECDLO CCNC(=O)C[N@@H+](C)Cc1ccc(N(CC)CC)cc1OC ZINC001138385837 796209171 /nfs/dbraw/zinc/20/91/71/796209171.db2.gz AMEBLNZNVRMWBQ-UHFFFAOYSA-N 1 2 307.438 2.109 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1C[C@@H](CO)CC[C@@H]1C ZINC001139126690 796327393 /nfs/dbraw/zinc/32/73/93/796327393.db2.gz MSYZVXWFZHMVTH-STQMWFEESA-N 1 2 317.385 2.400 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1C[C@@H](CO)CC[C@@H]1C ZINC001139126690 796327399 /nfs/dbraw/zinc/32/73/99/796327399.db2.gz MSYZVXWFZHMVTH-STQMWFEESA-N 1 2 317.385 2.400 20 10 DECDLO COC[C@@H]1CCC[N@@H+]1Cc1c(O)ccc2c(C)cc(=O)oc21 ZINC001139126825 796327906 /nfs/dbraw/zinc/32/79/06/796327906.db2.gz RJXAAPUTTDUKNB-LBPRGKRZSA-N 1 2 303.358 2.418 20 10 DECDLO COC[C@@H]1CCC[N@H+]1Cc1c(O)ccc2c(C)cc(=O)oc21 ZINC001139126825 796327909 /nfs/dbraw/zinc/32/79/09/796327909.db2.gz RJXAAPUTTDUKNB-LBPRGKRZSA-N 1 2 303.358 2.418 20 10 DECDLO CCC[NH+]1CCN(Cc2c(O)ccc3c(C)cc(=O)oc32)CC1 ZINC001139129338 796328845 /nfs/dbraw/zinc/32/88/45/796328845.db2.gz WMRVNQIOSMQUAP-UHFFFAOYSA-N 1 2 316.401 2.335 20 10 DECDLO O=C(C1CCC1)N1CC[NH+](Cc2cc(Cl)ccc2O)CC1 ZINC001203664152 796544741 /nfs/dbraw/zinc/54/47/41/796544741.db2.gz OSUNBXGGJLAXJH-UHFFFAOYSA-N 1 2 308.809 2.490 20 10 DECDLO Fc1cc(N2CCOCC2)ccc1C[N@@H+]1CCCC12COC2 ZINC001140661402 796552696 /nfs/dbraw/zinc/55/26/96/796552696.db2.gz CTMWTFPAFUAHJL-UHFFFAOYSA-N 1 2 306.381 2.027 20 10 DECDLO Fc1cc(N2CCOCC2)ccc1C[N@H+]1CCCC12COC2 ZINC001140661402 796552698 /nfs/dbraw/zinc/55/26/98/796552698.db2.gz CTMWTFPAFUAHJL-UHFFFAOYSA-N 1 2 306.381 2.027 20 10 DECDLO CC1(C)C[N@H+](Cc2ccc(N3CCOCC3)cc2F)CCO1 ZINC001140662443 796553262 /nfs/dbraw/zinc/55/32/62/796553262.db2.gz UPGPGACZUSPXGQ-UHFFFAOYSA-N 1 2 308.397 2.273 20 10 DECDLO CC1(C)C[N@@H+](Cc2ccc(N3CCOCC3)cc2F)CCO1 ZINC001140662443 796553266 /nfs/dbraw/zinc/55/32/66/796553266.db2.gz UPGPGACZUSPXGQ-UHFFFAOYSA-N 1 2 308.397 2.273 20 10 DECDLO CC(C)(C)OC(=O)N1CC[N@H+](Cc2cc(O)ccc2O)[C@@H]2C[C@@H]21 ZINC001141158076 796642415 /nfs/dbraw/zinc/64/24/15/796642415.db2.gz SLSSOFOCILMWPB-KGLIPLIRSA-N 1 2 320.389 2.291 20 10 DECDLO CC(C)(C)OC(=O)N1CC[N@@H+](Cc2cc(O)ccc2O)[C@@H]2C[C@@H]21 ZINC001141158076 796642417 /nfs/dbraw/zinc/64/24/17/796642417.db2.gz SLSSOFOCILMWPB-KGLIPLIRSA-N 1 2 320.389 2.291 20 10 DECDLO Cc1cc(NC(=O)c2c(F)ccc(O)c2O)cn2cc[nH+]c12 ZINC001161407268 798848323 /nfs/dbraw/zinc/84/83/23/798848323.db2.gz SPGZOCBWMAKZTF-UHFFFAOYSA-N 1 2 301.277 2.445 20 10 DECDLO Cc1nc(CN2CC[NH+](Cc3ccc(Cl)cc3O)CC2)no1 ZINC001204866364 800268447 /nfs/dbraw/zinc/26/84/47/800268447.db2.gz MENDNUNOBYTSNG-UHFFFAOYSA-N 1 2 322.796 2.055 20 10 DECDLO CN1C(=O)CC[C@@H]2C[N@@H+](Cc3cccc(Cl)c3O)CC[C@H]21 ZINC001231913859 801750245 /nfs/dbraw/zinc/75/02/45/801750245.db2.gz UERFYRQVMVNXHV-BXUZGUMPSA-N 1 2 308.809 2.488 20 10 DECDLO CN1C(=O)CC[C@@H]2C[N@H+](Cc3cccc(Cl)c3O)CC[C@H]21 ZINC001231913859 801750248 /nfs/dbraw/zinc/75/02/48/801750248.db2.gz UERFYRQVMVNXHV-BXUZGUMPSA-N 1 2 308.809 2.488 20 10 DECDLO Cc1ccc(N2CC[NH+](Cc3cc(O)c(O)c(O)c3)CC2)cc1 ZINC001233009822 802001419 /nfs/dbraw/zinc/00/14/19/802001419.db2.gz CLJPFKGYNHWERJ-UHFFFAOYSA-N 1 2 314.385 2.434 20 10 DECDLO CC[C@@H]([NH2+]CCCCCCO)c1cccc(-c2nn[nH]n2)c1O ZINC001604057040 1070191404 /nfs/dbraw/zinc/19/14/04/1070191404.db2.gz XXYMRVWPAFNBSQ-CQSZACIVSA-N 1 2 319.409 2.166 20 10 DECDLO COc1cc(C)c(C[NH+]2CC(OC(=O)NC(C)C)C2)c(O)c1 ZINC001462326113 1058802325 /nfs/dbraw/zinc/80/23/25/1058802325.db2.gz IHEZWTKTVHOKKV-UHFFFAOYSA-N 1 2 308.378 2.028 20 10 DECDLO CN(C)Cc1csc(C[NH2+]Cc2cc(F)c(F)cc2O)n1 ZINC001474711267 1060924082 /nfs/dbraw/zinc/92/40/82/1060924082.db2.gz PGYBEYDOSDAVRY-UHFFFAOYSA-N 1 2 313.373 2.478 20 10 DECDLO Cc1[nH]c([C@H]2CCCN2C(=O)Cc2ccc(O)c(O)c2)[nH+]c1C ZINC001649369334 1079114982 /nfs/dbraw/zinc/11/49/82/1079114982.db2.gz GCBZREHRPAYZRN-CYBMUJFWSA-N 1 2 315.373 2.344 20 10 DECDLO COC1(OC)CCOC[C@@H]1[NH2+]Cc1cc(Cl)cc(F)c1O ZINC001560574539 1075142163 /nfs/dbraw/zinc/14/21/63/1075142163.db2.gz VAPAATLAEYJBAY-LBPRGKRZSA-N 1 2 319.760 2.052 20 10 DECDLO CC[C@H]([NH2+]CC(C)(C)OC)c1cccc(-c2nn[nH]n2)c1O ZINC001590462851 1076631416 /nfs/dbraw/zinc/63/14/16/1076631416.db2.gz GANVBQNKQZPJGV-LBPRGKRZSA-N 1 2 305.382 2.038 20 10 DECDLO CCOCC(C)(C)C[NH2+][C@@H](C)c1cccc(-c2nn[nH]n2)c1O ZINC001590799697 1076679151 /nfs/dbraw/zinc/67/91/51/1076679151.db2.gz PNHZVIJHJANKHR-NSHDSACASA-N 1 2 319.409 2.286 20 10 DECDLO Cc1ccc(CC[NH2+][C@@H](C)c2cccc(-c3nn[nH]n3)c2O)o1 ZINC001592152222 1076859575 /nfs/dbraw/zinc/85/95/75/1076859575.db2.gz RRXBXMGOPIYTBD-NSHDSACASA-N 1 2 313.361 2.367 20 10 DECDLO Cc1nn(C)c(C)c1[C@H](O)C[NH2+]Cc1cccc(Cl)c1O ZINC001653246509 1079921043 /nfs/dbraw/zinc/92/10/43/1079921043.db2.gz QCCFGJGJXVEJNA-CYBMUJFWSA-N 1 2 309.797 2.219 20 10 DECDLO O=C(CCC[NH2+]Cc1cc(Cl)cc(F)c1O)NC1CC1 ZINC001657156651 1080161582 /nfs/dbraw/zinc/16/15/82/1080161582.db2.gz FBWQKHFOLKMCTG-UHFFFAOYSA-N 1 2 300.761 2.333 20 10 DECDLO NC(=O)[C@H](F)C1CC[NH+](Cc2c(O)ccc(Cl)c2F)CC1 ZINC001665576332 1081042070 /nfs/dbraw/zinc/04/20/70/1081042070.db2.gz DSCDIDMHSMPOJA-GFCCVEGCSA-N 1 2 318.751 2.220 20 10 DECDLO COc1ccc(N2C[C@@H]3[C@H](C2)OCC[N@@H+]3Cc2ccc[nH]2)cc1 ZINC001276925198 1083682577 /nfs/dbraw/zinc/68/25/77/1083682577.db2.gz XKIVHDXMGVWVKZ-MSOLQXFVSA-N 1 2 313.401 2.113 20 10 DECDLO COc1ccc(N2C[C@@H]3[C@H](C2)OCC[N@H+]3Cc2ccc[nH]2)cc1 ZINC001276925198 1083682583 /nfs/dbraw/zinc/68/25/83/1083682583.db2.gz XKIVHDXMGVWVKZ-MSOLQXFVSA-N 1 2 313.401 2.113 20 10 DECDLO COCCOC[NH+]1CC2(C1)CCN(c1ccc(OC)cc1)CC2 ZINC001276927444 1083683625 /nfs/dbraw/zinc/68/36/25/1083683625.db2.gz RPCCUKYJSGLMOM-UHFFFAOYSA-N 1 2 320.433 2.218 20 10 DECDLO Oc1c(Br)cc(F)cc1C[NH+]1CCC(O)CC1 ZINC001235298655 1084377507 /nfs/dbraw/zinc/37/75/07/1084377507.db2.gz SRDQRJHSGSHXSA-UHFFFAOYSA-N 1 2 304.159 2.251 20 10 DECDLO CN(Cc1cc(Br)cc(F)c1O)[C@@H]1CC[N@H+](C)C1 ZINC000715718446 1084944617 /nfs/dbraw/zinc/94/46/17/1084944617.db2.gz NCHLWJHDVFSAAS-LLVKDONJSA-N 1 2 317.202 2.430 20 10 DECDLO CN(Cc1cc(Br)cc(F)c1O)[C@@H]1CC[N@@H+](C)C1 ZINC000715718446 1084944625 /nfs/dbraw/zinc/94/46/25/1084944625.db2.gz NCHLWJHDVFSAAS-LLVKDONJSA-N 1 2 317.202 2.430 20 10 DECDLO CCn1cc(C[NH2+]Cc2c(O)cccc2Br)nn1 ZINC000706825427 1086652113 /nfs/dbraw/zinc/65/21/13/1086652113.db2.gz XOWSXIHRZAFZDC-UHFFFAOYSA-N 1 2 311.183 2.056 20 10 DECDLO CCNC(=O)C[N@H+](CC)Cc1c(O)cccc1Br ZINC000707152555 1086662381 /nfs/dbraw/zinc/66/23/81/1086662381.db2.gz PPSGNNAEIQUZTL-UHFFFAOYSA-N 1 2 315.211 2.113 20 10 DECDLO CCNC(=O)C[N@@H+](CC)Cc1c(O)cccc1Br ZINC000707152555 1086662384 /nfs/dbraw/zinc/66/23/84/1086662384.db2.gz PPSGNNAEIQUZTL-UHFFFAOYSA-N 1 2 315.211 2.113 20 10 DECDLO COc1ccc(C[N@@H+]2CCC[C@H](n3cncn3)C2)c(O)c1Cl ZINC001236805604 1138434180 /nfs/dbraw/zinc/43/41/80/1138434180.db2.gz ASSDWJJXMQYVLX-LBPRGKRZSA-N 1 2 322.796 2.483 20 10 DECDLO COc1ccc(C[N@H+]2CCC[C@H](n3cncn3)C2)c(O)c1Cl ZINC001236805604 1138434187 /nfs/dbraw/zinc/43/41/87/1138434187.db2.gz ASSDWJJXMQYVLX-LBPRGKRZSA-N 1 2 322.796 2.483 20 10 DECDLO COc1cc(O)c(C[N@@H+]2CCN[C@@H](C(F)(F)F)C2)c(Cl)c1 ZINC001236995620 1138477434 /nfs/dbraw/zinc/47/74/34/1138477434.db2.gz KBACGEMDKUNJPV-GFCCVEGCSA-N 1 2 324.730 2.390 20 10 DECDLO COc1cc(O)c(C[N@H+]2CCN[C@@H](C(F)(F)F)C2)c(Cl)c1 ZINC001236995620 1138477444 /nfs/dbraw/zinc/47/74/44/1138477444.db2.gz KBACGEMDKUNJPV-GFCCVEGCSA-N 1 2 324.730 2.390 20 10 DECDLO COC(=O)Cc1ccc(C[N@H+](C)Cc2cscn2)c(O)c1 ZINC001249207760 1141860252 /nfs/dbraw/zinc/86/02/52/1141860252.db2.gz ICOXFFCJDQSVLJ-UHFFFAOYSA-N 1 2 306.387 2.196 20 10 DECDLO COC(=O)Cc1ccc(C[N@@H+](C)Cc2cscn2)c(O)c1 ZINC001249207760 1141860255 /nfs/dbraw/zinc/86/02/55/1141860255.db2.gz ICOXFFCJDQSVLJ-UHFFFAOYSA-N 1 2 306.387 2.196 20 10 DECDLO CCOC(=O)C[N@H+](C)Cc1cc(C)c(Br)cc1O ZINC001250124133 1142084522 /nfs/dbraw/zinc/08/45/22/1142084522.db2.gz XMGPFPSFFCOQCC-UHFFFAOYSA-N 1 2 316.195 2.458 20 10 DECDLO CCOC(=O)C[N@@H+](C)Cc1cc(C)c(Br)cc1O ZINC001250124133 1142084531 /nfs/dbraw/zinc/08/45/31/1142084531.db2.gz XMGPFPSFFCOQCC-UHFFFAOYSA-N 1 2 316.195 2.458 20 10 DECDLO COC1CCN(CC[NH2+]Cc2cc(Cl)cc(F)c2O)CC1 ZINC001308296562 1147464353 /nfs/dbraw/zinc/46/43/53/1147464353.db2.gz ZSQOHTVYEHTNTF-UHFFFAOYSA-N 1 2 316.804 2.385 20 10 DECDLO Cc1nnc(C[N@@H+](Cc2ccccc2O)C[C@H]2CCCO2)o1 ZINC000096971066 185394550 /nfs/dbraw/zinc/39/45/50/185394550.db2.gz CCGZFTQGZAAEJU-CQSZACIVSA-N 1 2 303.362 2.265 20 10 DECDLO Cc1nnc(C[N@H+](Cc2ccccc2O)C[C@H]2CCCO2)o1 ZINC000096971066 185394551 /nfs/dbraw/zinc/39/45/51/185394551.db2.gz CCGZFTQGZAAEJU-CQSZACIVSA-N 1 2 303.362 2.265 20 10 DECDLO CN(C)c1ccc(CN(C)C(=O)NCCCn2cc[nH+]c2)cc1 ZINC000053510498 183904746 /nfs/dbraw/zinc/90/47/46/183904746.db2.gz YMJNYIAUQIWJIF-UHFFFAOYSA-N 1 2 315.421 2.181 20 10 DECDLO CC[N@H+](Cc1ccc(N(C)C)c(F)c1)[C@H](C)CS(C)(=O)=O ZINC000126215226 285100288 /nfs/dbraw/zinc/10/02/88/285100288.db2.gz YGFFSOBDIBSOOT-GFCCVEGCSA-N 1 2 316.442 2.147 20 10 DECDLO CC[N@@H+](Cc1ccc(N(C)C)c(F)c1)[C@H](C)CS(C)(=O)=O ZINC000126215226 285100289 /nfs/dbraw/zinc/10/02/89/285100289.db2.gz YGFFSOBDIBSOOT-GFCCVEGCSA-N 1 2 316.442 2.147 20 10 DECDLO COc1cc(O)c(C[N@@H+]2CC[C@@](C)(O)[C@@H](F)C2)cc1Cl ZINC001232265841 781983228 /nfs/dbraw/zinc/98/32/28/781983228.db2.gz GEALJLPUNNFYSV-UONOGXRCSA-N 1 2 303.761 2.349 20 10 DECDLO COc1cc(O)c(C[N@H+]2CC[C@@](C)(O)[C@@H](F)C2)cc1Cl ZINC001232265841 781983241 /nfs/dbraw/zinc/98/32/41/781983241.db2.gz GEALJLPUNNFYSV-UONOGXRCSA-N 1 2 303.761 2.349 20 10 DECDLO COc1cc(Cl)cc(C[N@@H+]2CC[S@](=O)[C@@H](C)[C@@H]2C)c1O ZINC000273706815 130157093 /nfs/dbraw/zinc/15/70/93/130157093.db2.gz FKTHWRQBMIANPT-VUPYVKPUSA-N 1 2 317.838 2.396 20 10 DECDLO COc1cc(Cl)cc(C[N@H+]2CC[S@](=O)[C@@H](C)[C@@H]2C)c1O ZINC000273706815 130157096 /nfs/dbraw/zinc/15/70/96/130157096.db2.gz FKTHWRQBMIANPT-VUPYVKPUSA-N 1 2 317.838 2.396 20 10 DECDLO CCc1nc(C[N@@H+]2CCCN(c3ccc(OC)cc3)CC2)no1 ZINC000054337621 402066488 /nfs/dbraw/zinc/06/64/88/402066488.db2.gz REZZCVACTJTBFZ-UHFFFAOYSA-N 1 2 316.405 2.353 20 10 DECDLO CCc1nc(C[N@H+]2CCCN(c3ccc(OC)cc3)CC2)no1 ZINC000054337621 402066491 /nfs/dbraw/zinc/06/64/91/402066491.db2.gz REZZCVACTJTBFZ-UHFFFAOYSA-N 1 2 316.405 2.353 20 10 DECDLO C[C@H](C[NH2+][C@@H](C)c1ccc(F)c(F)c1O)N1CCOCC1 ZINC000191192886 402649684 /nfs/dbraw/zinc/64/96/84/402649684.db2.gz OAYGNNWRZUUDRQ-MNOVXSKESA-N 1 2 300.349 2.042 20 10 DECDLO COC[C@H]([NH2+]Cc1ccc([N+](=O)[O-])c(OC)c1O)c1ccco1 ZINC000278553074 402868088 /nfs/dbraw/zinc/86/80/88/402868088.db2.gz ZLDNPWYSBUQSNG-NSHDSACASA-N 1 2 322.317 2.379 20 10 DECDLO OC[C@@H]1CCCN(c2cc(NCc3ccccc3O)[nH+]cn2)C1 ZINC000271627439 402882085 /nfs/dbraw/zinc/88/20/85/402882085.db2.gz NHEIRUGZZCPQHI-CYBMUJFWSA-N 1 2 314.389 2.003 20 10 DECDLO OC[C@@H]1CCCN(c2cc(NCc3ccccc3O)nc[nH+]2)C1 ZINC000271627439 402882086 /nfs/dbraw/zinc/88/20/86/402882086.db2.gz NHEIRUGZZCPQHI-CYBMUJFWSA-N 1 2 314.389 2.003 20 10 DECDLO CC[C@@H](C)[N@H+](C)CCNCc1ccc([N+](=O)[O-])c(OC)c1O ZINC000278917275 402885584 /nfs/dbraw/zinc/88/55/84/402885584.db2.gz UFOYIQAEPCXNQR-LLVKDONJSA-N 1 2 311.382 2.129 20 10 DECDLO CC[C@@H](C)[N@@H+](C)CCNCc1ccc([N+](=O)[O-])c(OC)c1O ZINC000278917275 402885585 /nfs/dbraw/zinc/88/55/85/402885585.db2.gz UFOYIQAEPCXNQR-LLVKDONJSA-N 1 2 311.382 2.129 20 10 DECDLO CC[C@@H](C)N(C)CC[NH2+]Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000278917275 402885587 /nfs/dbraw/zinc/88/55/87/402885587.db2.gz UFOYIQAEPCXNQR-LLVKDONJSA-N 1 2 311.382 2.129 20 10 DECDLO COC(=O)[C@@H](C)[N@H+](C)Cc1cc(Br)cc(C)c1O ZINC000280816445 403039788 /nfs/dbraw/zinc/03/97/88/403039788.db2.gz JRBMEZPQGOFLHG-SECBINFHSA-N 1 2 316.195 2.456 20 10 DECDLO COC(=O)[C@@H](C)[N@@H+](C)Cc1cc(Br)cc(C)c1O ZINC000280816445 403039789 /nfs/dbraw/zinc/03/97/89/403039789.db2.gz JRBMEZPQGOFLHG-SECBINFHSA-N 1 2 316.195 2.456 20 10 DECDLO Oc1cc2c(cc1CN1CC[NH+](Cc3ccco3)CC1)OCO2 ZINC000281012894 403056809 /nfs/dbraw/zinc/05/68/09/403056809.db2.gz NPGUFAPSRLXQRI-UHFFFAOYSA-N 1 2 316.357 2.032 20 10 DECDLO Oc1ccccc1CNc1cc(N2CCSCC2)nc[nH+]1 ZINC000277588625 403234035 /nfs/dbraw/zinc/23/40/35/403234035.db2.gz TXKNJOMMBPFROR-UHFFFAOYSA-N 1 2 302.403 2.348 20 10 DECDLO Oc1ccccc1CNc1cc(N2CCSCC2)[nH+]cn1 ZINC000277588625 403234037 /nfs/dbraw/zinc/23/40/37/403234037.db2.gz TXKNJOMMBPFROR-UHFFFAOYSA-N 1 2 302.403 2.348 20 10 DECDLO C[C@@](O)(C[NH2+]Cc1cc([N+](=O)[O-])ccc1O)c1ccc(F)cc1 ZINC000270294127 403180332 /nfs/dbraw/zinc/18/03/32/403180332.db2.gz PTBYCKSYOSOAFX-MRXNPFEDSA-N 1 2 320.320 2.437 20 10 DECDLO CN(C)c1ccc(C[N@@H+]2CCC[C@H]2c2nncn2C)cc1F ZINC000271163523 403271220 /nfs/dbraw/zinc/27/12/20/403271220.db2.gz ASMNJRVHUNTOIO-HNNXBMFYSA-N 1 2 303.385 2.357 20 10 DECDLO CN(C)c1ccc(C[N@H+]2CCC[C@H]2c2nncn2C)cc1F ZINC000271163523 403271222 /nfs/dbraw/zinc/27/12/22/403271222.db2.gz ASMNJRVHUNTOIO-HNNXBMFYSA-N 1 2 303.385 2.357 20 10 DECDLO CS(=O)(=O)C[C@H]1CCC[N@H+](Cc2c(O)cccc2Cl)C1 ZINC000293888580 403591466 /nfs/dbraw/zinc/59/14/66/403591466.db2.gz KEQWQMUSUWWQDM-NSHDSACASA-N 1 2 317.838 2.302 20 10 DECDLO CS(=O)(=O)C[C@H]1CCC[N@@H+](Cc2c(O)cccc2Cl)C1 ZINC000293888580 403591474 /nfs/dbraw/zinc/59/14/74/403591474.db2.gz KEQWQMUSUWWQDM-NSHDSACASA-N 1 2 317.838 2.302 20 10 DECDLO CS(=O)(=O)CC[N@H+](Cc1cc(Cl)c(F)cc1O)C1CC1 ZINC000293785510 403563905 /nfs/dbraw/zinc/56/39/05/403563905.db2.gz BGLWKZXMUNEKPM-UHFFFAOYSA-N 1 2 321.801 2.194 20 10 DECDLO CS(=O)(=O)CC[N@@H+](Cc1cc(Cl)c(F)cc1O)C1CC1 ZINC000293785510 403563907 /nfs/dbraw/zinc/56/39/07/403563907.db2.gz BGLWKZXMUNEKPM-UHFFFAOYSA-N 1 2 321.801 2.194 20 10 DECDLO C[C@H]1CCN(C(=O)c2c(F)ccc(O)c2O)C[C@H]1n1cc[nH+]c1 ZINC000295161952 403779638 /nfs/dbraw/zinc/77/96/38/403779638.db2.gz QRPITMRKRDZIED-CMPLNLGQSA-N 1 2 319.336 2.157 20 10 DECDLO COc1cc(O)c(C[N@H+](C)[C@H](C)C(=O)OC(C)C)cc1OC ZINC000271083127 295003502 /nfs/dbraw/zinc/00/35/02/295003502.db2.gz JQKBEZNRRZYKEG-LLVKDONJSA-N 1 2 311.378 2.181 20 10 DECDLO COc1cc(O)c(C[N@@H+](C)[C@H](C)C(=O)OC(C)C)cc1OC ZINC000271083127 295003506 /nfs/dbraw/zinc/00/35/06/295003506.db2.gz JQKBEZNRRZYKEG-LLVKDONJSA-N 1 2 311.378 2.181 20 10 DECDLO CCN(CC)C(=O)C[N@H+](C)Cc1cc(F)cc(C(C)=O)c1O ZINC000267072537 528015497 /nfs/dbraw/zinc/01/54/97/528015497.db2.gz OYVRTZOAMUINCR-UHFFFAOYSA-N 1 2 310.369 2.034 20 10 DECDLO CCN(CC)C(=O)C[N@@H+](C)Cc1cc(F)cc(C(C)=O)c1O ZINC000267072537 528015500 /nfs/dbraw/zinc/01/55/00/528015500.db2.gz OYVRTZOAMUINCR-UHFFFAOYSA-N 1 2 310.369 2.034 20 10 DECDLO C[C@@H]1C[N@H+](C/C=C/c2ccc(N(C)C)cc2)CC[S@@](=O)C1 ZINC000835048365 649871540 /nfs/dbraw/zinc/87/15/40/649871540.db2.gz HMBPBIGYIGDQPP-LLTUXLDESA-N 1 2 306.475 2.466 20 10 DECDLO C[C@@H]1C[N@@H+](C/C=C/c2ccc(N(C)C)cc2)CC[S@@](=O)C1 ZINC000835048365 649871541 /nfs/dbraw/zinc/87/15/41/649871541.db2.gz HMBPBIGYIGDQPP-LLTUXLDESA-N 1 2 306.475 2.466 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@H+](C)Cc2cccc(=O)[nH]2)c1O ZINC000933399189 624202495 /nfs/dbraw/zinc/20/24/95/624202495.db2.gz RNAOHIJZFABWKR-UHFFFAOYSA-N 1 2 304.321 2.467 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@@H+](C)Cc2cccc(=O)[nH]2)c1O ZINC000933399189 624202497 /nfs/dbraw/zinc/20/24/97/624202497.db2.gz RNAOHIJZFABWKR-UHFFFAOYSA-N 1 2 304.321 2.467 20 10 DECDLO CS(=O)(=O)[C@H]1CCC[N@@H+](Cc2cc(Cl)ccc2O)C1 ZINC000311955045 625730114 /nfs/dbraw/zinc/73/01/14/625730114.db2.gz MGMMKFBNCYCBKW-LBPRGKRZSA-N 1 2 303.811 2.055 20 10 DECDLO COC(=O)[C@@H]1C[C@H](C)CC[N@@H+]1Cc1ccc(OC)c(OC)c1O ZINC000893677663 635756408 /nfs/dbraw/zinc/75/64/08/635756408.db2.gz XDKNCSJHBSCHRQ-YPMHNXCESA-N 1 2 323.389 2.183 20 10 DECDLO COC(=O)[C@@H]1C[C@H](C)CC[N@H+]1Cc1ccc(OC)c(OC)c1O ZINC000893677663 635756410 /nfs/dbraw/zinc/75/64/10/635756410.db2.gz XDKNCSJHBSCHRQ-YPMHNXCESA-N 1 2 323.389 2.183 20 10 DECDLO CCN(CC)c1ccc(C[N@@H+]2CCO[C@@H]([C@H](C)O)C2)cc1F ZINC000840976572 636005371 /nfs/dbraw/zinc/00/53/71/636005371.db2.gz DQCORGICZKLBTJ-SUMWQHHRSA-N 1 2 310.413 2.254 20 10 DECDLO CCN(CC)c1ccc(C[N@H+]2CCO[C@@H]([C@H](C)O)C2)cc1F ZINC000840976572 636005373 /nfs/dbraw/zinc/00/53/73/636005373.db2.gz DQCORGICZKLBTJ-SUMWQHHRSA-N 1 2 310.413 2.254 20 10 DECDLO COc1ccc(C[N@@H+]2CCOC[C@H]2CC(F)F)c(O)c1OC ZINC000894429772 637034925 /nfs/dbraw/zinc/03/49/25/637034925.db2.gz KVBOHWZLFLZTOL-LLVKDONJSA-N 1 2 317.332 2.265 20 10 DECDLO COc1ccc(C[N@H+]2CCOC[C@H]2CC(F)F)c(O)c1OC ZINC000894429772 637034931 /nfs/dbraw/zinc/03/49/31/637034931.db2.gz KVBOHWZLFLZTOL-LLVKDONJSA-N 1 2 317.332 2.265 20 10 DECDLO C[N@H+](CCCCO)Cc1cc(Br)cc(F)c1O ZINC000894539925 637096827 /nfs/dbraw/zinc/09/68/27/637096827.db2.gz ZLZPTSPMLDNEEX-UHFFFAOYSA-N 1 2 306.175 2.498 20 10 DECDLO C[N@@H+](CCCCO)Cc1cc(Br)cc(F)c1O ZINC000894539925 637096828 /nfs/dbraw/zinc/09/68/28/637096828.db2.gz ZLZPTSPMLDNEEX-UHFFFAOYSA-N 1 2 306.175 2.498 20 10 DECDLO C[C@@H]1OCC[C@@]12C[N@H+](Cc1cc(F)cc(F)c1O)C[C@@H](C)O2 ZINC000894598109 637127748 /nfs/dbraw/zinc/12/77/48/637127748.db2.gz USTKVLLOULIGFW-OHUAYANFSA-N 1 2 313.344 2.439 20 10 DECDLO CCS(=O)(=O)CC[N@@H+](C)Cc1cc(Cl)c(C)cc1O ZINC000824863180 637281491 /nfs/dbraw/zinc/28/14/91/637281491.db2.gz OTTQAJWHQATHOE-UHFFFAOYSA-N 1 2 305.827 2.221 20 10 DECDLO COc1cc(C)cc(C[NH+]2CC(OC(=O)NC(C)C)C2)c1O ZINC000894980449 637356766 /nfs/dbraw/zinc/35/67/66/637356766.db2.gz PSIICERLGLTSDF-UHFFFAOYSA-N 1 2 308.378 2.028 20 10 DECDLO CCOC(=O)c1noc(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)n1 ZINC000838937978 637724132 /nfs/dbraw/zinc/72/41/32/637724132.db2.gz YWXBBFTZTXHRFN-LLVKDONJSA-N 1 2 318.377 2.163 20 10 DECDLO CC(=O)N1C[C@@H]2C[N@@H+](Cc3cc(Cl)cc(F)c3O)C[C@@H]2C1 ZINC000895576197 638089462 /nfs/dbraw/zinc/08/94/62/638089462.db2.gz KBILDZXZZIKWQC-TXEJJXNPSA-N 1 2 312.772 2.095 20 10 DECDLO CC(=O)N1C[C@@H]2C[N@H+](Cc3cc(Cl)cc(F)c3O)C[C@@H]2C1 ZINC000895576197 638089466 /nfs/dbraw/zinc/08/94/66/638089466.db2.gz KBILDZXZZIKWQC-TXEJJXNPSA-N 1 2 312.772 2.095 20 10 DECDLO OC[C@@H](C[C@@H]1CCCO1)[NH2+]Cc1cc(Cl)cc(F)c1O ZINC000895746091 638174862 /nfs/dbraw/zinc/17/48/62/638174862.db2.gz BNEGWNZKEAMFLK-NEPJUHHUSA-N 1 2 303.761 2.204 20 10 DECDLO Cc1nc2n(n1)C[C@@H]([NH2+][C@@H](C)c1cc(F)cc(F)c1O)CC2 ZINC000756535023 639670385 /nfs/dbraw/zinc/67/03/85/639670385.db2.gz MWENNVISQDVRSP-KWQFWETISA-N 1 2 308.332 2.236 20 10 DECDLO C[C@H](CCS(C)(=O)=O)[NH2+][C@H](C)c1cc(F)cc(F)c1O ZINC000756657265 639682589 /nfs/dbraw/zinc/68/25/89/639682589.db2.gz CACNKHYCXNNSSW-RKDXNWHRSA-N 1 2 307.362 2.144 20 10 DECDLO C[C@@H]([NH2+][C@@H](C)CCS(C)(=O)=O)c1cc(F)cc(F)c1O ZINC000756657263 639682627 /nfs/dbraw/zinc/68/26/27/639682627.db2.gz CACNKHYCXNNSSW-DTWKUNHWSA-N 1 2 307.362 2.144 20 10 DECDLO C[C@H]([NH2+]C[C@H](O)C1CCOCC1)c1cc(F)cc(F)c1O ZINC000756739097 639690957 /nfs/dbraw/zinc/69/09/57/639690957.db2.gz RRBXMIIYNIQDFZ-XPTSAGLGSA-N 1 2 301.333 2.109 20 10 DECDLO CCNC(=O)N1CC[C@@H]([NH2+][C@H](C)c2cc(F)cc(F)c2O)C1 ZINC000756760341 639693229 /nfs/dbraw/zinc/69/32/29/639693229.db2.gz NSZSVPYCQOXZGV-MWLCHTKSSA-N 1 2 313.348 2.125 20 10 DECDLO CCNC(=O)C(C)(C)C[NH2+][C@@H](C)c1cc(F)cc(F)c1O ZINC000756856771 639705222 /nfs/dbraw/zinc/70/52/22/639705222.db2.gz LKQUGFMWZWWDRY-VIFPVBQESA-N 1 2 300.349 2.483 20 10 DECDLO CCN1CC[N@H+](Cc2cc(OC)cc(C(C)(C)C)c2O)CC1=O ZINC000758275862 639940085 /nfs/dbraw/zinc/94/00/85/639940085.db2.gz IOKMGERJLTWAGX-UHFFFAOYSA-N 1 2 320.433 2.362 20 10 DECDLO CCN1CC[N@@H+](Cc2cc(OC)cc(C(C)(C)C)c2O)CC1=O ZINC000758275862 639940090 /nfs/dbraw/zinc/94/00/90/639940090.db2.gz IOKMGERJLTWAGX-UHFFFAOYSA-N 1 2 320.433 2.362 20 10 DECDLO CC(C)[NH+]1CC(NC(=O)c2cc3cc(O)c(O)cc3s2)C1 ZINC000897493034 640495424 /nfs/dbraw/zinc/49/54/24/640495424.db2.gz OKIBNLGOIWWUFF-UHFFFAOYSA-N 1 2 306.387 2.135 20 10 DECDLO Cn1nccc1[C@@H]1C[N@H+](Cc2c(O)cccc2Cl)CCO1 ZINC000897558187 640798176 /nfs/dbraw/zinc/79/81/76/640798176.db2.gz FMPLIIPKYHGYPP-HNNXBMFYSA-N 1 2 307.781 2.353 20 10 DECDLO Cn1nccc1[C@@H]1C[N@@H+](Cc2c(O)cccc2Cl)CCO1 ZINC000897558187 640798178 /nfs/dbraw/zinc/79/81/78/640798178.db2.gz FMPLIIPKYHGYPP-HNNXBMFYSA-N 1 2 307.781 2.353 20 10 DECDLO Cc1[nH+]c(N2CCOCC2)ccc1NC(=O)C1=CC(=O)CS1 ZINC000771063405 641460383 /nfs/dbraw/zinc/46/03/83/641460383.db2.gz GWOGDLOEBIAGBL-UHFFFAOYSA-N 1 2 319.386 2.246 20 10 DECDLO CN(C)c1ccc(CNC(=O)c2cc(-n3cc[nH+]c3)ccn2)cc1 ZINC000771503193 641520249 /nfs/dbraw/zinc/52/02/49/641520249.db2.gz VIDMFJKSWHIAIP-UHFFFAOYSA-N 1 2 321.384 2.263 20 10 DECDLO CCN(C)c1ccc(C[N@@H+]2CC[C@H](OC)C[C@H]2C(=O)OC)cc1 ZINC000773830166 641827451 /nfs/dbraw/zinc/82/74/51/641827451.db2.gz FAHJTSJYYCFGAF-IRXDYDNUSA-N 1 2 320.433 2.295 20 10 DECDLO CCN(C)c1ccc(C[N@H+]2CC[C@H](OC)C[C@H]2C(=O)OC)cc1 ZINC000773830166 641827454 /nfs/dbraw/zinc/82/74/54/641827454.db2.gz FAHJTSJYYCFGAF-IRXDYDNUSA-N 1 2 320.433 2.295 20 10 DECDLO COC1(CO)CC[NH+](Cc2cc(Cl)cc(F)c2O)CC1 ZINC000775203047 642016048 /nfs/dbraw/zinc/01/60/48/642016048.db2.gz AKGVWBFHNVQAAU-UHFFFAOYSA-N 1 2 303.761 2.158 20 10 DECDLO C[N@H+](CC(=O)NCc1ccco1)Cc1cccc(Cl)c1O ZINC000775647265 642071373 /nfs/dbraw/zinc/07/13/73/642071373.db2.gz TXPZAIIDBOZIAI-UHFFFAOYSA-N 1 2 308.765 2.387 20 10 DECDLO C[N@@H+](CC(=O)NCc1ccco1)Cc1cccc(Cl)c1O ZINC000775647265 642071379 /nfs/dbraw/zinc/07/13/79/642071379.db2.gz TXPZAIIDBOZIAI-UHFFFAOYSA-N 1 2 308.765 2.387 20 10 DECDLO C[C@H]([NH2+]Cc1cccc(Br)c1O)c1nncn1C ZINC000042412005 642582790 /nfs/dbraw/zinc/58/27/90/642582790.db2.gz QBJVOJJBMCGVQK-QMMMGPOBSA-N 1 2 311.183 2.134 20 10 DECDLO CC(C)C[C@H]1C(=O)NCC[N@H+]1Cc1ccc(N(C)C)c(F)c1 ZINC000783729405 643043657 /nfs/dbraw/zinc/04/36/57/643043657.db2.gz YGVGDTZYIUANFA-INIZCTEOSA-N 1 2 307.413 2.238 20 10 DECDLO CC(C)C[C@H]1C(=O)NCC[N@@H+]1Cc1ccc(N(C)C)c(F)c1 ZINC000783729405 643043665 /nfs/dbraw/zinc/04/36/65/643043665.db2.gz YGVGDTZYIUANFA-INIZCTEOSA-N 1 2 307.413 2.238 20 10 DECDLO [O-]c1c(Cl)cccc1C[NH2+][C@@H]1C[NH2+]CC2(CCOCC2)C1 ZINC000903971325 643530976 /nfs/dbraw/zinc/53/09/76/643530976.db2.gz AEXAVHODCYUBKU-ZDUSSCGKSA-N 1 2 310.825 2.294 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@@H+](C)Cc2cnn(C)c2C)c1O ZINC000790445460 643853653 /nfs/dbraw/zinc/85/36/53/643853653.db2.gz SWQNRLODVQLDJV-UHFFFAOYSA-N 1 2 305.353 2.408 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@H+](C)Cc2cnn(C)c2C)c1O ZINC000790445460 643853657 /nfs/dbraw/zinc/85/36/57/643853657.db2.gz SWQNRLODVQLDJV-UHFFFAOYSA-N 1 2 305.353 2.408 20 10 DECDLO Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)CCc1[nH]cc[nH+]1 ZINC000839922414 645311498 /nfs/dbraw/zinc/31/14/98/645311498.db2.gz UEUCOWBBQICFJJ-AWEZNQCLSA-N 1 2 314.433 2.464 20 10 DECDLO OC[C@@H]1CCC[C@@H]1[NH2+]Cc1cccc(Br)c1O ZINC000230679167 646744083 /nfs/dbraw/zinc/74/40/83/646744083.db2.gz CLNUTWIODIPHJK-JQWIXIFHSA-N 1 2 300.196 2.405 20 10 DECDLO CC(=O)NC1CC[NH+](Cc2cc(Cl)c(F)cc2O)CC1 ZINC000816498717 647142858 /nfs/dbraw/zinc/14/28/58/647142858.db2.gz INFBOSBRIJFFGP-UHFFFAOYSA-N 1 2 300.761 2.285 20 10 DECDLO COC(=O)c1ccc([O-])c([C@H](C)[NH2+][C@H](C[NH3+])C2CCCC2)c1 ZINC000817983100 647400805 /nfs/dbraw/zinc/40/08/05/647400805.db2.gz YAVCWYLYSYCOMX-XHDPSFHLSA-N 1 2 306.406 2.347 20 10 DECDLO C[C@@H]1C[NH+](C[C@H]2CCCN2C(=O)C2=CC(=O)CS2)C[C@@H](C)O1 ZINC000731871441 647515992 /nfs/dbraw/zinc/51/59/92/647515992.db2.gz LBRXOGFEZZABEU-JHJVBQTASA-N 1 2 324.446 2.168 20 10 DECDLO COC(=O)[C@@H](C)[N@H+](C)Cc1ccc(Br)cc1O ZINC000825745092 648808287 /nfs/dbraw/zinc/80/82/87/648808287.db2.gz VXBCNMPIJGRMDY-MRVPVSSYSA-N 1 2 302.168 2.148 20 10 DECDLO COC(=O)[C@@H](C)[N@@H+](C)Cc1ccc(Br)cc1O ZINC000825745092 648808291 /nfs/dbraw/zinc/80/82/91/648808291.db2.gz VXBCNMPIJGRMDY-MRVPVSSYSA-N 1 2 302.168 2.148 20 10 DECDLO O=C1OCCN1[C@@H]1CC[N@@H+](Cc2c(O)ccc(Cl)c2F)C1 ZINC000827000761 648959066 /nfs/dbraw/zinc/95/90/66/648959066.db2.gz NRKUSTIRJSIIGE-SECBINFHSA-N 1 2 314.744 2.211 20 10 DECDLO O=C1OCCN1[C@@H]1CC[N@H+](Cc2c(O)ccc(Cl)c2F)C1 ZINC000827000761 648959069 /nfs/dbraw/zinc/95/90/69/648959069.db2.gz NRKUSTIRJSIIGE-SECBINFHSA-N 1 2 314.744 2.211 20 10 DECDLO COc1ccc(N(C)CC[N@H+](C)CC(=O)c2cccn2C)cc1 ZINC000844402491 651123357 /nfs/dbraw/zinc/12/33/57/651123357.db2.gz ZRBOKRWPNGESPK-UHFFFAOYSA-N 1 2 315.417 2.285 20 10 DECDLO COc1ccc(N(C)CC[N@@H+](C)CC(=O)c2cccn2C)cc1 ZINC000844402491 651123358 /nfs/dbraw/zinc/12/33/58/651123358.db2.gz ZRBOKRWPNGESPK-UHFFFAOYSA-N 1 2 315.417 2.285 20 10 DECDLO COCc1cc(C[N@H+](C)CCN(C)c2ccc(OC)cc2)no1 ZINC000846051474 651304431 /nfs/dbraw/zinc/30/44/31/651304431.db2.gz HSFYGMVRRAYTJE-UHFFFAOYSA-N 1 2 319.405 2.398 20 10 DECDLO COCc1cc(C[N@@H+](C)CCN(C)c2ccc(OC)cc2)no1 ZINC000846051474 651304432 /nfs/dbraw/zinc/30/44/32/651304432.db2.gz HSFYGMVRRAYTJE-UHFFFAOYSA-N 1 2 319.405 2.398 20 10 DECDLO O=C(NCc1cc(Cl)ccc1O)[C@H]1CCc2[nH+]ccn2C1 ZINC000846472170 651332273 /nfs/dbraw/zinc/33/22/73/651332273.db2.gz HZBNCWVYXFBKPK-JTQLQIEISA-N 1 2 305.765 2.121 20 10 DECDLO CCN(CC)c1ccc(CNC(=O)NCCn2cc[nH+]c2)cc1 ZINC000079897857 683976157 /nfs/dbraw/zinc/97/61/57/683976157.db2.gz ABKGEWZPKXWECZ-UHFFFAOYSA-N 1 2 315.421 2.229 20 10 DECDLO CCc1cccc(C[NH2+][C@H](C[C@@H]2CCCOC2)C(=O)OC)c1O ZINC000862515962 686313002 /nfs/dbraw/zinc/31/30/02/686313002.db2.gz GWJHUPHSVPJRIE-XJKSGUPXSA-N 1 2 321.417 2.403 20 10 DECDLO O=C(NCCCNc1cccc[nH+]1)N1Cc2cccc(O)c2C1 ZINC000875093806 689570235 /nfs/dbraw/zinc/57/02/35/689570235.db2.gz GTKZIIJSFVMZDC-UHFFFAOYSA-N 1 2 312.373 2.315 20 10 DECDLO CC(C)C[C@H](C(=O)NCCc1ccc(N)cc1)n1cc[nH+]c1 ZINC000876528518 689847485 /nfs/dbraw/zinc/84/74/85/689847485.db2.gz RVQLESLZMROBAA-MRXNPFEDSA-N 1 2 300.406 2.411 20 10 DECDLO COCCOc1ncccc1C[NH2+]Cc1ccc(F)c(F)c1O ZINC000876934667 689976151 /nfs/dbraw/zinc/97/61/51/689976151.db2.gz ICBVFEZPYAIKEJ-UHFFFAOYSA-N 1 2 324.327 2.380 20 10 DECDLO OC[C@@H]1C[N@H+](Cc2ccc(F)c(F)c2O)C[C@H]1C(F)(F)F ZINC000877693096 690193356 /nfs/dbraw/zinc/19/33/56/690193356.db2.gz AUARZNLZJQKXRK-DTWKUNHWSA-N 1 2 311.250 2.273 20 10 DECDLO OC[C@@H]1C[N@@H+](Cc2ccc(F)c(F)c2O)C[C@H]1C(F)(F)F ZINC000877693096 690193360 /nfs/dbraw/zinc/19/33/60/690193360.db2.gz AUARZNLZJQKXRK-DTWKUNHWSA-N 1 2 311.250 2.273 20 10 DECDLO C[C@@H]1C[N@@H+](Cc2cc(F)cc(F)c2O)C[C@@]2(CCCOC2)O1 ZINC001350320538 1151344259 /nfs/dbraw/zinc/34/42/59/1151344259.db2.gz ZXVBVXNEGDCUMR-BDJLRTHQSA-N 1 2 313.344 2.440 20 10 DECDLO O=C1CCC[N@@H+](Cc2ccc(N3CCOCC3)cc2F)CC1 ZINC001140665124 777539472 /nfs/dbraw/zinc/53/94/72/777539472.db2.gz FAFKSMCQBFKALB-UHFFFAOYSA-N 1 2 306.381 2.217 20 10 DECDLO O=C1CCC[N@H+](Cc2ccc(N3CCOCC3)cc2F)CC1 ZINC001140665124 777539476 /nfs/dbraw/zinc/53/94/76/777539476.db2.gz FAFKSMCQBFKALB-UHFFFAOYSA-N 1 2 306.381 2.217 20 10 DECDLO Oc1c(F)cc(Br)cc1C[NH2+]CCN1CCC1 ZINC000715811380 792524342 /nfs/dbraw/zinc/52/43/42/792524342.db2.gz DQNKBBHWNMEBPH-UHFFFAOYSA-N 1 2 303.175 2.089 20 10 DECDLO Oc1cccc(F)c1C[NH+]1CCN(c2nccnc2Cl)CC1 ZINC001137832952 796144190 /nfs/dbraw/zinc/14/41/90/796144190.db2.gz NHRKTZSENJAGJL-UHFFFAOYSA-N 1 2 322.771 2.297 20 10 DECDLO COc1cccnc1N1CC[NH+](Cc2cccc(F)c2O)CC1 ZINC001138129498 796168097 /nfs/dbraw/zinc/16/80/97/796168097.db2.gz HOQOIDDTZNRMGX-UHFFFAOYSA-N 1 2 317.364 2.257 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CC[C@@](C)(O)[C@@H](F)C1 ZINC001139126289 796327659 /nfs/dbraw/zinc/32/76/59/796327659.db2.gz DSDDLYIHSCDOAH-WMLDXEAASA-N 1 2 321.348 2.102 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CC[C@@](C)(O)[C@@H](F)C1 ZINC001139126289 796327663 /nfs/dbraw/zinc/32/76/63/796327663.db2.gz DSDDLYIHSCDOAH-WMLDXEAASA-N 1 2 321.348 2.102 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CC[C@H](O)[C@@H](F)CC1 ZINC001139126774 796327889 /nfs/dbraw/zinc/32/78/89/796327889.db2.gz PTMZGFKENHJGBM-ZFWWWQNUSA-N 1 2 321.348 2.102 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CC[C@H](O)[C@@H](F)CC1 ZINC001139126774 796327890 /nfs/dbraw/zinc/32/78/90/796327890.db2.gz PTMZGFKENHJGBM-ZFWWWQNUSA-N 1 2 321.348 2.102 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CCC[C@@](C)(O)C1 ZINC001139129157 796328708 /nfs/dbraw/zinc/32/87/08/796328708.db2.gz OQLDOFFLPCAXGB-QGZVFWFLSA-N 1 2 303.358 2.154 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CCC[C@@](C)(O)C1 ZINC001139129157 796328714 /nfs/dbraw/zinc/32/87/14/796328714.db2.gz OQLDOFFLPCAXGB-QGZVFWFLSA-N 1 2 303.358 2.154 20 10 DECDLO CC[NH+](CC)C[C@H]1CN(Cc2c(F)ccc(F)c2O)CCO1 ZINC001139690253 796411240 /nfs/dbraw/zinc/41/12/40/796411240.db2.gz TWKAGJBNDDGYKX-LBPRGKRZSA-N 1 2 314.376 2.213 20 10 DECDLO COc1ncc(C[NH+]2CCN(c3ccc(OC)cc3)CC2)s1 ZINC001139815140 796429919 /nfs/dbraw/zinc/42/99/19/796429919.db2.gz YGPUCLFFMVNUKT-UHFFFAOYSA-N 1 2 319.430 2.483 20 10 DECDLO COCCCC[NH+]1CCN(Cc2c(O)cc(F)cc2F)CC1 ZINC001140585982 796541736 /nfs/dbraw/zinc/54/17/36/796541736.db2.gz YJPPUFJOBBROCQ-UHFFFAOYSA-N 1 2 314.376 2.215 20 10 DECDLO COc1cc(O)c(C[N@H+](C)Cc2cc(C)nn2C)c(OC)c1 ZINC001141028649 796620053 /nfs/dbraw/zinc/62/00/53/796620053.db2.gz YKHKHYFRECRPIO-UHFFFAOYSA-N 1 2 305.378 2.083 20 10 DECDLO COc1cc(O)c(C[N@@H+](C)Cc2cc(C)nn2C)c(OC)c1 ZINC001141028649 796620059 /nfs/dbraw/zinc/62/00/59/796620059.db2.gz YKHKHYFRECRPIO-UHFFFAOYSA-N 1 2 305.378 2.083 20 10 DECDLO OC[C@]1(C(F)(F)F)CC[N@H+](Cc2cc(F)c(F)cc2O)C1 ZINC001142508492 796746664 /nfs/dbraw/zinc/74/66/64/796746664.db2.gz APFWOEAPCJCRLB-LBPRGKRZSA-N 1 2 311.250 2.417 20 10 DECDLO OC[C@]1(C(F)(F)F)CC[N@@H+](Cc2cc(F)c(F)cc2O)C1 ZINC001142508492 796746667 /nfs/dbraw/zinc/74/66/67/796746667.db2.gz APFWOEAPCJCRLB-LBPRGKRZSA-N 1 2 311.250 2.417 20 10 DECDLO Nc1[nH]c2cc(C(=O)N3CCc4cccc(O)c4C3)ccc2[nH+]1 ZINC001156969309 798119901 /nfs/dbraw/zinc/11/99/01/798119901.db2.gz CVTLNIMNAILLNY-UHFFFAOYSA-N 1 2 308.341 2.049 20 10 DECDLO Oc1ccc(CNc2cc(N3CCCCC3)nc[nH+]2)cc1O ZINC001158997856 798501709 /nfs/dbraw/zinc/50/17/09/798501709.db2.gz RBHFDKRHROVMHE-UHFFFAOYSA-N 1 2 300.362 2.490 20 10 DECDLO Oc1ccc(CNc2cc(N3CCCCC3)[nH+]cn2)cc1O ZINC001158997856 798501712 /nfs/dbraw/zinc/50/17/12/798501712.db2.gz RBHFDKRHROVMHE-UHFFFAOYSA-N 1 2 300.362 2.490 20 10 DECDLO COC(=O)c1ccc2c(c1)C[N@@H+](Cc1ccc(O)c(O)c1)CC2 ZINC001203882675 800139557 /nfs/dbraw/zinc/13/95/57/800139557.db2.gz QDRZKHWDGFEXJT-UHFFFAOYSA-N 1 2 313.353 2.443 20 10 DECDLO COC(=O)c1ccc2c(c1)C[N@H+](Cc1ccc(O)c(O)c1)CC2 ZINC001203882675 800139559 /nfs/dbraw/zinc/13/95/59/800139559.db2.gz QDRZKHWDGFEXJT-UHFFFAOYSA-N 1 2 313.353 2.443 20 10 DECDLO COc1ccc(N2CC[NH+](Cc3[nH]cnc3C)CC2)c(OC)c1 ZINC001204592872 800237981 /nfs/dbraw/zinc/23/79/81/800237981.db2.gz BIUZEAAXIGHPSB-UHFFFAOYSA-N 1 2 316.405 2.058 20 10 DECDLO CC(C)OCC[NH+]1CCN(Cc2cc(F)c(F)cc2O)CC1 ZINC001204690334 800246965 /nfs/dbraw/zinc/24/69/65/800246965.db2.gz OZEUTDKEMCHIIO-UHFFFAOYSA-N 1 2 314.376 2.213 20 10 DECDLO CC(C)[N@H+](Cc1cc(C(=O)[O-])ccc1O)C1CC[NH+](C)CC1 ZINC001231568946 801688043 /nfs/dbraw/zinc/68/80/43/801688043.db2.gz SFZUATYJVAKHAQ-UHFFFAOYSA-N 1 2 306.406 2.395 20 10 DECDLO COC(=O)[C@@H]1CCCC[N@@H+]1Cc1ccc(N(C)C)cc1OC ZINC001231851822 801737355 /nfs/dbraw/zinc/73/73/55/801737355.db2.gz NFDBHLRGROPPPX-HNNXBMFYSA-N 1 2 306.406 2.289 20 10 DECDLO COC(=O)[C@@H]1CCCC[N@H+]1Cc1ccc(N(C)C)cc1OC ZINC001231851822 801737357 /nfs/dbraw/zinc/73/73/57/801737357.db2.gz NFDBHLRGROPPPX-HNNXBMFYSA-N 1 2 306.406 2.289 20 10 DECDLO C[C@@H]1C[N@H+](Cc2c(O)cc(Br)cc2F)CC[C@H]1O ZINC001233028317 802006609 /nfs/dbraw/zinc/00/66/09/802006609.db2.gz NFYFIOKQUPMYKQ-PRHODGIISA-N 1 2 318.186 2.497 20 10 DECDLO C[C@@H]1C[N@@H+](Cc2c(O)cc(Br)cc2F)CC[C@H]1O ZINC001233028317 802006619 /nfs/dbraw/zinc/00/66/19/802006619.db2.gz NFYFIOKQUPMYKQ-PRHODGIISA-N 1 2 318.186 2.497 20 10 DECDLO Oc1c(C[N@@H+]2CC[C@H](Oc3cnccn3)C2)ccc(F)c1F ZINC001233080225 802022357 /nfs/dbraw/zinc/02/23/57/802022357.db2.gz SSBZACSMMQYUDG-NSHDSACASA-N 1 2 307.300 2.114 20 10 DECDLO Oc1c(CN2CC([NH+]3CCC(F)CC3)C2)ccc(F)c1F ZINC001233078011 802022428 /nfs/dbraw/zinc/02/24/28/802022428.db2.gz CMIMGCIKNNRVHZ-UHFFFAOYSA-N 1 2 300.324 2.289 20 10 DECDLO COc1cc(Cl)cc(C[N@@H+]2CCc3ncn(C)c3C2)c1O ZINC001233290802 802064757 /nfs/dbraw/zinc/06/47/57/802064757.db2.gz XCBZWVSRJPFEBY-UHFFFAOYSA-N 1 2 307.781 2.346 20 10 DECDLO COc1cc(Cl)cc(C[N@H+]2CCc3ncn(C)c3C2)c1O ZINC001233290802 802064763 /nfs/dbraw/zinc/06/47/63/802064763.db2.gz XCBZWVSRJPFEBY-UHFFFAOYSA-N 1 2 307.781 2.346 20 10 DECDLO C[C@@H]1[C@H](CC(=O)[O-])CC[C@@H]1[NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1 ZINC001594182460 998701236 /nfs/dbraw/zinc/70/12/36/998701236.db2.gz BEKOXEHTHWGNIJ-UOJCXKCYSA-N 1 2 319.449 2.231 20 10 DECDLO C[C@@H](C[NH2+][C@H](C)c1cccc(-c2nn[nH]n2)c1O)c1ccncc1 ZINC001603551788 1069986607 /nfs/dbraw/zinc/98/66/07/1069986607.db2.gz GGXWVCHBZXVJJV-NWDGAFQWSA-N 1 2 324.388 2.422 20 10 DECDLO CC[C@H]([NH2+]C[C@H]1CC[C@@H](C)O1)c1cccc(-c2nn[nH]n2)c1O ZINC001604056492 1070190829 /nfs/dbraw/zinc/19/08/29/1070190829.db2.gz ULWQBYFWZHOBCB-GYSYKLTISA-N 1 2 317.393 2.181 20 10 DECDLO C[C@H]([NH2+]C[C@@H]([NH3+])c1ccccc1)c1cc(C(=O)[O-])ccc1O ZINC001604332148 1070332528 /nfs/dbraw/zinc/33/25/28/1070332528.db2.gz IDVWYCUKXDOQPR-XHDPSFHLSA-N 1 2 300.358 2.441 20 10 DECDLO COC1CCC([NH2+][C@H](C)c2cccc(-c3nn[nH]n3)c2O)CC1 ZINC001605029653 1070583666 /nfs/dbraw/zinc/58/36/66/1070583666.db2.gz MHTXVVVTNXELQD-VOMCLLRMSA-N 1 2 317.393 2.181 20 10 DECDLO C[C@H](Cn1cc[nH+]c1)NC(=O)c1cc2cc(O)c(O)cc2s1 ZINC001464159531 1059085701 /nfs/dbraw/zinc/08/57/01/1059085701.db2.gz RBQZULLRTCKUAC-SECBINFHSA-N 1 2 317.370 2.328 20 10 DECDLO CCC(=O)N1CC[C@H]([NH2+]Cc2cc(Cl)cc(F)c2O)C1 ZINC001474068212 1060808365 /nfs/dbraw/zinc/80/83/65/1060808365.db2.gz SUXZMPQYPXBLRR-NSHDSACASA-N 1 2 300.761 2.285 20 10 DECDLO C[C@@]1(C[NH2+]Cc2cc(Cl)cc(Cl)c2[O-])C[NH2+]CCO1 ZINC001576526700 1066628359 /nfs/dbraw/zinc/62/83/59/1066628359.db2.gz XWXHVKNDGPNQKN-ZDUSSCGKSA-N 1 2 305.205 2.167 20 10 DECDLO O=C(N[C@H]1CCn2c[nH+]cc21)c1cc2cc(O)c(O)cc2s1 ZINC001634084927 1078418690 /nfs/dbraw/zinc/41/86/90/1078418690.db2.gz LSSBALGFZNVTQX-VIFPVBQESA-N 1 2 315.354 2.384 20 10 DECDLO CC[N@@H+]1CC[C@H]1C(=O)NCc1cc(Cl)cc(Cl)c1O ZINC001638305976 1078557086 /nfs/dbraw/zinc/55/70/86/1078557086.db2.gz SAYPRSBXQYERPE-NSHDSACASA-N 1 2 303.189 2.409 20 10 DECDLO CC[N@H+]1CC[C@H]1C(=O)NCc1cc(Cl)cc(Cl)c1O ZINC001638305976 1078557089 /nfs/dbraw/zinc/55/70/89/1078557089.db2.gz SAYPRSBXQYERPE-NSHDSACASA-N 1 2 303.189 2.409 20 10 DECDLO CC[C@@H]([NH2+][C@@H](C)CSC)c1cccc(-c2nn[nH]n2)c1O ZINC001590461346 1076630742 /nfs/dbraw/zinc/63/07/42/1076630742.db2.gz BEYCZQQLOOLVFX-JOYOIKCWSA-N 1 2 307.423 2.365 20 10 DECDLO CC[C@H]([NH2+]C[C@H](OC)C1CC1)c1cccc(-c2nn[nH]n2)c1O ZINC001590462462 1076631534 /nfs/dbraw/zinc/63/15/34/1076631534.db2.gz CQKUVAIOZJBCSB-KBPBESRZSA-N 1 2 317.393 2.038 20 10 DECDLO CC[C@@H]([NH2+]C[C@@H](O)CC(C)C)c1cccc(-c2nn[nH]n2)c1O ZINC001590462885 1076631712 /nfs/dbraw/zinc/63/17/12/1076631712.db2.gz GGVJAJIDWNWPNV-SMDDNHRTSA-N 1 2 319.409 2.020 20 10 DECDLO CC[C@H]([NH2+]C[C@H](C)C[C@H](C)O)c1cccc(-c2nn[nH]n2)c1O ZINC001590464897 1076633040 /nfs/dbraw/zinc/63/30/40/1076633040.db2.gz RCXLMTUNNOAHGC-SUNKGSAMSA-N 1 2 319.409 2.020 20 10 DECDLO O=S(=O)(CC[NH2+]Cc1cc(Cl)cc(F)c1O)CC1CC1 ZINC001655798645 1080018753 /nfs/dbraw/zinc/01/87/53/1080018753.db2.gz HWNCWXRLPXWEJX-UHFFFAOYSA-N 1 2 321.801 2.099 20 10 DECDLO Oc1cc(Cl)ccc1C[NH2+]Cc1nc([C@@H]2CCCO2)n[nH]1 ZINC001659541628 1080243417 /nfs/dbraw/zinc/24/34/17/1080243417.db2.gz AVEBYIFPXLLWOJ-LBPRGKRZSA-N 1 2 308.769 2.305 20 10 DECDLO Oc1cccc(F)c1C[NH2+]Cc1n[nH]cc1Br ZINC001660749348 1080391839 /nfs/dbraw/zinc/39/18/39/1080391839.db2.gz WDFDUASRROPJHF-UHFFFAOYSA-N 1 2 300.131 2.307 20 10 DECDLO COC(=O)[C@@H](C)[N@H+](C)Cc1cc(Br)c(C)cc1O ZINC001237678717 1080473337 /nfs/dbraw/zinc/47/33/37/1080473337.db2.gz LIXNDUQRVAJFMH-SECBINFHSA-N 1 2 316.195 2.456 20 10 DECDLO COC(=O)[C@@H](C)[N@@H+](C)Cc1cc(Br)c(C)cc1O ZINC001237678717 1080473339 /nfs/dbraw/zinc/47/33/39/1080473339.db2.gz LIXNDUQRVAJFMH-SECBINFHSA-N 1 2 316.195 2.456 20 10 DECDLO CC(C)NC(=O)N1CC2(C1)C[NH+](Cc1cccc(Cl)c1O)C2 ZINC001276380500 1083746640 /nfs/dbraw/zinc/74/66/40/1083746640.db2.gz XQPWYNPHQVBOKZ-UHFFFAOYSA-N 1 2 323.824 2.281 20 10 DECDLO Oc1c(Br)cc(F)cc1C[N@@H+]1C[C@@H]2COC[C@@H]2C1 ZINC001235294105 1084375400 /nfs/dbraw/zinc/37/54/00/1084375400.db2.gz NFXRVTJQKBJZEB-AOOOYVTPSA-N 1 2 316.170 2.372 20 10 DECDLO Oc1c(Br)cc(F)cc1C[N@H+]1C[C@@H]2COC[C@@H]2C1 ZINC001235294105 1084375408 /nfs/dbraw/zinc/37/54/08/1084375408.db2.gz NFXRVTJQKBJZEB-AOOOYVTPSA-N 1 2 316.170 2.372 20 10 DECDLO COc1ccc(C[N@H+]2CCc3nccn3CC2)c(O)c1Cl ZINC001236808382 1138435028 /nfs/dbraw/zinc/43/50/28/1138435028.db2.gz XWOGBVDDWIWBSE-UHFFFAOYSA-N 1 2 307.781 2.309 20 10 DECDLO COc1ccc(C[N@@H+]2CCc3nccn3CC2)c(O)c1Cl ZINC001236808382 1138435032 /nfs/dbraw/zinc/43/50/32/1138435032.db2.gz XWOGBVDDWIWBSE-UHFFFAOYSA-N 1 2 307.781 2.309 20 10 DECDLO COC(=O)CC1C[NH+](Cc2c(O)cccc2OC(F)(F)F)C1 ZINC001237123874 1138507952 /nfs/dbraw/zinc/50/79/52/1138507952.db2.gz UIVSCSKWRNUHEJ-UHFFFAOYSA-N 1 2 319.279 2.286 20 10 DECDLO CNC(=O)N[C@H]1CCC[N@H+](Cc2cc(F)c(Cl)cc2O)C1 ZINC001237940900 1138811800 /nfs/dbraw/zinc/81/18/00/1138811800.db2.gz PABCGGWHDSLPGP-JTQLQIEISA-N 1 2 315.776 2.078 20 10 DECDLO CNC(=O)C1CC[NH+](Cc2cc(Cl)cc(C(C)=O)c2O)CC1 ZINC000194805418 529842391 /nfs/dbraw/zinc/84/23/91/529842391.db2.gz RDLLHFMYMGWIIV-UHFFFAOYSA-N 1 2 324.808 2.206 20 10 DECDLO COc1ccc(N2CC[NH+](Cc3cc(C)no3)CC2)cc1F ZINC000084866041 355488314 /nfs/dbraw/zinc/48/83/14/355488314.db2.gz SRCNHSWVGLLFAX-UHFFFAOYSA-N 1 2 305.353 2.453 20 10 DECDLO COCC[N@H+](Cc1cc(Cl)cc(Cl)c1O)[C@@H](C)C(N)=O ZINC000093138410 193207384 /nfs/dbraw/zinc/20/73/84/193207384.db2.gz NJMKZKJPVDZUTQ-QMMMGPOBSA-N 1 2 321.204 2.021 20 10 DECDLO COCC[N@@H+](Cc1cc(Cl)cc(Cl)c1O)[C@@H](C)C(N)=O ZINC000093138410 193207386 /nfs/dbraw/zinc/20/73/86/193207386.db2.gz NJMKZKJPVDZUTQ-QMMMGPOBSA-N 1 2 321.204 2.021 20 10 DECDLO C[C@@H]1C[C@@H]([NH2+][C@@H](C(N)=O)c2ccccn2)c2c1c(F)ccc2O ZINC000834828256 649852599 /nfs/dbraw/zinc/85/25/99/649852599.db2.gz QTHCJZATOVUUHI-VYROHLMNSA-N 1 2 315.348 2.291 20 10 DECDLO CC(C)[N@H+](CCS(C)(=O)=O)Cc1ccc(N(C)C)c(F)c1 ZINC000131682056 401854791 /nfs/dbraw/zinc/85/47/91/401854791.db2.gz DHMJPLFKZQBZIY-UHFFFAOYSA-N 1 2 316.442 2.147 20 10 DECDLO CC(C)[N@@H+](CCS(C)(=O)=O)Cc1ccc(N(C)C)c(F)c1 ZINC000131682056 401854793 /nfs/dbraw/zinc/85/47/93/401854793.db2.gz DHMJPLFKZQBZIY-UHFFFAOYSA-N 1 2 316.442 2.147 20 10 DECDLO O=C(c1ccccc1)N1CC[NH+](Cc2cc(F)ccc2O)CC1 ZINC000183245164 402749778 /nfs/dbraw/zinc/74/97/78/402749778.db2.gz JBPBBOSLULMTFD-UHFFFAOYSA-N 1 2 314.360 2.489 20 10 DECDLO CCOC1CC(O)(C[NH2+][C@@H](C)c2ccc(F)c(F)c2O)C1 ZINC000278398608 402864161 /nfs/dbraw/zinc/86/41/61/402864161.db2.gz GJQURKGUDIINQT-YLTRJXTNSA-N 1 2 301.333 2.251 20 10 DECDLO COc1cc(Cl)cc(C[N@@H+]2CC[S@](=O)C[C@H](C)C2)c1O ZINC000277627124 403238474 /nfs/dbraw/zinc/23/84/74/403238474.db2.gz XMGUGGIMJOCXNO-SBKAZYGRSA-N 1 2 317.838 2.255 20 10 DECDLO COc1cc(Cl)cc(C[N@H+]2CC[S@](=O)C[C@H](C)C2)c1O ZINC000277627124 403238476 /nfs/dbraw/zinc/23/84/76/403238476.db2.gz XMGUGGIMJOCXNO-SBKAZYGRSA-N 1 2 317.838 2.255 20 10 DECDLO CC[N@H+](CCS(C)(=O)=O)Cc1cc(Cl)c(F)cc1O ZINC000294200387 403671597 /nfs/dbraw/zinc/67/15/97/403671597.db2.gz KTNFZFQNODMRPT-UHFFFAOYSA-N 1 2 309.790 2.051 20 10 DECDLO CC[N@@H+](CCS(C)(=O)=O)Cc1cc(Cl)c(F)cc1O ZINC000294200387 403671601 /nfs/dbraw/zinc/67/16/01/403671601.db2.gz KTNFZFQNODMRPT-UHFFFAOYSA-N 1 2 309.790 2.051 20 10 DECDLO CC(=O)N1CC[N@H+](Cc2cc(Cl)c(F)cc2O)[C@H](C)C1 ZINC000295066879 403749379 /nfs/dbraw/zinc/74/93/79/403749379.db2.gz AMDPUXCYXLPOOG-SECBINFHSA-N 1 2 300.761 2.237 20 10 DECDLO CC(=O)N1CC[N@@H+](Cc2cc(Cl)c(F)cc2O)[C@H](C)C1 ZINC000295066879 403749383 /nfs/dbraw/zinc/74/93/83/403749383.db2.gz AMDPUXCYXLPOOG-SECBINFHSA-N 1 2 300.761 2.237 20 10 DECDLO O=C(NCc1ccc(N2CCCC2)cc1)[C@H]1CCn2c[nH+]cc2C1 ZINC000372147881 227085262 /nfs/dbraw/zinc/08/52/62/227085262.db2.gz BEZWFDYQIZPOCL-INIZCTEOSA-N 1 2 324.428 2.362 20 10 DECDLO CC(C)COC(=O)C[N@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000181424622 519750064 /nfs/dbraw/zinc/75/00/64/519750064.db2.gz AEVJZENAXMXDML-UHFFFAOYSA-N 1 2 320.433 2.154 20 10 DECDLO CC(C)COC(=O)C[N@@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000181424622 519750065 /nfs/dbraw/zinc/75/00/65/519750065.db2.gz AEVJZENAXMXDML-UHFFFAOYSA-N 1 2 320.433 2.154 20 10 DECDLO Cc1ccc(C(=O)N2CC[C@@H](C)[C@@H](n3cc[nH+]c3)C2)c(O)c1O ZINC000182606718 526122912 /nfs/dbraw/zinc/12/29/12/526122912.db2.gz ZEQPTTADWROMSR-RISCZKNCSA-N 1 2 315.373 2.326 20 10 DECDLO CCc1nnc([C@H](C)[NH2+][C@@H](C)c2cc(C(=O)OC)ccc2O)[nH]1 ZINC000273347968 536153285 /nfs/dbraw/zinc/15/32/85/536153285.db2.gz BCSJNDAPNXTHIH-UWVGGRQHSA-N 1 2 318.377 2.271 20 10 DECDLO CC(C)OCC[NH+]1CCN(Cc2cc(F)cc(F)c2O)CC1 ZINC000894042272 636097500 /nfs/dbraw/zinc/09/75/00/636097500.db2.gz KUHNJYZXQNTJNB-UHFFFAOYSA-N 1 2 314.376 2.213 20 10 DECDLO CCO[C@H](CNCc1c(O)ccc(Cl)c1F)C[NH+](C)C ZINC000922753726 636377248 /nfs/dbraw/zinc/37/72/48/636377248.db2.gz IFCLHEUIDXSQJC-SNVBAGLBSA-N 1 2 304.793 2.241 20 10 DECDLO COC(=O)[C@@H]1[C@@H]2CCC[C@@H]2C[N@@H+]1Cc1cc(F)cc(F)c1O ZINC000894531804 637092671 /nfs/dbraw/zinc/09/26/71/637092671.db2.gz DIMTVRZUYRTFMJ-IUPBHXKESA-N 1 2 311.328 2.444 20 10 DECDLO COC(=O)[C@@H]1[C@@H]2CCC[C@@H]2C[N@H+]1Cc1cc(F)cc(F)c1O ZINC000894531804 637092677 /nfs/dbraw/zinc/09/26/77/637092677.db2.gz DIMTVRZUYRTFMJ-IUPBHXKESA-N 1 2 311.328 2.444 20 10 DECDLO Cc1cc(C[NH2+]Cc2cccc(Br)c2O)nn1C ZINC000840940481 650390451 /nfs/dbraw/zinc/39/04/51/650390451.db2.gz AZRHVOBJTFGAMU-UHFFFAOYSA-N 1 2 310.195 2.486 20 10 DECDLO Oc1c(F)cc(Cl)cc1C[NH2+]C[C@@H]1C[C@@H]2COC[C@@H]2O1 ZINC000896857512 638732936 /nfs/dbraw/zinc/73/29/36/638732936.db2.gz PMVLGVMLTIRSBN-CDMKHQONSA-N 1 2 301.745 2.078 20 10 DECDLO Cc1ccc(NC(=O)NCc2ccccc2O)c(N(C)C)[nH+]1 ZINC000750388278 638738958 /nfs/dbraw/zinc/73/89/58/638738958.db2.gz QWRPNYSEBLCJNX-UHFFFAOYSA-N 1 2 300.362 2.483 20 10 DECDLO COCCN1CCC[C@@H]1C[NH2+][C@@H](C)c1cc(F)cc(F)c1O ZINC000756531835 639669576 /nfs/dbraw/zinc/66/95/76/639669576.db2.gz BEHOGKPZBCKIQD-WCQYABFASA-N 1 2 314.376 2.432 20 10 DECDLO C[C@H]([C@H](C)[NH2+][C@@H](C)c1cc(F)cc(F)c1O)N1CCOCC1 ZINC000756542607 639671145 /nfs/dbraw/zinc/67/11/45/639671145.db2.gz KPIAESAFFIVCFX-SDDRHHMPSA-N 1 2 314.376 2.430 20 10 DECDLO C[C@@H]([NH2+]C[C@H](C)CN1CCOCC1)c1cc(F)cc(F)c1O ZINC000756591047 639678123 /nfs/dbraw/zinc/67/81/23/639678123.db2.gz DYKFNJSWPCSINP-NWDGAFQWSA-N 1 2 314.376 2.289 20 10 DECDLO C[C@@H]1CN(Cc2cc(Cl)cc(F)c2O)[C@@H](C)C[N@@H+]1CCO ZINC000841891362 650594497 /nfs/dbraw/zinc/59/44/97/650594497.db2.gz KQVRRJZDCXUUSE-MNOVXSKESA-N 1 2 316.804 2.072 20 10 DECDLO C[C@@H]1CN(Cc2cc(Cl)cc(F)c2O)[C@@H](C)C[N@H+]1CCO ZINC000841891362 650594499 /nfs/dbraw/zinc/59/44/99/650594499.db2.gz KQVRRJZDCXUUSE-MNOVXSKESA-N 1 2 316.804 2.072 20 10 DECDLO Oc1c(F)cc(Cl)cc1C[N@@H+]1CC[C@@H](N2CCOCC2)C1 ZINC000775657880 642074227 /nfs/dbraw/zinc/07/42/27/642074227.db2.gz BARLIJFMHWZZBC-CYBMUJFWSA-N 1 2 314.788 2.091 20 10 DECDLO Oc1c(F)cc(Cl)cc1C[N@H+]1CC[C@@H](N2CCOCC2)C1 ZINC000775657880 642074229 /nfs/dbraw/zinc/07/42/29/642074229.db2.gz BARLIJFMHWZZBC-CYBMUJFWSA-N 1 2 314.788 2.091 20 10 DECDLO OCCOC1CC[NH+](Cc2cc(Cl)cc(F)c2O)CC1 ZINC000775733519 642086984 /nfs/dbraw/zinc/08/69/84/642086984.db2.gz VQIMSWAATDINMX-UHFFFAOYSA-N 1 2 303.761 2.158 20 10 DECDLO CCOC(=O)[C@H]([NH2+]Cc1cc(C)c(C)cc1O)C1CCOCC1 ZINC000789580811 643751226 /nfs/dbraw/zinc/75/12/26/643751226.db2.gz LNNDVNTYAJHEFS-QGZVFWFLSA-N 1 2 321.417 2.457 20 10 DECDLO CCOC(=O)[C@H]([NH2+]Cc1cc(C)ccc1O)C1CCOCC1 ZINC000789582020 643751466 /nfs/dbraw/zinc/75/14/66/643751466.db2.gz TZXQXDZLCXSLDM-MRXNPFEDSA-N 1 2 307.390 2.149 20 10 DECDLO COc1c(O)c(C[N@@H+]2CCOC[C@H]2C2CCC2)ccc1[N+](=O)[O-] ZINC000843429279 650973522 /nfs/dbraw/zinc/97/35/22/650973522.db2.gz UTPJYOZRMQACSM-AWEZNQCLSA-N 1 2 322.361 2.310 20 10 DECDLO COc1c(O)c(C[N@H+]2CCOC[C@H]2C2CCC2)ccc1[N+](=O)[O-] ZINC000843429279 650973525 /nfs/dbraw/zinc/97/35/25/650973525.db2.gz UTPJYOZRMQACSM-AWEZNQCLSA-N 1 2 322.361 2.310 20 10 DECDLO COc1ccc(O)c(CNc2cc(N3CCCC3)nc[nH+]2)c1 ZINC000811806411 646579964 /nfs/dbraw/zinc/57/99/64/646579964.db2.gz VNEJERVGYYSDLJ-UHFFFAOYSA-N 1 2 300.362 2.403 20 10 DECDLO COc1ccc(O)c(CNc2cc(N3CCCC3)[nH+]cn2)c1 ZINC000811806411 646579967 /nfs/dbraw/zinc/57/99/67/646579967.db2.gz VNEJERVGYYSDLJ-UHFFFAOYSA-N 1 2 300.362 2.403 20 10 DECDLO C[C@@H]([NH2+]Cc1cnn(C)n1)c1cccc(C(F)(F)F)c1O ZINC000815626175 647036622 /nfs/dbraw/zinc/03/66/22/647036622.db2.gz XXNZUOWUIRIDLQ-MRVPVSSYSA-N 1 2 300.284 2.390 20 10 DECDLO CCOC(=O)C[N@@H+](Cc1ccccc1O)C[C@@H]1CCCCO1 ZINC000823581721 648446421 /nfs/dbraw/zinc/44/64/21/648446421.db2.gz OFQHBPBKPCYTJT-HNNXBMFYSA-N 1 2 307.390 2.326 20 10 DECDLO CCOC(=O)C[N@H+](Cc1ccccc1O)C[C@@H]1CCCCO1 ZINC000823581721 648446423 /nfs/dbraw/zinc/44/64/23/648446423.db2.gz OFQHBPBKPCYTJT-HNNXBMFYSA-N 1 2 307.390 2.326 20 10 DECDLO CCn1ccnc1[C@@H](C)[NH2+]Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000825006069 648684692 /nfs/dbraw/zinc/68/46/92/648684692.db2.gz XVJSOVKXWKXIGS-SNVBAGLBSA-N 1 2 320.349 2.376 20 10 DECDLO COc1cc(C[N@@H+]2CC(=O)N(C)C[C@H]2C)c(O)c(C(C)(C)C)c1 ZINC000825629069 648790993 /nfs/dbraw/zinc/79/09/93/648790993.db2.gz QSMZOOCDPRCOAU-GFCCVEGCSA-N 1 2 320.433 2.361 20 10 DECDLO COc1cc(C[N@H+]2CC(=O)N(C)C[C@H]2C)c(O)c(C(C)(C)C)c1 ZINC000825629069 648790995 /nfs/dbraw/zinc/79/09/95/648790995.db2.gz QSMZOOCDPRCOAU-GFCCVEGCSA-N 1 2 320.433 2.361 20 10 DECDLO Oc1c(F)cc(Cl)cc1C[N@@H+]1CC[C@@H](Cn2ccnn2)C1 ZINC000826844890 648935586 /nfs/dbraw/zinc/93/55/86/648935586.db2.gz BGNYHYQLNWNQPL-SNVBAGLBSA-N 1 2 310.760 2.298 20 10 DECDLO Oc1c(F)cc(Cl)cc1C[N@H+]1CC[C@@H](Cn2ccnn2)C1 ZINC000826844890 648935588 /nfs/dbraw/zinc/93/55/88/648935588.db2.gz BGNYHYQLNWNQPL-SNVBAGLBSA-N 1 2 310.760 2.298 20 10 DECDLO Cc1cc(C[N@H+](C)CCS(C)(=O)=O)ccc1N1CCCCC1 ZINC000827661065 649063583 /nfs/dbraw/zinc/06/35/83/649063583.db2.gz JLERWMLLBFKJIO-UHFFFAOYSA-N 1 2 324.490 2.462 20 10 DECDLO Cc1cc(C[N@@H+](C)CCS(C)(=O)=O)ccc1N1CCCCC1 ZINC000827661065 649063587 /nfs/dbraw/zinc/06/35/87/649063587.db2.gz JLERWMLLBFKJIO-UHFFFAOYSA-N 1 2 324.490 2.462 20 10 DECDLO CC(C)NC(=O)CC[NH2+]Cc1cccc(Br)c1O ZINC000101591521 649824019 /nfs/dbraw/zinc/82/40/19/649824019.db2.gz AFQFIHNEKPBQPI-UHFFFAOYSA-N 1 2 315.211 2.159 20 10 DECDLO O=C(NCc1cc(Cl)ccc1O)N[C@@H]1CCn2cc[nH+]c2C1 ZINC000845126880 651207428 /nfs/dbraw/zinc/20/74/28/651207428.db2.gz DESJMOZULRIVTH-GFCCVEGCSA-N 1 2 320.780 2.056 20 10 DECDLO C[C@H]([NH2+]Cc1cnsn1)c1ccc(N2CCOCC2)cc1 ZINC000846846386 651356356 /nfs/dbraw/zinc/35/63/56/651356356.db2.gz VNSGLRQFRQNDNQ-LBPRGKRZSA-N 1 2 304.419 2.226 20 10 DECDLO Oc1cc2c(cc1CN1CC[NH+]([C@H]3CCOC3)CC1)CCCC2 ZINC000853552490 652567231 /nfs/dbraw/zinc/56/72/31/652567231.db2.gz GULYJAYMSBPPRQ-SFHVURJKSA-N 1 2 316.445 2.178 20 10 DECDLO CC[C@@H]([NH2+][C@H](C)C(=O)N(C)OC)c1cccc(Cl)c1O ZINC000858587167 685563445 /nfs/dbraw/zinc/56/34/45/685563445.db2.gz JEXSFAGZOHGDTA-BXKDBHETSA-N 1 2 300.786 2.495 20 10 DECDLO C[C@H](C[S@](C)=O)[N@H+](C)Cc1cc(F)c(N(C)C)cc1F ZINC000862324338 686276264 /nfs/dbraw/zinc/27/62/64/686276264.db2.gz JYQPFYGNXQOKED-SBKAZYGRSA-N 1 2 304.406 2.230 20 10 DECDLO C[C@H](C[S@](C)=O)[N@@H+](C)Cc1cc(F)c(N(C)C)cc1F ZINC000862324338 686276270 /nfs/dbraw/zinc/27/62/70/686276270.db2.gz JYQPFYGNXQOKED-SBKAZYGRSA-N 1 2 304.406 2.230 20 10 DECDLO Cc1ccc(C[N@@H+]2CCO[C@H](C(=O)OC(C)(C)C)C2)c(O)c1 ZINC000876755135 689927710 /nfs/dbraw/zinc/92/77/10/689927710.db2.gz KOPWNVAZKVYPEA-HNNXBMFYSA-N 1 2 307.390 2.243 20 10 DECDLO Cc1ccc(C[N@H+]2CCO[C@H](C(=O)OC(C)(C)C)C2)c(O)c1 ZINC000876755135 689927711 /nfs/dbraw/zinc/92/77/11/689927711.db2.gz KOPWNVAZKVYPEA-HNNXBMFYSA-N 1 2 307.390 2.243 20 10 DECDLO COC(=O)[C@H](C[C@H]1CCCOC1)[NH2+]Cc1ccc(C)cc1O ZINC000877656281 690181167 /nfs/dbraw/zinc/18/11/67/690181167.db2.gz DAVMGHFWOUEYMV-HIFRSBDPSA-N 1 2 307.390 2.149 20 10 DECDLO COC(=O)[C@H](C[C@@H]1CCCOC1)[NH2+]Cc1ccc(C)cc1O ZINC000877656283 690181255 /nfs/dbraw/zinc/18/12/55/690181255.db2.gz DAVMGHFWOUEYMV-ZFWWWQNUSA-N 1 2 307.390 2.149 20 10 DECDLO Oc1c(F)c(F)ccc1C[NH2+]C[C@@H](n1cncn1)C(F)(F)F ZINC000877673472 690186165 /nfs/dbraw/zinc/18/61/65/690186165.db2.gz GECTUDRNBVKALQ-SECBINFHSA-N 1 2 322.237 2.155 20 10 DECDLO COc1ccc(N2CC[NH+](Cc3ccns3)CC2)c(OC)c1 ZINC000877708365 690198524 /nfs/dbraw/zinc/19/85/24/690198524.db2.gz JVWVAOGZGGXDHU-UHFFFAOYSA-N 1 2 319.430 2.483 20 10 DECDLO COc1ccc(N2CC[NH+](Cc3cnc(C)o3)CC2)c(OC)c1 ZINC000877708120 690198858 /nfs/dbraw/zinc/19/88/58/690198858.db2.gz ALQWXUJCAOONOT-UHFFFAOYSA-N 1 2 317.389 2.322 20 10 DECDLO COC(=O)C1CC([NH2+]Cc2cccc(Br)c2O)C1 ZINC000877720447 690204106 /nfs/dbraw/zinc/20/41/06/690204106.db2.gz BZECPESIGWTVST-UHFFFAOYSA-N 1 2 314.179 2.196 20 10 DECDLO CCN(CC)c1ccc(C[NH+]2CCN([S@](C)(=N)=O)CC2)cc1 ZINC000877793906 690232843 /nfs/dbraw/zinc/23/28/43/690232843.db2.gz CSNHMIRXWQZXFX-QFIPXVFZSA-N 1 2 324.494 2.242 20 10 DECDLO Cc1conc1C[N@@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000877923811 690261163 /nfs/dbraw/zinc/26/11/63/690261163.db2.gz XIJVQHDLVJWBBW-UHFFFAOYSA-N 1 2 301.390 2.452 20 10 DECDLO Cc1conc1C[N@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000877923811 690261166 /nfs/dbraw/zinc/26/11/66/690261166.db2.gz XIJVQHDLVJWBBW-UHFFFAOYSA-N 1 2 301.390 2.452 20 10 DECDLO C[C@@]1(CO)CC[N@H+](Cc2cc(Br)c(F)cc2O)C1 ZINC001144298346 790847204 /nfs/dbraw/zinc/84/72/04/790847204.db2.gz CDOKUCVKDWWTTK-CYBMUJFWSA-N 1 2 318.186 2.498 20 10 DECDLO C[C@@]1(CO)CC[N@@H+](Cc2cc(Br)c(F)cc2O)C1 ZINC001144298346 790847221 /nfs/dbraw/zinc/84/72/21/790847221.db2.gz CDOKUCVKDWWTTK-CYBMUJFWSA-N 1 2 318.186 2.498 20 10 DECDLO COC(=O)[C@H](Cc1ccc(O)c(O)c1)[NH2+][C@@H]1C[C@@H]2[C@H](C1)C2(C)C ZINC001170709020 788627271 /nfs/dbraw/zinc/62/72/71/788627271.db2.gz APDNWNDCHSLNIP-FQUUOJAGSA-N 1 2 319.401 2.206 20 10 DECDLO CN1CC[C@@H]1C[NH2+]Cc1cc(Br)cc(F)c1O ZINC000715791260 792511845 /nfs/dbraw/zinc/51/18/45/792511845.db2.gz GKFSFULQIQVMEE-SNVBAGLBSA-N 1 2 303.175 2.088 20 10 DECDLO Oc1c(F)cc(Br)cc1C[NH2+]CCN1CCCC1 ZINC000715816376 792524448 /nfs/dbraw/zinc/52/44/48/792524448.db2.gz ABVHGWKXUQDNGA-UHFFFAOYSA-N 1 2 317.202 2.479 20 10 DECDLO O=C(NCc1ccccc1O)[C@H]1CCCN(c2cccc[nH+]2)C1 ZINC001176970281 794543505 /nfs/dbraw/zinc/54/35/05/794543505.db2.gz LNQYSEWZHWUZJP-HNNXBMFYSA-N 1 2 311.385 2.320 20 10 DECDLO O=C(Cc1ccc(-n2cc[nH+]c2)cc1)NCc1c(O)cccc1O ZINC001178917783 795030111 /nfs/dbraw/zinc/03/01/11/795030111.db2.gz RZTZAZNYEGWARL-UHFFFAOYSA-N 1 2 323.352 2.142 20 10 DECDLO O=C(/C=C\c1ccc(O)c(O)c1)NCc1[nH]c2c([nH+]1)CCCC2 ZINC001178921915 795032861 /nfs/dbraw/zinc/03/28/61/795032861.db2.gz DDQLYZGNQMVGII-VURMDHGXSA-N 1 2 313.357 2.029 20 10 DECDLO CCN(Cc1ccc(N(C)C)cc1)C(=O)Cc1cc[nH+]c(N)c1 ZINC001181257158 795455054 /nfs/dbraw/zinc/45/50/54/795455054.db2.gz SDLVLHFGEJIJRJ-UHFFFAOYSA-N 1 2 312.417 2.321 20 10 DECDLO COc1ccc(N(C)CC[N@H+](C)Cc2nc(CO)cs2)cc1 ZINC001182724844 795743395 /nfs/dbraw/zinc/74/33/95/795743395.db2.gz CCCZQZBZABQEIK-UHFFFAOYSA-N 1 2 321.446 2.212 20 10 DECDLO COc1ccc(N(C)CC[N@@H+](C)Cc2nc(CO)cs2)cc1 ZINC001182724844 795743401 /nfs/dbraw/zinc/74/34/01/795743401.db2.gz CCCZQZBZABQEIK-UHFFFAOYSA-N 1 2 321.446 2.212 20 10 DECDLO COC[C@H]1C[N@H+](Cc2c(O)cccc2F)Cc2cn(C)nc21 ZINC001137834454 796143981 /nfs/dbraw/zinc/14/39/81/796143981.db2.gz HKNHGDHERJYAPZ-GFCCVEGCSA-N 1 2 305.353 2.011 20 10 DECDLO COC[C@H]1C[N@@H+](Cc2c(O)cccc2F)Cc2cn(C)nc21 ZINC001137834454 796143986 /nfs/dbraw/zinc/14/39/86/796143986.db2.gz HKNHGDHERJYAPZ-GFCCVEGCSA-N 1 2 305.353 2.011 20 10 DECDLO CCOCc1nnn2c1C[N@H+](Cc1c(O)cccc1F)CCC2 ZINC001137836240 796144307 /nfs/dbraw/zinc/14/43/07/796144307.db2.gz XEILMCVWVUYGBW-UHFFFAOYSA-N 1 2 320.368 2.065 20 10 DECDLO CCOCc1nnn2c1C[N@@H+](Cc1c(O)cccc1F)CCC2 ZINC001137836240 796144309 /nfs/dbraw/zinc/14/43/09/796144309.db2.gz XEILMCVWVUYGBW-UHFFFAOYSA-N 1 2 320.368 2.065 20 10 DECDLO COc1cc(N2CC[NH+](Cc3c(O)cccc3F)CC2)ccn1 ZINC001137841424 796145222 /nfs/dbraw/zinc/14/52/22/796145222.db2.gz DTMULMVJIYZJQQ-UHFFFAOYSA-N 1 2 317.364 2.257 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[NH+]1CCC(CO)CC1 ZINC001139125660 796326568 /nfs/dbraw/zinc/32/65/68/796326568.db2.gz ZKRCSJNKVWYIMO-UHFFFAOYSA-N 1 2 303.358 2.011 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CCC[C@@H](C)[C@@H]1CO ZINC001139126528 796327848 /nfs/dbraw/zinc/32/78/48/796327848.db2.gz IUSQDBOGCMMQSJ-ABAIWWIYSA-N 1 2 317.385 2.400 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CCC[C@@H](C)[C@@H]1CO ZINC001139126528 796327851 /nfs/dbraw/zinc/32/78/51/796327851.db2.gz IUSQDBOGCMMQSJ-ABAIWWIYSA-N 1 2 317.385 2.400 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CC[C@H](O)C[C@H]1C ZINC001139132720 796330074 /nfs/dbraw/zinc/33/00/74/796330074.db2.gz ZMJDEPSNEKBZKU-NEPJUHHUSA-N 1 2 303.358 2.152 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CC[C@H](O)C[C@H]1C ZINC001139132720 796330079 /nfs/dbraw/zinc/33/00/79/796330079.db2.gz ZMJDEPSNEKBZKU-NEPJUHHUSA-N 1 2 303.358 2.152 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+](C)CCC1OCCO1 ZINC001139131576 796330839 /nfs/dbraw/zinc/33/08/39/796330839.db2.gz PBTNDBMNKMGXFM-UHFFFAOYSA-N 1 2 319.357 2.002 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+](C)CCC1OCCO1 ZINC001139131576 796330844 /nfs/dbraw/zinc/33/08/44/796330844.db2.gz PBTNDBMNKMGXFM-UHFFFAOYSA-N 1 2 319.357 2.002 20 10 DECDLO CCn1nnc2c1CC[N@H+](Cc1cc(C)ccc1O)[C@@H]2COC ZINC001140619455 796547143 /nfs/dbraw/zinc/54/71/43/796547143.db2.gz DNZDPWMWMDLYKV-OAHLLOKOSA-N 1 2 316.405 2.058 20 10 DECDLO CCn1nnc2c1CC[N@@H+](Cc1cc(C)ccc1O)[C@@H]2COC ZINC001140619455 796547145 /nfs/dbraw/zinc/54/71/45/796547145.db2.gz DNZDPWMWMDLYKV-OAHLLOKOSA-N 1 2 316.405 2.058 20 10 DECDLO CCOc1ccc(N2CC[NH+](Cc3cc(C)n[nH]3)CC2)cc1 ZINC001203081103 796603901 /nfs/dbraw/zinc/60/39/01/796603901.db2.gz KMOHQGDXXSZYGT-UHFFFAOYSA-N 1 2 300.406 2.439 20 10 DECDLO CCOC(=O)[C@H]1CCCC[N@@H+]1Cc1c(O)cc(OC)cc1OC ZINC001141028427 796620421 /nfs/dbraw/zinc/62/04/21/796620421.db2.gz NZCAHLVGKZRWEB-CQSZACIVSA-N 1 2 323.389 2.327 20 10 DECDLO CCOC(=O)[C@H]1CCCC[N@H+]1Cc1c(O)cc(OC)cc1OC ZINC001141028427 796620426 /nfs/dbraw/zinc/62/04/26/796620426.db2.gz NZCAHLVGKZRWEB-CQSZACIVSA-N 1 2 323.389 2.327 20 10 DECDLO CCOc1cccc(C[NH+]2CC(Oc3cccnc3)C2)c1O ZINC001203608987 800089074 /nfs/dbraw/zinc/08/90/74/800089074.db2.gz DOZQRFZMGLDBRX-UHFFFAOYSA-N 1 2 300.358 2.449 20 10 DECDLO CCOC(=O)[C@@]12C[C@@H]1CC[N@@H+]2Cc1ccc(N(C)C)cc1OC ZINC001231851826 801737150 /nfs/dbraw/zinc/73/71/50/801737150.db2.gz NGGQFICVLAELFB-KBXCAEBGSA-N 1 2 318.417 2.289 20 10 DECDLO CCOC(=O)[C@@]12C[C@@H]1CC[N@H+]2Cc1ccc(N(C)C)cc1OC ZINC001231851826 801737155 /nfs/dbraw/zinc/73/71/55/801737155.db2.gz NGGQFICVLAELFB-KBXCAEBGSA-N 1 2 318.417 2.289 20 10 DECDLO Cc1cc(N2CC[NH+](Cc3cccc(Cl)c3O)CC2)ncn1 ZINC001231913591 801749775 /nfs/dbraw/zinc/74/97/75/801749775.db2.gz OFVFJWKIMMWYKJ-UHFFFAOYSA-N 1 2 318.808 2.466 20 10 DECDLO COC(=O)c1c(C[N@H+]2C[C@H]3CC[C@@H](C2)O3)c2ccccc2n1C ZINC001232402508 801870518 /nfs/dbraw/zinc/87/05/18/801870518.db2.gz PAJUOFJHGCIZQP-BETUJISGSA-N 1 2 314.385 2.328 20 10 DECDLO COC(=O)c1c(C[N@@H+]2C[C@H]3CC[C@@H](C2)O3)c2ccccc2n1C ZINC001232402508 801870522 /nfs/dbraw/zinc/87/05/22/801870522.db2.gz PAJUOFJHGCIZQP-BETUJISGSA-N 1 2 314.385 2.328 20 10 DECDLO OC[C@H]1CC[N@H+](Cc2c(O)cc(Br)cc2F)C1 ZINC001233029367 802007935 /nfs/dbraw/zinc/00/79/35/802007935.db2.gz BMXHWXOJSHINII-QMMMGPOBSA-N 1 2 304.159 2.108 20 10 DECDLO OC[C@H]1CC[N@@H+](Cc2c(O)cc(Br)cc2F)C1 ZINC001233029367 802007943 /nfs/dbraw/zinc/00/79/43/802007943.db2.gz BMXHWXOJSHINII-QMMMGPOBSA-N 1 2 304.159 2.108 20 10 DECDLO CN(Cc1c(O)cc(Br)cc1F)[C@H]1CC[N@H+](C)C1 ZINC001233031649 802008617 /nfs/dbraw/zinc/00/86/17/802008617.db2.gz JZSGIOFDFGCYFK-JTQLQIEISA-N 1 2 317.202 2.430 20 10 DECDLO CN(Cc1c(O)cc(Br)cc1F)[C@H]1CC[N@@H+](C)C1 ZINC001233031649 802008622 /nfs/dbraw/zinc/00/86/22/802008622.db2.gz JZSGIOFDFGCYFK-JTQLQIEISA-N 1 2 317.202 2.430 20 10 DECDLO OC[C@@]1(C(F)(F)F)CC[N@H+](Cc2c(O)ccc(F)c2F)C1 ZINC001233332507 802078264 /nfs/dbraw/zinc/07/82/64/802078264.db2.gz NHCBFQLQRIWNBQ-GFCCVEGCSA-N 1 2 311.250 2.417 20 10 DECDLO OC[C@@]1(C(F)(F)F)CC[N@@H+](Cc2c(O)ccc(F)c2F)C1 ZINC001233332507 802078272 /nfs/dbraw/zinc/07/82/72/802078272.db2.gz NHCBFQLQRIWNBQ-GFCCVEGCSA-N 1 2 311.250 2.417 20 10 DECDLO COC(=O)C[C@H]([NH3+])c1nnc(-c2ccc(-n3cccc3)cc2)o1 ZINC001217697605 802101023 /nfs/dbraw/zinc/10/10/23/802101023.db2.gz OPXHBACNBCVWTD-ZDUSSCGKSA-N 1 2 312.329 2.090 20 10 DECDLO O=C1CC[C@@H]2C[N@@H+](Cc3cccc(C(F)(F)F)c3O)CCN12 ZINC001233418597 802112319 /nfs/dbraw/zinc/11/23/19/802112319.db2.gz NQUXBAZDIFWSCZ-LLVKDONJSA-N 1 2 314.307 2.218 20 10 DECDLO O=S1(=O)CCC[C@H]1CC[NH2+]Cc1cc(Cl)cc(F)c1O ZINC001334382877 1150289629 /nfs/dbraw/zinc/28/96/29/1150289629.db2.gz BIJBSVJBNNIGDM-NSHDSACASA-N 1 2 321.801 2.242 20 10 DECDLO C[C@@H]([NH2+]Cc1cc(N(C)C)cc[nH+]1)c1cc(C(=O)[O-])ccc1O ZINC001593292109 994674463 /nfs/dbraw/zinc/67/44/63/994674463.db2.gz IFGHZULDYOHFEG-LLVKDONJSA-N 1 2 315.373 2.402 20 10 DECDLO C[C@@H]([NH2+][C@H]1CCCSC1)c1cccc(-c2nn[nH]n2)c1O ZINC001603659303 1070026654 /nfs/dbraw/zinc/02/66/54/1070026654.db2.gz ZXUAUHDMUXHQFO-ZJUUUORDSA-N 1 2 305.407 2.119 20 10 DECDLO CC[C@H]([NH2+][C@@H](C)c1cccc(-c2nn[nH]n2)c1O)[C@@H]1CCCO1 ZINC001604055488 1070188819 /nfs/dbraw/zinc/18/88/19/1070188819.db2.gz PRDJHRHGFNRPBZ-BPNCWPANSA-N 1 2 317.393 2.181 20 10 DECDLO CC[C@H]([NH2+]C[C@H]1CC[C@H](C)O1)c1cccc(-c2nn[nH]n2)c1O ZINC001604056495 1070191177 /nfs/dbraw/zinc/19/11/77/1070191177.db2.gz ULWQBYFWZHOBCB-WDMOLILDSA-N 1 2 317.393 2.181 20 10 DECDLO C[C@H]([NH2+]C[C@H]([NH3+])c1ccccc1)c1cc(C(=O)[O-])ccc1O ZINC001604332147 1070331758 /nfs/dbraw/zinc/33/17/58/1070331758.db2.gz IDVWYCUKXDOQPR-NHYWBVRUSA-N 1 2 300.358 2.441 20 10 DECDLO COC(=O)[C@H](COC1CCC1)[N@H+](C)Cc1ccc(C)cc1O ZINC001461866150 1058728662 /nfs/dbraw/zinc/72/86/62/1058728662.db2.gz USANZWPXGXIPHY-HNNXBMFYSA-N 1 2 307.390 2.243 20 10 DECDLO COC(=O)[C@H](COC1CCC1)[N@@H+](C)Cc1ccc(C)cc1O ZINC001461866150 1058728679 /nfs/dbraw/zinc/72/86/79/1058728679.db2.gz USANZWPXGXIPHY-HNNXBMFYSA-N 1 2 307.390 2.243 20 10 DECDLO CNc1ccc(NCc2ccc([N+](=O)[O-])c(OC)c2O)c[nH+]1 ZINC001578760798 1067165155 /nfs/dbraw/zinc/16/51/55/1067165155.db2.gz UZMDXLXJIJYITR-UHFFFAOYSA-N 1 2 304.306 2.358 20 10 DECDLO O=C(NCc1ccc2cccnc2c1O)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC001638573093 1078571298 /nfs/dbraw/zinc/57/12/98/1078571298.db2.gz IRWSANWEGJOVJY-CHWSQXEVSA-N 1 2 308.341 2.083 20 10 DECDLO O=C(NCc1ccc2cccnc2c1O)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC001638573093 1078571316 /nfs/dbraw/zinc/57/13/16/1078571316.db2.gz IRWSANWEGJOVJY-CHWSQXEVSA-N 1 2 308.341 2.083 20 10 DECDLO C[C@@]1(O)CC[N@H+](Cc2cc(Br)cc(F)c2O)C1 ZINC001235057997 1079006384 /nfs/dbraw/zinc/00/63/84/1079006384.db2.gz GVILYBIHTQDOKA-GFCCVEGCSA-N 1 2 304.159 2.251 20 10 DECDLO C[C@@]1(O)CC[N@@H+](Cc2cc(Br)cc(F)c2O)C1 ZINC001235057997 1079006389 /nfs/dbraw/zinc/00/63/89/1079006389.db2.gz GVILYBIHTQDOKA-GFCCVEGCSA-N 1 2 304.159 2.251 20 10 DECDLO CS(=O)(=O)[C@@H]1CCC[N@H+](Cc2cc(F)c(F)cc2O)CC1 ZINC001560783527 1075146155 /nfs/dbraw/zinc/14/61/55/1075146155.db2.gz GZTSVHHARMRREH-LLVKDONJSA-N 1 2 319.373 2.070 20 10 DECDLO CS(=O)(=O)[C@@H]1CCC[N@@H+](Cc2cc(F)c(F)cc2O)CC1 ZINC001560783527 1075146158 /nfs/dbraw/zinc/14/61/58/1075146158.db2.gz GZTSVHHARMRREH-LLVKDONJSA-N 1 2 319.373 2.070 20 10 DECDLO C[C@@H]([NH2+]C1CCSCC1)c1cccc(-c2nn[nH]n2)c1O ZINC001589952785 1076534028 /nfs/dbraw/zinc/53/40/28/1076534028.db2.gz DBWVFFFWUVMNBL-SECBINFHSA-N 1 2 305.407 2.119 20 10 DECDLO CC[C@H]([NH2+]C[C@@]1(C)CCOC1)c1cccc(-c2nn[nH]n2)c1O ZINC001590462071 1076631775 /nfs/dbraw/zinc/63/17/75/1076631775.db2.gz ALNILPOQXTVSFD-XJKSGUPXSA-N 1 2 317.393 2.040 20 10 DECDLO CC[C@@H]1C[C@H]([NH2+][C@@H](C)c2cccc(-c3nn[nH]n3)c2O)CCO1 ZINC001590504774 1076643038 /nfs/dbraw/zinc/64/30/38/1076643038.db2.gz KZNLOWHIUDYQSG-QJPTWQEYSA-N 1 2 317.393 2.181 20 10 DECDLO CC[C@H]1COCCN1CC[NH2+]Cc1cc(Cl)cc(F)c1O ZINC001657938007 1080191305 /nfs/dbraw/zinc/19/13/05/1080191305.db2.gz RQQKTIJJBUTVJZ-ZDUSSCGKSA-N 1 2 316.804 2.385 20 10 DECDLO OC[C@@H]1C[N@H+](Cc2cc(F)c(F)cc2O)C[C@H]1C(F)(F)F ZINC001658688378 1080215023 /nfs/dbraw/zinc/21/50/23/1080215023.db2.gz BWXGFFGDOMGJJR-DTWKUNHWSA-N 1 2 311.250 2.273 20 10 DECDLO OC[C@@H]1C[N@@H+](Cc2cc(F)c(F)cc2O)C[C@H]1C(F)(F)F ZINC001658688378 1080215030 /nfs/dbraw/zinc/21/50/30/1080215030.db2.gz BWXGFFGDOMGJJR-DTWKUNHWSA-N 1 2 311.250 2.273 20 10 DECDLO COC(=O)C[C@H]1CSCC[N@@H+]1Cc1cc(F)c(F)cc1O ZINC001658851296 1080220435 /nfs/dbraw/zinc/22/04/35/1080220435.db2.gz VDWBPXHDQHHHBK-JTQLQIEISA-N 1 2 317.357 2.151 20 10 DECDLO COC(=O)C[C@H]1CSCC[N@H+]1Cc1cc(F)c(F)cc1O ZINC001658851296 1080220446 /nfs/dbraw/zinc/22/04/46/1080220446.db2.gz VDWBPXHDQHHHBK-JTQLQIEISA-N 1 2 317.357 2.151 20 10 DECDLO COc1c(O)c(C[NH2+][C@H](C)c2csnn2)ccc1[N+](=O)[O-] ZINC001660049594 1080259696 /nfs/dbraw/zinc/25/96/96/1080259696.db2.gz JRVWFJZKKMKCQK-SSDOTTSWSA-N 1 2 310.335 2.011 20 10 DECDLO CS(=O)(=O)c1ccccc1C[NH2+]Cc1cccc(F)c1O ZINC001660036084 1080260010 /nfs/dbraw/zinc/26/00/10/1080260010.db2.gz HJQZHMJFUZJONG-UHFFFAOYSA-N 1 2 309.362 2.225 20 10 DECDLO OC[C@H]1CN(Cc2ccccc2O)CC[N@@H+]1Cc1ccccc1 ZINC001203547303 1084000866 /nfs/dbraw/zinc/00/08/66/1084000866.db2.gz NSBKEVNULMOHLE-GOSISDBHSA-N 1 2 312.413 2.071 20 10 DECDLO OC[C@H]1CN(Cc2ccccc2O)CC[N@H+]1Cc1ccccc1 ZINC001203547303 1084000877 /nfs/dbraw/zinc/00/08/77/1084000877.db2.gz NSBKEVNULMOHLE-GOSISDBHSA-N 1 2 312.413 2.071 20 10 DECDLO C[N@@H+](Cc1cc(F)cc(Br)c1O)CC1COC1 ZINC001235301143 1084378575 /nfs/dbraw/zinc/37/85/75/1084378575.db2.gz DIJQAHXFHNICKD-UHFFFAOYSA-N 1 2 304.159 2.372 20 10 DECDLO C[N@H+](Cc1cc(F)cc(Br)c1O)CC1COC1 ZINC001235301143 1084378584 /nfs/dbraw/zinc/37/85/84/1084378584.db2.gz DIJQAHXFHNICKD-UHFFFAOYSA-N 1 2 304.159 2.372 20 10 DECDLO Brc1c[nH]nc1C[NH2+]Cc1ccc2c(c1)CCO2 ZINC000718139804 1088280749 /nfs/dbraw/zinc/28/07/49/1088280749.db2.gz XQIBPQQKIXGQCG-UHFFFAOYSA-N 1 2 308.179 2.397 20 10 DECDLO Oc1cc(C[N@H+](C2CC2)C2COC2)c(O)cc1Br ZINC001236770478 1138423291 /nfs/dbraw/zinc/42/32/91/1138423291.db2.gz IBMQVAWHHNNOOV-UHFFFAOYSA-N 1 2 314.179 2.224 20 10 DECDLO Oc1cc(C[N@@H+](C2CC2)C2COC2)c(O)cc1Br ZINC001236770478 1138423296 /nfs/dbraw/zinc/42/32/96/1138423296.db2.gz IBMQVAWHHNNOOV-UHFFFAOYSA-N 1 2 314.179 2.224 20 10 DECDLO CCOc1ccc(C[NH+]2CC(Oc3cccnc3)C2)c(O)c1 ZINC001237042702 1138485637 /nfs/dbraw/zinc/48/56/37/1138485637.db2.gz ZIWHAQLMHHWBHU-UHFFFAOYSA-N 1 2 300.358 2.449 20 10 DECDLO CC(=O)N(C)[C@@H]1CC[N@H+](Cc2cc(Cl)cc(F)c2O)C1 ZINC001237622852 1138719569 /nfs/dbraw/zinc/71/95/69/1138719569.db2.gz DKWYRZXOSIKUHL-GFCCVEGCSA-N 1 2 300.761 2.237 20 10 DECDLO CC(=O)N(C)[C@@H]1CC[N@@H+](Cc2cc(Cl)cc(F)c2O)C1 ZINC001237622852 1138719573 /nfs/dbraw/zinc/71/95/73/1138719573.db2.gz DKWYRZXOSIKUHL-GFCCVEGCSA-N 1 2 300.761 2.237 20 10 DECDLO COc1cc(C[NH+]2CC(Oc3cccnc3)C2)c(O)c(OC)c1 ZINC001237677277 1138753228 /nfs/dbraw/zinc/75/32/28/1138753228.db2.gz YSQWEPXMQRMVJJ-UHFFFAOYSA-N 1 2 316.357 2.068 20 10 DECDLO CC(=O)N(C)[C@@H]1CC[N@H+](Cc2cc(F)cc(Cl)c2O)C1 ZINC001237801437 1138792822 /nfs/dbraw/zinc/79/28/22/1138792822.db2.gz IADCKTVULAEVLT-GFCCVEGCSA-N 1 2 300.761 2.237 20 10 DECDLO CC(=O)N(C)[C@@H]1CC[N@@H+](Cc2cc(F)cc(Cl)c2O)C1 ZINC001237801437 1138792829 /nfs/dbraw/zinc/79/28/29/1138792829.db2.gz IADCKTVULAEVLT-GFCCVEGCSA-N 1 2 300.761 2.237 20 10 DECDLO COc1ncnc2c1CC[N@H+](Cc1cc(F)cc(C)c1O)C2 ZINC001238063585 1138819587 /nfs/dbraw/zinc/81/95/87/1138819587.db2.gz ZCRCTUMWHRTEEX-UHFFFAOYSA-N 1 2 303.337 2.197 20 10 DECDLO COc1ncnc2c1CC[N@@H+](Cc1cc(F)cc(C)c1O)C2 ZINC001238063585 1138819588 /nfs/dbraw/zinc/81/95/88/1138819588.db2.gz ZCRCTUMWHRTEEX-UHFFFAOYSA-N 1 2 303.337 2.197 20 10 DECDLO CN(C)c1noc(C[NH2+]Cc2ccc(N3CCCC3)cc2)n1 ZINC001320792808 1140926546 /nfs/dbraw/zinc/92/65/46/1140926546.db2.gz IVXFQGNGCOPPSI-UHFFFAOYSA-N 1 2 301.394 2.026 20 10 DECDLO COC(=O)[C@H](Cc1ccc(O)c(O)c1)[NH2+]C1CCC2(CC2)CC1 ZINC001254432043 1143115666 /nfs/dbraw/zinc/11/56/66/1143115666.db2.gz NHTVBNUQLGYQPE-AWEZNQCLSA-N 1 2 319.401 2.494 20 10 DECDLO C[C@H]([NH2+]Cc1nnc2n1CCCC2)c1cc([N+](=O)[O-])ccc1O ZINC000274251166 299325562 /nfs/dbraw/zinc/32/55/62/299325562.db2.gz SGIUZJGTTZIXOX-JTQLQIEISA-N 1 2 317.349 2.079 20 10 DECDLO C[C@H]([NH2+]CCC1(O)CCOCC1)c1ccc(F)c(F)c1O ZINC000287706325 131295558 /nfs/dbraw/zinc/29/55/58/131295558.db2.gz XGJDPEMSQIQKHG-JTQLQIEISA-N 1 2 301.333 2.253 20 10 DECDLO O=C(NCCCNc1cccc[nH+]1)NCc1ccccc1O ZINC000299472960 132106902 /nfs/dbraw/zinc/10/69/02/132106902.db2.gz DRXRYHOXZRJASP-UHFFFAOYSA-N 1 2 300.362 2.089 20 10 DECDLO C[N@@H+]1CCN(C(=O)c2cccc(O)c2O)[C@H](c2ccccc2)C1 ZINC000184770351 402298839 /nfs/dbraw/zinc/29/88/39/402298839.db2.gz RRGOQSJPLNCLPK-HNNXBMFYSA-N 1 2 312.369 2.227 20 10 DECDLO C[N@H+]1CCN(C(=O)c2cccc(O)c2O)[C@H](c2ccccc2)C1 ZINC000184770351 402298842 /nfs/dbraw/zinc/29/88/42/402298842.db2.gz RRGOQSJPLNCLPK-HNNXBMFYSA-N 1 2 312.369 2.227 20 10 DECDLO CC[N@H+](Cc1cccc(Cl)c1O)[C@H]1CCS(=O)(=O)C1 ZINC000179562430 402594293 /nfs/dbraw/zinc/59/42/93/402594293.db2.gz LHQRUKCLNNSPIW-NSHDSACASA-N 1 2 303.811 2.055 20 10 DECDLO CC[N@@H+](Cc1cccc(Cl)c1O)[C@H]1CCS(=O)(=O)C1 ZINC000179562430 402594295 /nfs/dbraw/zinc/59/42/95/402594295.db2.gz LHQRUKCLNNSPIW-NSHDSACASA-N 1 2 303.811 2.055 20 10 DECDLO O=C1C[N@H+](Cc2ccccc2O)CCN1Cc1cccc(F)c1 ZINC000179579848 402594937 /nfs/dbraw/zinc/59/49/37/402594937.db2.gz GTFUCBKJYMSNJK-UHFFFAOYSA-N 1 2 314.360 2.376 20 10 DECDLO O=C1C[N@@H+](Cc2ccccc2O)CCN1Cc1cccc(F)c1 ZINC000179579848 402594939 /nfs/dbraw/zinc/59/49/39/402594939.db2.gz GTFUCBKJYMSNJK-UHFFFAOYSA-N 1 2 314.360 2.376 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@H+]2C[C@H](C)O[C@@]3(CCOC3)C2)c1O ZINC000280606788 403018325 /nfs/dbraw/zinc/01/83/25/403018325.db2.gz VQIJFZYPXUFCJM-GTNSWQLSSA-N 1 2 323.364 2.114 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@@H+]2C[C@H](C)O[C@@]3(CCOC3)C2)c1O ZINC000280606788 403018327 /nfs/dbraw/zinc/01/83/27/403018327.db2.gz VQIJFZYPXUFCJM-GTNSWQLSSA-N 1 2 323.364 2.114 20 10 DECDLO CC[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1O)[C@H](O)C(F)(F)F ZINC000270776432 403223347 /nfs/dbraw/zinc/22/33/47/403223347.db2.gz BQSSDUCNYRLWKF-KOLCDFICSA-N 1 2 308.256 2.092 20 10 DECDLO CN(C)c1ccc(CN(C)C(=O)CCc2c[nH+]cn2C)cc1 ZINC000276485059 403179727 /nfs/dbraw/zinc/17/97/27/403179727.db2.gz FNZUVGGBCVGHHC-UHFFFAOYSA-N 1 2 300.406 2.077 20 10 DECDLO COCCN1CC[C@H]([NH2+][C@H](C)c2ccc(F)c(F)c2O)C1 ZINC000276930459 403196095 /nfs/dbraw/zinc/19/60/95/403196095.db2.gz ODXATXYGWRYRFT-MNOVXSKESA-N 1 2 300.349 2.042 20 10 DECDLO CCS(=O)(=O)C[C@@H](C)[N@H+](C)Cc1cc(Cl)c(F)cc1O ZINC000295437780 403924416 /nfs/dbraw/zinc/92/44/16/403924416.db2.gz UGHABOBKUSIYDC-SECBINFHSA-N 1 2 323.817 2.440 20 10 DECDLO CCS(=O)(=O)C[C@@H](C)[N@@H+](C)Cc1cc(Cl)c(F)cc1O ZINC000295437780 403924423 /nfs/dbraw/zinc/92/44/23/403924423.db2.gz UGHABOBKUSIYDC-SECBINFHSA-N 1 2 323.817 2.440 20 10 DECDLO C[C@H]1C[N@H+](Cc2c(O)ccc(Cl)c2F)CC[S@](=O)C1 ZINC000365446206 404662413 /nfs/dbraw/zinc/66/24/13/404662413.db2.gz HKFIVWIKUXAVBY-UGZDLDLSSA-N 1 2 305.802 2.385 20 10 DECDLO C[C@H]1C[N@@H+](Cc2c(O)ccc(Cl)c2F)CC[S@](=O)C1 ZINC000365446206 404662416 /nfs/dbraw/zinc/66/24/16/404662416.db2.gz HKFIVWIKUXAVBY-UGZDLDLSSA-N 1 2 305.802 2.385 20 10 DECDLO COC(=O)[C@H]1C[C@@H](OC)CC[N@@H+]1Cc1ccc(N(C)C)c(F)c1 ZINC000359993971 404811601 /nfs/dbraw/zinc/81/16/01/404811601.db2.gz AMQNOCXZZURYGW-XJKSGUPXSA-N 1 2 324.396 2.044 20 10 DECDLO COC(=O)[C@H]1C[C@@H](OC)CC[N@H+]1Cc1ccc(N(C)C)c(F)c1 ZINC000359993971 404811602 /nfs/dbraw/zinc/81/16/02/404811602.db2.gz AMQNOCXZZURYGW-XJKSGUPXSA-N 1 2 324.396 2.044 20 10 DECDLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)N1CCOc2cc(N(C)C)ccc21 ZINC000571535670 406533798 /nfs/dbraw/zinc/53/37/98/406533798.db2.gz SRKSQTYTHSREPH-GFCCVEGCSA-N 1 2 314.389 2.080 20 10 DECDLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)N1CCOc2cc(N(C)C)ccc21 ZINC000571535670 406533802 /nfs/dbraw/zinc/53/38/02/406533802.db2.gz SRKSQTYTHSREPH-GFCCVEGCSA-N 1 2 314.389 2.080 20 10 DECDLO CC[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1O)[C@@H](O)C(F)(F)F ZINC000270776431 280946481 /nfs/dbraw/zinc/94/64/81/280946481.db2.gz BQSSDUCNYRLWKF-GXSJLCMTSA-N 1 2 308.256 2.092 20 10 DECDLO COC(=O)[C@H](CC(C)C)[NH2+]Cc1cc(OC)c(OC)cc1O ZINC000276361066 334076194 /nfs/dbraw/zinc/07/61/94/334076194.db2.gz ALXWMGFHEINCII-LBPRGKRZSA-N 1 2 311.378 2.087 20 10 DECDLO CN(C)c1ccc(/C=C/C[NH+]2CCC(S(C)(=O)=O)CC2)cc1 ZINC000835025651 649867953 /nfs/dbraw/zinc/86/79/53/649867953.db2.gz IPVOGQXCFVNTMP-SNAWJCMRSA-N 1 2 322.474 2.275 20 10 DECDLO CCN(CC)c1ccc(C[N@@H+]2CCC[C@H](O)[C@@H]2C(=O)OC)cc1 ZINC000188776620 520892899 /nfs/dbraw/zinc/89/28/99/520892899.db2.gz AZLKWXLVKDVSEU-DLBZAZTESA-N 1 2 320.433 2.031 20 10 DECDLO CCN(CC)c1ccc(C[N@H+]2CCC[C@H](O)[C@@H]2C(=O)OC)cc1 ZINC000188776620 520892911 /nfs/dbraw/zinc/89/29/11/520892911.db2.gz AZLKWXLVKDVSEU-DLBZAZTESA-N 1 2 320.433 2.031 20 10 DECDLO CC(C)(CC[NH2+]Cc1cc(Cl)cc(F)c1O)S(C)(=O)=O ZINC000840960210 635774230 /nfs/dbraw/zinc/77/42/30/635774230.db2.gz GNVBTSDXDPVQQG-UHFFFAOYSA-N 1 2 323.817 2.488 20 10 DECDLO CC[N@H+](Cc1cc(F)cc(F)c1O)[C@@H](C)CS(=O)(=O)CC ZINC000894025456 636095199 /nfs/dbraw/zinc/09/51/99/636095199.db2.gz BBZRRKBFWXXOFS-JTQLQIEISA-N 1 2 321.389 2.316 20 10 DECDLO CC[N@@H+](Cc1cc(F)cc(F)c1O)[C@@H](C)CS(=O)(=O)CC ZINC000894025456 636095201 /nfs/dbraw/zinc/09/52/01/636095201.db2.gz BBZRRKBFWXXOFS-JTQLQIEISA-N 1 2 321.389 2.316 20 10 DECDLO C[C@H](O)[C@H]1CC[N@H+](Cc2cc(Br)cc(F)c2O)C1 ZINC000894430635 637034613 /nfs/dbraw/zinc/03/46/13/637034613.db2.gz HOWNZENIYVRVSF-IUCAKERBSA-N 1 2 318.186 2.497 20 10 DECDLO C[C@H](O)[C@H]1CC[N@@H+](Cc2cc(Br)cc(F)c2O)C1 ZINC000894430635 637034618 /nfs/dbraw/zinc/03/46/18/637034618.db2.gz HOWNZENIYVRVSF-IUCAKERBSA-N 1 2 318.186 2.497 20 10 DECDLO CCCN(Cc1ccccc1O)C(=O)NCCc1cn(C)c[nH+]1 ZINC000838744203 637643628 /nfs/dbraw/zinc/64/36/28/637643628.db2.gz ISRFDKXIYNJJCL-UHFFFAOYSA-N 1 2 316.405 2.290 20 10 DECDLO COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@@H](C)c2csnn2)c1 ZINC000840885251 650371110 /nfs/dbraw/zinc/37/11/10/650371110.db2.gz AIDOKDUKETVEHO-IUCAKERBSA-N 1 2 307.375 2.442 20 10 DECDLO COc1ccc(N2CC[NH+](Cc3ccc(C)nn3)CC2)cc1F ZINC000840919266 650382272 /nfs/dbraw/zinc/38/22/72/650382272.db2.gz AFXTWSQMXAIVLY-UHFFFAOYSA-N 1 2 316.380 2.255 20 10 DECDLO O=C1CC2(CCC2)[N@H+](Cc2cc(Cl)cc(F)c2O)CCN1 ZINC000895927431 638271009 /nfs/dbraw/zinc/27/10/09/638271009.db2.gz RIKJXDYXMOVQEY-UHFFFAOYSA-N 1 2 312.772 2.429 20 10 DECDLO O=C1CC2(CCC2)[N@@H+](Cc2cc(Cl)cc(F)c2O)CCN1 ZINC000895927431 638271012 /nfs/dbraw/zinc/27/10/12/638271012.db2.gz RIKJXDYXMOVQEY-UHFFFAOYSA-N 1 2 312.772 2.429 20 10 DECDLO Cc1cccn2cc(CCNC(=O)NCc3ccccc3O)[nH+]c12 ZINC000746759978 638375041 /nfs/dbraw/zinc/37/50/41/638375041.db2.gz FLPJWZNOEAKUFK-UHFFFAOYSA-N 1 2 324.384 2.390 20 10 DECDLO Cc1cc(Br)c(O)c(CNCC(F)(F)C[NH3+])c1 ZINC000841059441 650417653 /nfs/dbraw/zinc/41/76/53/650417653.db2.gz DORVBAYPDXNILM-UHFFFAOYSA-N 1 2 309.154 2.147 20 10 DECDLO COCCN(Cc1c[nH+]cn1C)c1ccc(OC)c(OC)c1 ZINC000751481182 639087021 /nfs/dbraw/zinc/08/70/21/639087021.db2.gz HYSGXVAOYQVCHV-UHFFFAOYSA-N 1 2 305.378 2.090 20 10 DECDLO Oc1c(Cl)cccc1C[NH2+]C[C@H]1CCN1C1CCOCC1 ZINC000897227138 639260954 /nfs/dbraw/zinc/26/09/54/639260954.db2.gz BPLWSLILPWOOIL-CQSZACIVSA-N 1 2 310.825 2.389 20 10 DECDLO NC(=O)[C@]12CCC[C@H]1C[N@H+](Cc1cc(Cl)cc(F)c1O)C2 ZINC000897623993 640873919 /nfs/dbraw/zinc/87/39/19/640873919.db2.gz OOQMQKIPPDZIJM-BONVTDFDSA-N 1 2 312.772 2.272 20 10 DECDLO NC(=O)[C@]12CCC[C@H]1C[N@@H+](Cc1cc(Cl)cc(F)c1O)C2 ZINC000897623993 640873921 /nfs/dbraw/zinc/87/39/21/640873921.db2.gz OOQMQKIPPDZIJM-BONVTDFDSA-N 1 2 312.772 2.272 20 10 DECDLO C=Cn1cc(CNC[C@H](c2ccc(N(C)C)cc2)[NH+](C)C)cn1 ZINC000898451493 641663471 /nfs/dbraw/zinc/66/34/71/641663471.db2.gz ZBGSZNJBKSJEBC-GOSISDBHSA-N 1 2 313.449 2.442 20 10 DECDLO Cc1ccc(O)c(CNC(=O)c2cc([C@H]3CCC[N@H+]3C)n[nH]2)c1 ZINC000899133226 641950251 /nfs/dbraw/zinc/95/02/51/641950251.db2.gz JBMMXNTXZOJGKP-OAHLLOKOSA-N 1 2 314.389 2.120 20 10 DECDLO Cc1ccc(O)c(CNC(=O)c2cc([C@H]3CCC[N@@H+]3C)n[nH]2)c1 ZINC000899133226 641950255 /nfs/dbraw/zinc/95/02/55/641950255.db2.gz JBMMXNTXZOJGKP-OAHLLOKOSA-N 1 2 314.389 2.120 20 10 DECDLO COc1c(O)c(C[N@@H+]2CCOC(C)(C)[C@@H]2C)ccc1[N+](=O)[O-] ZINC000774904287 641978893 /nfs/dbraw/zinc/97/88/93/641978893.db2.gz GDRMRLCQPMMUND-JTQLQIEISA-N 1 2 310.350 2.308 20 10 DECDLO COc1c(O)c(C[N@H+]2CCOC(C)(C)[C@@H]2C)ccc1[N+](=O)[O-] ZINC000774904287 641978897 /nfs/dbraw/zinc/97/88/97/641978897.db2.gz GDRMRLCQPMMUND-JTQLQIEISA-N 1 2 310.350 2.308 20 10 DECDLO CC[N@H+](CCNCc1ccc([N+](=O)[O-])c(OC)c1O)C(C)C ZINC000774989199 641990697 /nfs/dbraw/zinc/99/06/97/641990697.db2.gz KRARCFUJPUATLF-UHFFFAOYSA-N 1 2 311.382 2.129 20 10 DECDLO CC[N@@H+](CCNCc1ccc([N+](=O)[O-])c(OC)c1O)C(C)C ZINC000774989199 641990702 /nfs/dbraw/zinc/99/07/02/641990702.db2.gz KRARCFUJPUATLF-UHFFFAOYSA-N 1 2 311.382 2.129 20 10 DECDLO CCN(CC[NH2+]Cc1ccc([N+](=O)[O-])c(OC)c1O)C(C)C ZINC000774989199 641990707 /nfs/dbraw/zinc/99/07/07/641990707.db2.gz KRARCFUJPUATLF-UHFFFAOYSA-N 1 2 311.382 2.129 20 10 DECDLO Cc1[nH]c(C2CCN(C(=O)c3cccc(O)c3O)CC2)[nH+]c1C ZINC000899509106 642088585 /nfs/dbraw/zinc/08/85/85/642088585.db2.gz IMXHAMUUNURAEU-UHFFFAOYSA-N 1 2 315.373 2.458 20 10 DECDLO CS(=O)(=O)[C@H]1CCC[C@@H]([NH2+]Cc2cccc(Cl)c2O)C1 ZINC000776208837 642143682 /nfs/dbraw/zinc/14/36/82/642143682.db2.gz LVQCLORHKMRENG-NEPJUHHUSA-N 1 2 317.838 2.491 20 10 DECDLO CCOC(=O)[C@H]([NH2+]Cc1cccc(C)c1O)[C@@H]1CCCOC1 ZINC000789579025 643750806 /nfs/dbraw/zinc/75/08/06/643750806.db2.gz DSKGNPLVUVCZCE-HUUCEWRRSA-N 1 2 307.390 2.149 20 10 DECDLO CCOC(=O)[C@H]([NH2+]Cc1cc(C)c(C)cc1O)[C@@H]1CCCOC1 ZINC000789581726 643751619 /nfs/dbraw/zinc/75/16/19/643751619.db2.gz SYGJGDJYDNWLHY-RHSMWYFYSA-N 1 2 321.417 2.457 20 10 DECDLO COc1cc(N(C)Cc2ccc(N)[nH+]c2)cc(OC)c1OC ZINC000843067913 650883239 /nfs/dbraw/zinc/88/32/39/650883239.db2.gz JAWFRJSSMNCEBO-UHFFFAOYSA-N 1 2 303.362 2.326 20 10 DECDLO CS(=O)(=O)C1(C[NH2+]Cc2cc(Cl)cc(F)c2O)CCC1 ZINC000793280755 644224512 /nfs/dbraw/zinc/22/45/12/644224512.db2.gz NOPPXJVCOGAZFX-UHFFFAOYSA-N 1 2 321.801 2.242 20 10 DECDLO CC[C@@H]([NH2+]C[C@H]1CN(C)CCN1C)c1cccc(Cl)c1O ZINC000806139579 645802962 /nfs/dbraw/zinc/80/29/62/645802962.db2.gz PVOMSMVSXGRKMF-SWLSCSKDSA-N 1 2 311.857 2.332 20 10 DECDLO C[C@H](NC(=O)NCc1c[nH+]cn1C)c1ccc(N(C)C)cc1 ZINC000811905592 646590972 /nfs/dbraw/zinc/59/09/72/646590972.db2.gz HIDNRJYGDCVRJC-LBPRGKRZSA-N 1 2 301.394 2.047 20 10 DECDLO C[C@H](O)[C@H]1CCN(c2cc(NCc3ccccc3O)[nH+]cn2)C1 ZINC000840253575 646653189 /nfs/dbraw/zinc/65/31/89/646653189.db2.gz LZLAKQCJTCODAY-JSGCOSHPSA-N 1 2 314.389 2.001 20 10 DECDLO C[C@H](O)[C@H]1CCN(c2cc(NCc3ccccc3O)nc[nH+]2)C1 ZINC000840253575 646653193 /nfs/dbraw/zinc/65/31/93/646653193.db2.gz LZLAKQCJTCODAY-JSGCOSHPSA-N 1 2 314.389 2.001 20 10 DECDLO COc1cc(Cl)cc(C[N@@H+]2C[C@@H](CO)OC(C)(C)C2)c1O ZINC000817412359 647289193 /nfs/dbraw/zinc/28/91/93/647289193.db2.gz JIKSKQCDQFVLBE-LBPRGKRZSA-N 1 2 315.797 2.026 20 10 DECDLO COc1cc(Cl)cc(C[N@H+]2C[C@@H](CO)OC(C)(C)C2)c1O ZINC000817412359 647289196 /nfs/dbraw/zinc/28/91/96/647289196.db2.gz JIKSKQCDQFVLBE-LBPRGKRZSA-N 1 2 315.797 2.026 20 10 DECDLO COC(=O)[C@@]1(F)CC[N@H+](Cc2cc(Cl)c(C)cc2O)C1 ZINC000824913508 648671921 /nfs/dbraw/zinc/67/19/21/648671921.db2.gz UXAIPBFGZLXSQI-CQSZACIVSA-N 1 2 301.745 2.441 20 10 DECDLO COC(=O)[C@@]1(F)CC[N@@H+](Cc2cc(Cl)c(C)cc2O)C1 ZINC000824913508 648671923 /nfs/dbraw/zinc/67/19/23/648671923.db2.gz UXAIPBFGZLXSQI-CQSZACIVSA-N 1 2 301.745 2.441 20 10 DECDLO Oc1cc(Br)ccc1C[NH2+]Cc1nnc(C2CC2)[nH]1 ZINC000826036246 648841277 /nfs/dbraw/zinc/84/12/77/648841277.db2.gz CCNOIBSTWACSMQ-UHFFFAOYSA-N 1 2 323.194 2.440 20 10 DECDLO CN(C)c1ccc(/C=C/C[NH+]2CCN([C@H]3CCOC3)CC2)cc1 ZINC000827126131 648977086 /nfs/dbraw/zinc/97/70/86/648977086.db2.gz WOWKEVQAWRWLAQ-RTLBZRNLSA-N 1 2 315.461 2.172 20 10 DECDLO O=C1CC[C@@H]2C[N@H+](Cc3cc(Cl)cc(F)c3O)CC[C@H]2N1 ZINC000827133973 648979527 /nfs/dbraw/zinc/97/95/27/648979527.db2.gz YVENFIHHJVVRTE-NOZJJQNGSA-N 1 2 312.772 2.285 20 10 DECDLO O=C1CC[C@@H]2C[N@@H+](Cc3cc(Cl)cc(F)c3O)CC[C@H]2N1 ZINC000827133973 648979530 /nfs/dbraw/zinc/97/95/30/648979530.db2.gz YVENFIHHJVVRTE-NOZJJQNGSA-N 1 2 312.772 2.285 20 10 DECDLO O=C(NCc1cc(Cl)ccc1O)[C@@H]1CCc2c[nH+]cn2C1 ZINC000846661261 651343541 /nfs/dbraw/zinc/34/35/41/651343541.db2.gz PEUKFCXQAOWGTO-SNVBAGLBSA-N 1 2 305.765 2.121 20 10 DECDLO C[C@H]([NH2+]C/C=C\CO)c1cc(Br)cc(F)c1O ZINC000850506992 651941633 /nfs/dbraw/zinc/94/16/33/651941633.db2.gz DCWLGQVERWQKRB-KZUAUGPASA-N 1 2 304.159 2.493 20 10 DECDLO CCC[C@@H]1C(=O)NCC[N@H+]1Cc1cc(C(C)(C)C)cc(O)c1O ZINC000128705637 684173151 /nfs/dbraw/zinc/17/31/51/684173151.db2.gz BGQDTZTWSZSGTC-CQSZACIVSA-N 1 2 320.433 2.496 20 10 DECDLO CCC[C@@H]1C(=O)NCC[N@@H+]1Cc1cc(C(C)(C)C)cc(O)c1O ZINC000128705637 684173152 /nfs/dbraw/zinc/17/31/52/684173152.db2.gz BGQDTZTWSZSGTC-CQSZACIVSA-N 1 2 320.433 2.496 20 10 DECDLO C[C@H]([NH3+])[C@@H]1CN(Cc2cc(Cl)cc(Cl)c2O)CCO1 ZINC000132560289 684210512 /nfs/dbraw/zinc/21/05/12/684210512.db2.gz RIYKDKADOPLCHY-UFBFGSQYSA-N 1 2 305.205 2.247 20 10 DECDLO CCc1cccc(C[NH2+][C@@H](C[C@H]2CCCOC2)C(=O)OC)c1O ZINC000862515960 686313218 /nfs/dbraw/zinc/31/32/18/686313218.db2.gz GWJHUPHSVPJRIE-CJNGLKHVSA-N 1 2 321.417 2.403 20 10 DECDLO CC[C@H](C(=O)NCc1cc(C)ccc1O)[N@@H+]1CCO[C@H](CC)C1 ZINC000862756214 686368834 /nfs/dbraw/zinc/36/88/34/686368834.db2.gz UAERMAATTIZKFO-HZPDHXFCSA-N 1 2 320.433 2.206 20 10 DECDLO CC[C@H](C(=O)NCc1cc(C)ccc1O)[N@H+]1CCO[C@H](CC)C1 ZINC000862756214 686368843 /nfs/dbraw/zinc/36/88/43/686368843.db2.gz UAERMAATTIZKFO-HZPDHXFCSA-N 1 2 320.433 2.206 20 10 DECDLO Cc1cnc(C[NH2+]Cc2ccc(N3CCC(CO)CC3)cc2)o1 ZINC000876965608 689984891 /nfs/dbraw/zinc/98/48/91/689984891.db2.gz JFBHMJFOAJMFNH-UHFFFAOYSA-N 1 2 315.417 2.482 20 10 DECDLO Cc1cc(C[NH2+]Cc2ccc(N3CCC(O)CC3)c(F)c2)no1 ZINC000882917320 691386408 /nfs/dbraw/zinc/38/64/08/691386408.db2.gz JNQRQABLSLWUHP-UHFFFAOYSA-N 1 2 319.380 2.373 20 10 DECDLO C[C@H]([NH2+][C@H](CO)C[C@H]1CCCO1)c1cc(F)cc(F)c1O ZINC000886669817 692154602 /nfs/dbraw/zinc/15/46/02/692154602.db2.gz FGNNCRUKZMWQIU-ZMLRMANQSA-N 1 2 301.333 2.251 20 10 DECDLO Cn1c[nH+]cc1CCNC(=O)c1cc2cc(O)c(O)cc2s1 ZINC001447633094 1184830466 /nfs/dbraw/zinc/83/04/66/1184830466.db2.gz ROSMOHYJBCKWBC-UHFFFAOYSA-N 1 2 317.370 2.019 20 10 DECDLO COc1ccc(C[N@@H+]2CC[C@H]([NH3+])[C@@H](F)CC2)c([O-])c1Cl ZINC001206201588 793734041 /nfs/dbraw/zinc/73/40/41/793734041.db2.gz XXOHHHZBHMNSPE-QWRGUYRKSA-N 1 2 302.777 2.315 20 10 DECDLO COc1ccc(C[N@H+]2CC[C@H]([NH3+])[C@@H](F)CC2)c([O-])c1Cl ZINC001206201588 793734046 /nfs/dbraw/zinc/73/40/46/793734046.db2.gz XXOHHHZBHMNSPE-QWRGUYRKSA-N 1 2 302.777 2.315 20 10 DECDLO CCOC[C@@H]1C[N@H+](Cc2c(O)cccc2F)Cc2cn(C)nc21 ZINC001137834342 796143924 /nfs/dbraw/zinc/14/39/24/796143924.db2.gz CWYNDFKFDBOGSQ-ZDUSSCGKSA-N 1 2 319.380 2.401 20 10 DECDLO CCOC[C@@H]1C[N@@H+](Cc2c(O)cccc2F)Cc2cn(C)nc21 ZINC001137834342 796143929 /nfs/dbraw/zinc/14/39/29/796143929.db2.gz CWYNDFKFDBOGSQ-ZDUSSCGKSA-N 1 2 319.380 2.401 20 10 DECDLO CCOC[C@@H]1C[N@H+](Cc2cccc(F)c2O)Cc2cnn(C)c21 ZINC001138124988 796165906 /nfs/dbraw/zinc/16/59/06/796165906.db2.gz GIPXEDADPGRWJS-AWEZNQCLSA-N 1 2 319.380 2.401 20 10 DECDLO CCOC[C@@H]1C[N@@H+](Cc2cccc(F)c2O)Cc2cnn(C)c21 ZINC001138124988 796165913 /nfs/dbraw/zinc/16/59/13/796165913.db2.gz GIPXEDADPGRWJS-AWEZNQCLSA-N 1 2 319.380 2.401 20 10 DECDLO Cc1nc2c(o1)CC[N@H+](Cc1ccc(N3CCOCC3)cc1)C2 ZINC001138500941 796229065 /nfs/dbraw/zinc/22/90/65/796229065.db2.gz HVJBHRAOKRLHPT-UHFFFAOYSA-N 1 2 313.401 2.378 20 10 DECDLO Cc1nc2c(o1)CC[N@@H+](Cc1ccc(N3CCOCC3)cc1)C2 ZINC001138500941 796229071 /nfs/dbraw/zinc/22/90/71/796229071.db2.gz HVJBHRAOKRLHPT-UHFFFAOYSA-N 1 2 313.401 2.378 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[NH+]1CCC2(COC2)CC1 ZINC001139126251 796326813 /nfs/dbraw/zinc/32/68/13/796326813.db2.gz CTNJKEYOYGMOEU-UHFFFAOYSA-N 1 2 315.369 2.419 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1C[C@H](O)CC[C@H]1C ZINC001139127474 796329078 /nfs/dbraw/zinc/32/90/78/796329078.db2.gz WPBPANNPJIBGGU-VXGBXAGGSA-N 1 2 303.358 2.152 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1C[C@H](O)CC[C@H]1C ZINC001139127474 796329084 /nfs/dbraw/zinc/32/90/84/796329084.db2.gz WPBPANNPJIBGGU-VXGBXAGGSA-N 1 2 303.358 2.152 20 10 DECDLO O=C1CCC[C@@]2(CCC[N@@H+](Cc3c(O)cc(F)cc3F)C2)N1 ZINC001140581212 796541171 /nfs/dbraw/zinc/54/11/71/796541171.db2.gz RWNUFBUPPIEVOD-INIZCTEOSA-N 1 2 310.344 2.305 20 10 DECDLO O=C1CCC[C@@]2(CCC[N@H+](Cc3c(O)cc(F)cc3F)C2)N1 ZINC001140581212 796541175 /nfs/dbraw/zinc/54/11/75/796541175.db2.gz RWNUFBUPPIEVOD-INIZCTEOSA-N 1 2 310.344 2.305 20 10 DECDLO Fc1cc(N2CCOCC2)ccc1C[N@@H+]1CCOCC12CCC2 ZINC001140663616 796553277 /nfs/dbraw/zinc/55/32/77/796553277.db2.gz LRURESVHTNBFHB-UHFFFAOYSA-N 1 2 320.408 2.417 20 10 DECDLO Fc1cc(N2CCOCC2)ccc1C[N@H+]1CCOCC12CCC2 ZINC001140663616 796553280 /nfs/dbraw/zinc/55/32/80/796553280.db2.gz LRURESVHTNBFHB-UHFFFAOYSA-N 1 2 320.408 2.417 20 10 DECDLO CN(C)c1ccc(C[N@@H+]2CCO[C@@]3(CCOC3)C2)c(Cl)c1 ZINC001140922150 796597861 /nfs/dbraw/zinc/59/78/61/796597861.db2.gz IDZSIPGKARBXMS-INIZCTEOSA-N 1 2 310.825 2.397 20 10 DECDLO CN(C)c1ccc(C[N@H+]2CCO[C@@]3(CCOC3)C2)c(Cl)c1 ZINC001140922150 796597864 /nfs/dbraw/zinc/59/78/64/796597864.db2.gz IDZSIPGKARBXMS-INIZCTEOSA-N 1 2 310.825 2.397 20 10 DECDLO CNC(=O)NC1CC[NH+](Cc2c(O)ccc(Cl)c2F)CC1 ZINC000840974483 796710759 /nfs/dbraw/zinc/71/07/59/796710759.db2.gz JJIQGRDDMLCNAP-UHFFFAOYSA-N 1 2 315.776 2.078 20 10 DECDLO CCOC(=O)Cc1ccc[nH+]c1NCc1ccc(O)c(O)c1 ZINC001158994316 798500964 /nfs/dbraw/zinc/50/09/64/798500964.db2.gz HQBBXZCKQXUGBI-UHFFFAOYSA-N 1 2 302.330 2.211 20 10 DECDLO CCOc1ccc(N2CC[NH+](Cc3cncn3C)CC2)cc1 ZINC001204388304 798536184 /nfs/dbraw/zinc/53/61/84/798536184.db2.gz ABRMWPBJURXKHX-UHFFFAOYSA-N 1 2 300.406 2.141 20 10 DECDLO C[NH+](C)C[C@H]1COCCN1Cc1cc(Cl)cc(Cl)c1O ZINC001203581888 800084088 /nfs/dbraw/zinc/08/40/88/800084088.db2.gz CKLRMCFKQIDSAE-LBPRGKRZSA-N 1 2 319.232 2.461 20 10 DECDLO Cc1nccnc1O[C@H]1CC[N@H+](Cc2ccc(F)c(F)c2O)C1 ZINC001233079909 802023111 /nfs/dbraw/zinc/02/31/11/802023111.db2.gz NEQMHFUBZLUMFZ-LBPRGKRZSA-N 1 2 321.327 2.422 20 10 DECDLO Oc1cc(O)c(C[N@@H+]2CCOC[C@@H]2c2ccccc2)cc1O ZINC001233483232 802127746 /nfs/dbraw/zinc/12/77/46/802127746.db2.gz RKPRFYSOIUKTRD-CQSZACIVSA-N 1 2 301.342 2.377 20 10 DECDLO Oc1cc(O)c(C[N@H+]2CCOC[C@@H]2c2ccccc2)cc1O ZINC001233483232 802127747 /nfs/dbraw/zinc/12/77/47/802127747.db2.gz RKPRFYSOIUKTRD-CQSZACIVSA-N 1 2 301.342 2.377 20 10 DECDLO COC1(OC)CCOC[C@@H]1[NH2+]Cc1c(O)ccc(Cl)c1F ZINC001461727800 1058701657 /nfs/dbraw/zinc/70/16/57/1058701657.db2.gz IJTROIMIAXAINL-LBPRGKRZSA-N 1 2 319.760 2.052 20 10 DECDLO O=C1N[C@@H]2C[N@H+](Cc3cc(Cl)cc(F)c3O)CC[C@H]2CO1 ZINC001462407548 1058819595 /nfs/dbraw/zinc/81/95/95/1058819595.db2.gz UTQRCRARBKINCU-QPUJVOFHSA-N 1 2 314.744 2.115 20 10 DECDLO O=C1N[C@@H]2C[N@@H+](Cc3cc(Cl)cc(F)c3O)CC[C@H]2CO1 ZINC001462407548 1058819614 /nfs/dbraw/zinc/81/96/14/1058819614.db2.gz UTQRCRARBKINCU-QPUJVOFHSA-N 1 2 314.744 2.115 20 10 DECDLO C[C@@H](Cn1cc[nH+]c1)NC(=O)c1cc2cc(O)c(O)cc2s1 ZINC001464159535 1059088840 /nfs/dbraw/zinc/08/88/40/1059088840.db2.gz RBQZULLRTCKUAC-VIFPVBQESA-N 1 2 317.370 2.328 20 10 DECDLO O=C(c1cc2cc(O)c(O)cc2s1)N1CC(n2cc[nH+]c2)C1 ZINC001465206229 1059268807 /nfs/dbraw/zinc/26/88/07/1059268807.db2.gz AQUNVSNFHLWWSN-UHFFFAOYSA-N 1 2 315.354 2.206 20 10 DECDLO NC(=O)[C@@H]([NH2+]Cc1cc(F)c(F)cc1O)c1ccc(F)cc1 ZINC001621229684 1078171396 /nfs/dbraw/zinc/17/13/96/1078171396.db2.gz KHMHZMRAJDVAMI-AWEZNQCLSA-N 1 2 310.275 2.126 20 10 DECDLO O=C(NCc1ccc(O)cc1O)c1ccc(-n2cc[nH+]c2)cc1 ZINC001626837683 1078263942 /nfs/dbraw/zinc/26/39/42/1078263942.db2.gz DAFGITAFKJQVAN-UHFFFAOYSA-N 1 2 309.325 2.214 20 10 DECDLO C[C@@H]([NH2+]CCOC1CCCC1)c1cccc(-c2nn[nH]n2)c1O ZINC001589961962 1076536875 /nfs/dbraw/zinc/53/68/75/1076536875.db2.gz DLDKQCWTVVZDQD-LLVKDONJSA-N 1 2 317.393 2.182 20 10 DECDLO C[C@@H]([NH2+]CCOC(C)(C)C)c1cccc(-c2nn[nH]n2)c1O ZINC001589964995 1076538416 /nfs/dbraw/zinc/53/84/16/1076538416.db2.gz XKONCWZKLYKVEC-SNVBAGLBSA-N 1 2 305.382 2.038 20 10 DECDLO C[C@@H]([NH2+][C@@H](C)c1cccnc1)c1cccc(-c2nn[nH]n2)c1O ZINC001589973110 1076540874 /nfs/dbraw/zinc/54/08/74/1076540874.db2.gz BKGNNSBNKKRQFJ-WDEREUQCSA-N 1 2 310.361 2.379 20 10 DECDLO CC(C)[C@H]([NH2+][C@@H](C)c1cccc(-c2nn[nH]n2)c1O)C(C)(C)O ZINC001589974166 1076541193 /nfs/dbraw/zinc/54/11/93/1076541193.db2.gz PZHMQQAMOLYWTK-HZMBPMFUSA-N 1 2 319.409 2.018 20 10 DECDLO CC[C@@H]([NH2+]C[C@@H](OC)C1CC1)c1cccc(-c2nn[nH]n2)c1O ZINC001590462469 1076631057 /nfs/dbraw/zinc/63/10/57/1076631057.db2.gz CQKUVAIOZJBCSB-ZIAGYGMSSA-N 1 2 317.393 2.038 20 10 DECDLO C[C@H]([NH2+]C1CC[NH+](C2CC2)CC1)c1cc(C(=O)[O-])ccc1O ZINC001609780704 1077922593 /nfs/dbraw/zinc/92/25/93/1077922593.db2.gz VAEAGVPKHNEBJQ-NSHDSACASA-N 1 2 304.390 2.368 20 10 DECDLO Oc1c(F)cc(F)cc1C[NH2+]Cc1nc(-c2ccccn2)n[nH]1 ZINC001659788438 1080249939 /nfs/dbraw/zinc/24/99/39/1080249939.db2.gz LYVNBNGZNXNMOL-UHFFFAOYSA-N 1 2 317.299 2.140 20 10 DECDLO Oc1c(F)cc(Cl)cc1C[NH2+]CCOC[C@@H]1CCCO1 ZINC001661488173 1080486562 /nfs/dbraw/zinc/48/65/62/1080486562.db2.gz QXUQWDWOJUTLHC-LBPRGKRZSA-N 1 2 303.761 2.470 20 10 DECDLO CC[N@H+](Cc1cc(Br)cc(F)c1O)C1CN(C)C1 ZINC001235066640 1084295556 /nfs/dbraw/zinc/29/55/56/1084295556.db2.gz LQQQSLRCMKFWDU-UHFFFAOYSA-N 1 2 317.202 2.430 20 10 DECDLO CC[N@@H+](Cc1cc(Br)cc(F)c1O)C1CN(C)C1 ZINC001235066640 1084295568 /nfs/dbraw/zinc/29/55/68/1084295568.db2.gz LQQQSLRCMKFWDU-UHFFFAOYSA-N 1 2 317.202 2.430 20 10 DECDLO CCCOc1ccc(C[NH2+][C@H](Cc2c[nH+]c[nH]2)C(=O)[O-])cc1C ZINC001350663214 1126183152 /nfs/dbraw/zinc/18/31/52/1126183152.db2.gz RREANUGNAOMENG-OAHLLOKOSA-N 1 2 317.389 2.292 20 10 DECDLO COC[C@@H]1C[N@H+](Cc2c(O)cccc2F)Cc2ncn(C)c21 ZINC001137834387 1086519884 /nfs/dbraw/zinc/51/98/84/1086519884.db2.gz DZWDPOWNEJXKGQ-NSHDSACASA-N 1 2 305.353 2.011 20 10 DECDLO COC[C@@H]1C[N@@H+](Cc2c(O)cccc2F)Cc2ncn(C)c21 ZINC001137834387 1086519893 /nfs/dbraw/zinc/51/98/93/1086519893.db2.gz DZWDPOWNEJXKGQ-NSHDSACASA-N 1 2 305.353 2.011 20 10 DECDLO O=S1(=O)CCC[C@@H]([NH2+]Cc2cccc(Cl)c2O)CC1 ZINC000822188350 1090624413 /nfs/dbraw/zinc/62/44/13/1090624413.db2.gz HIOYXDHRONCZBP-LLVKDONJSA-N 1 2 303.811 2.103 20 10 DECDLO CN1CC[C@@]2(CCC[N@@H+]2Cc2cc(F)cc(Cl)c2O)C1=O ZINC001274442172 1091245273 /nfs/dbraw/zinc/24/52/73/1091245273.db2.gz NMCWWFIUGMIFCU-HNNXBMFYSA-N 1 2 312.772 2.381 20 10 DECDLO CN1CC[C@@]2(CCC[N@H+]2Cc2cc(F)cc(Cl)c2O)C1=O ZINC001274442172 1091245281 /nfs/dbraw/zinc/24/52/81/1091245281.db2.gz NMCWWFIUGMIFCU-HNNXBMFYSA-N 1 2 312.772 2.381 20 10 DECDLO COc1cc(C)c(C[NH+]2CC(NC(=O)OC(C)(C)C)C2)c(O)c1 ZINC001236817788 1138438684 /nfs/dbraw/zinc/43/86/84/1138438684.db2.gz HOKMIQKSNVJOHC-UHFFFAOYSA-N 1 2 322.405 2.418 20 10 DECDLO OCCC[NH+]1CCN(Cc2cc3ccccc3cc2O)CC1 ZINC001236827548 1138440589 /nfs/dbraw/zinc/44/05/89/1138440589.db2.gz VBUQJODFVFWRDK-UHFFFAOYSA-N 1 2 300.402 2.045 20 10 DECDLO CC(C)c1ccc(CN2CC[NH+]([C@H]3CCOC3)CC2)c(O)c1 ZINC001237046949 1138487763 /nfs/dbraw/zinc/48/77/63/1138487763.db2.gz XNQUBMJXZLAOCH-KRWDZBQOSA-N 1 2 304.434 2.422 20 10 DECDLO CC(=O)N1CCC2(C[NH+](Cc3c(O)ccc(F)c3Cl)C2)C1 ZINC001237124144 1138508959 /nfs/dbraw/zinc/50/89/59/1138508959.db2.gz JYIWYFVUNFANLN-UHFFFAOYSA-N 1 2 312.772 2.239 20 10 DECDLO CCOC(=O)c1nc2c(o1)CC[N@H+](Cc1c(C)cccc1O)C2 ZINC001237492393 1138655737 /nfs/dbraw/zinc/65/57/37/1138655737.db2.gz OJQQSEQAKFFLOT-UHFFFAOYSA-N 1 2 316.357 2.424 20 10 DECDLO CCOC(=O)c1nc2c(o1)CC[N@@H+](Cc1c(C)cccc1O)C2 ZINC001237492393 1138655742 /nfs/dbraw/zinc/65/57/42/1138655742.db2.gz OJQQSEQAKFFLOT-UHFFFAOYSA-N 1 2 316.357 2.424 20 10 DECDLO C[C@H]([NH2+][C@H]1CCN(c2cnn(C)c2)C1)c1cc(F)cc(F)c1O ZINC001325339246 1147894237 /nfs/dbraw/zinc/89/42/37/1147894237.db2.gz HRMFDIHEHRJEEN-JQWIXIFHSA-N 1 2 322.359 2.333 20 10 DECDLO C[C@H](Cn1cc[nH+]c1)NC(=O)N(C)Cc1ccc(N(C)C)cc1 ZINC000047029153 354303445 /nfs/dbraw/zinc/30/34/45/354303445.db2.gz UWWBEOQJDWJFKF-CQSZACIVSA-N 1 2 315.421 2.179 20 10 DECDLO COC[C@@]1(C(=O)OC)CC[N@H+](Cc2cccc(Cl)c2O)C1 ZINC000294923323 224313995 /nfs/dbraw/zinc/31/39/95/224313995.db2.gz BBXXFILBSXKKSX-OAHLLOKOSA-N 1 2 313.781 2.057 20 10 DECDLO COC[C@@]1(C(=O)OC)CC[N@@H+](Cc2cccc(Cl)c2O)C1 ZINC000294923323 224313998 /nfs/dbraw/zinc/31/39/98/224313998.db2.gz BBXXFILBSXKKSX-OAHLLOKOSA-N 1 2 313.781 2.057 20 10 DECDLO CN1CCCc2cc(CNC(=O)[C@@H]3CCn4c[nH+]cc4C3)ccc21 ZINC000131666741 401854900 /nfs/dbraw/zinc/85/49/00/401854900.db2.gz NEXSFFHFLGTZHN-MRXNPFEDSA-N 1 2 324.428 2.144 20 10 DECDLO COC(=O)C[N@H+](C)Cc1cc(Br)cc(C)c1O ZINC000179710107 402598059 /nfs/dbraw/zinc/59/80/59/402598059.db2.gz HZZPMBPFCOMODM-UHFFFAOYSA-N 1 2 302.168 2.068 20 10 DECDLO COC(=O)C[N@@H+](C)Cc1cc(Br)cc(C)c1O ZINC000179710107 402598063 /nfs/dbraw/zinc/59/80/63/402598063.db2.gz HZZPMBPFCOMODM-UHFFFAOYSA-N 1 2 302.168 2.068 20 10 DECDLO C[C@H]([C@H](C)S(C)(=O)=O)[N@H+](C)Cc1cccc(Cl)c1O ZINC000180260117 402611636 /nfs/dbraw/zinc/61/16/36/402611636.db2.gz JRIPAZJWOJWVAY-ZJUUUORDSA-N 1 2 305.827 2.299 20 10 DECDLO C[C@H]([C@H](C)S(C)(=O)=O)[N@@H+](C)Cc1cccc(Cl)c1O ZINC000180260117 402611637 /nfs/dbraw/zinc/61/16/37/402611637.db2.gz JRIPAZJWOJWVAY-ZJUUUORDSA-N 1 2 305.827 2.299 20 10 DECDLO CCN(Cc1ccc(N(C)C)cc1)C(=O)NCc1[nH+]ccn1C ZINC000264162129 402852897 /nfs/dbraw/zinc/85/28/97/402852897.db2.gz KZUSJZLZOUVQPT-UHFFFAOYSA-N 1 2 315.421 2.218 20 10 DECDLO C[C@@H]([NH2+]Cc1cc(Br)ccc1O)c1ncn(C)n1 ZINC000275827599 403126510 /nfs/dbraw/zinc/12/65/10/403126510.db2.gz NVYFJUGQKWNSFF-MRVPVSSYSA-N 1 2 311.183 2.134 20 10 DECDLO O=[N+]([O-])c1ccc(O)c(C[NH2+][C@H](CO)Cc2ccc(F)cc2)c1 ZINC000271243423 403282836 /nfs/dbraw/zinc/28/28/36/403282836.db2.gz VATGYEAVRCAIHO-AWEZNQCLSA-N 1 2 320.320 2.133 20 10 DECDLO CS(=O)(=O)C[C@@H]1CCC[N@H+](Cc2c(O)cccc2Cl)C1 ZINC000293888574 403591227 /nfs/dbraw/zinc/59/12/27/403591227.db2.gz KEQWQMUSUWWQDM-LLVKDONJSA-N 1 2 317.838 2.302 20 10 DECDLO CS(=O)(=O)C[C@@H]1CCC[N@@H+](Cc2c(O)cccc2Cl)C1 ZINC000293888574 403591231 /nfs/dbraw/zinc/59/12/31/403591231.db2.gz KEQWQMUSUWWQDM-LLVKDONJSA-N 1 2 317.838 2.302 20 10 DECDLO CC(C)[N@H+](CCS(C)(=O)=O)Cc1cc(Cl)c(F)cc1O ZINC000295316906 403851451 /nfs/dbraw/zinc/85/14/51/403851451.db2.gz LAZRJEBALKQHJK-UHFFFAOYSA-N 1 2 323.817 2.440 20 10 DECDLO CC(C)[N@@H+](CCS(C)(=O)=O)Cc1cc(Cl)c(F)cc1O ZINC000295316906 403851459 /nfs/dbraw/zinc/85/14/59/403851459.db2.gz LAZRJEBALKQHJK-UHFFFAOYSA-N 1 2 323.817 2.440 20 10 DECDLO C[C@H](CS(C)(=O)=O)[N@H+](C)C/C=C\c1ccc(N(C)C)cc1 ZINC000835027181 649868739 /nfs/dbraw/zinc/86/87/39/649868739.db2.gz CYEJQMVMLZCUKW-LMVHVUTASA-N 1 2 310.463 2.131 20 10 DECDLO C[C@H](CS(C)(=O)=O)[N@@H+](C)C/C=C\c1ccc(N(C)C)cc1 ZINC000835027181 649868741 /nfs/dbraw/zinc/86/87/41/649868741.db2.gz CYEJQMVMLZCUKW-LMVHVUTASA-N 1 2 310.463 2.131 20 10 DECDLO COC(=O)[C@]1(F)CC[N@H+](C/C=C\c2ccc(N(C)C)cc2)C1 ZINC000835030042 649868960 /nfs/dbraw/zinc/86/89/60/649868960.db2.gz VKQQHMVNLQASCR-CHYADLBTSA-N 1 2 306.381 2.353 20 10 DECDLO COC(=O)[C@]1(F)CC[N@@H+](C/C=C\c2ccc(N(C)C)cc2)C1 ZINC000835030042 649868963 /nfs/dbraw/zinc/86/89/63/649868963.db2.gz VKQQHMVNLQASCR-CHYADLBTSA-N 1 2 306.381 2.353 20 10 DECDLO Cc1nsc(N2CC[NH+](Cc3cc(F)ccc3O)CC2)n1 ZINC000180199677 526711433 /nfs/dbraw/zinc/71/14/33/526711433.db2.gz WNDKGUZDIZBDHT-UHFFFAOYSA-N 1 2 308.382 2.013 20 10 DECDLO CC(=O)c1cc(Cl)cc(C[N@H+]2CCCN(C(C)=O)CC2)c1O ZINC000194175550 527206404 /nfs/dbraw/zinc/20/64/04/527206404.db2.gz YETSGIWBAXQSRB-UHFFFAOYSA-N 1 2 324.808 2.302 20 10 DECDLO CC(=O)c1cc(Cl)cc(C[N@@H+]2CCCN(C(C)=O)CC2)c1O ZINC000194175550 527206411 /nfs/dbraw/zinc/20/64/11/527206411.db2.gz YETSGIWBAXQSRB-UHFFFAOYSA-N 1 2 324.808 2.302 20 10 DECDLO O=C(NCCCCNc1cccc[nH+]1)c1cccc(O)c1O ZINC000188420785 527652593 /nfs/dbraw/zinc/65/25/93/527652593.db2.gz XKBUWGPIGCFOKT-UHFFFAOYSA-N 1 2 301.346 2.115 20 10 DECDLO CC[N@H+](C[C@H]1CCNC(=O)CC1)c1ccc(OC)c(OC)c1 ZINC000295655502 528752312 /nfs/dbraw/zinc/75/23/12/528752312.db2.gz HADWFJPZECKKEG-CYBMUJFWSA-N 1 2 306.406 2.446 20 10 DECDLO CC[N@@H+](C[C@H]1CCNC(=O)CC1)c1ccc(OC)c(OC)c1 ZINC000295655502 528752317 /nfs/dbraw/zinc/75/23/17/528752317.db2.gz HADWFJPZECKKEG-CYBMUJFWSA-N 1 2 306.406 2.446 20 10 DECDLO Cn1c[nH+]cc1[C@@H]1C[C@H]1C(=O)NCc1cccc(Cl)c1O ZINC000890761120 623198791 /nfs/dbraw/zinc/19/87/91/623198791.db2.gz LEXNEMFYGZDMDE-GHMZBOCLSA-N 1 2 305.765 2.199 20 10 DECDLO CNC(=O)CCC[N@H+](C)Cc1cccc(Br)c1O ZINC000093717869 636284085 /nfs/dbraw/zinc/28/40/85/636284085.db2.gz BKMDXDCXQIBXFI-UHFFFAOYSA-N 1 2 315.211 2.113 20 10 DECDLO CNC(=O)CCC[N@@H+](C)Cc1cccc(Br)c1O ZINC000093717869 636284087 /nfs/dbraw/zinc/28/40/87/636284087.db2.gz BKMDXDCXQIBXFI-UHFFFAOYSA-N 1 2 315.211 2.113 20 10 DECDLO COC(=O)c1cnc(C[NH2+]Cc2ccc(N(C)C)cc2)s1 ZINC000894160033 636326376 /nfs/dbraw/zinc/32/63/76/636326376.db2.gz JXCNVBLMVWBHJC-UHFFFAOYSA-N 1 2 305.403 2.286 20 10 DECDLO Cc1[nH+]c[nH]c1CC(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C ZINC000840555334 650321012 /nfs/dbraw/zinc/32/10/12/650321012.db2.gz NUIRLDIFLYGTSG-ZDUSSCGKSA-N 1 2 314.433 2.382 20 10 DECDLO Oc1c(F)cc(F)cc1C[N@@H+]1CCO[C@]2(CCSC2)C1 ZINC000895075754 637501758 /nfs/dbraw/zinc/50/17/58/637501758.db2.gz GRMPUUWUVPCLPR-CQSZACIVSA-N 1 2 301.358 2.378 20 10 DECDLO Oc1c(F)cc(F)cc1C[N@H+]1CCO[C@]2(CCSC2)C1 ZINC000895075754 637501762 /nfs/dbraw/zinc/50/17/62/637501762.db2.gz GRMPUUWUVPCLPR-CQSZACIVSA-N 1 2 301.358 2.378 20 10 DECDLO CCc1cccc(C[NH2+][C@H](CC2CCOCC2)C(=O)OC)c1O ZINC000895593341 638106267 /nfs/dbraw/zinc/10/62/67/638106267.db2.gz PYURXMNZIXZPAA-MRXNPFEDSA-N 1 2 321.417 2.403 20 10 DECDLO COC[C@]1(C[NH2+]Cc2cc(Cl)cc(F)c2[O-])CCC[NH2+]1 ZINC000841067207 650420899 /nfs/dbraw/zinc/42/08/99/650420899.db2.gz KORXYBVWKICYBK-CQSZACIVSA-N 1 2 302.777 2.043 20 10 DECDLO C[C@@H]1C[N@H+](CCO)[C@H](C)CN1Cc1cc(Cl)cc(F)c1O ZINC000841891360 650594237 /nfs/dbraw/zinc/59/42/37/650594237.db2.gz KQVRRJZDCXUUSE-GHMZBOCLSA-N 1 2 316.804 2.072 20 10 DECDLO C[C@@H]1C[N@@H+](CCO)[C@H](C)CN1Cc1cc(Cl)cc(F)c1O ZINC000841891360 650594240 /nfs/dbraw/zinc/59/42/40/650594240.db2.gz KQVRRJZDCXUUSE-GHMZBOCLSA-N 1 2 316.804 2.072 20 10 DECDLO Cn1nccc1[C@H]1C[N@H+](Cc2cc(Cl)ccc2O)CCO1 ZINC000897559503 640800468 /nfs/dbraw/zinc/80/04/68/640800468.db2.gz XRBKJJDUROVXGR-OAHLLOKOSA-N 1 2 307.781 2.353 20 10 DECDLO Cn1nccc1[C@H]1C[N@@H+](Cc2cc(Cl)ccc2O)CCO1 ZINC000897559503 640800470 /nfs/dbraw/zinc/80/04/70/640800470.db2.gz XRBKJJDUROVXGR-OAHLLOKOSA-N 1 2 307.781 2.353 20 10 DECDLO Cc1noc(C[NH2+][C@H](C)c2ccc(N3CCOCC3)cc2)n1 ZINC000765760161 640816223 /nfs/dbraw/zinc/81/62/23/640816223.db2.gz XPTAQNRKSFPZBP-GFCCVEGCSA-N 1 2 302.378 2.065 20 10 DECDLO COc1ccc(N2CC[NH+](Cc3cc(C)n(C)n3)CC2)cc1 ZINC000767887761 641028798 /nfs/dbraw/zinc/02/87/98/641028798.db2.gz NNSLOSFRKSHBIJ-UHFFFAOYSA-N 1 2 300.406 2.059 20 10 DECDLO C[C@H]1CC[C@H](C(N)=O)C[N@@H+]1Cc1cc(Cl)cc(F)c1O ZINC000775648843 642071113 /nfs/dbraw/zinc/07/11/13/642071113.db2.gz GNLGQARIJKLXKB-IUCAKERBSA-N 1 2 300.761 2.271 20 10 DECDLO C[C@H]1CC[C@H](C(N)=O)C[N@H+]1Cc1cc(Cl)cc(F)c1O ZINC000775648843 642071118 /nfs/dbraw/zinc/07/11/18/642071118.db2.gz GNLGQARIJKLXKB-IUCAKERBSA-N 1 2 300.761 2.271 20 10 DECDLO C[C@@H]1CC[C@H](C(N)=O)C[N@@H+]1Cc1cc(Cl)cc(F)c1O ZINC000775648839 642071180 /nfs/dbraw/zinc/07/11/80/642071180.db2.gz GNLGQARIJKLXKB-BDAKNGLRSA-N 1 2 300.761 2.271 20 10 DECDLO C[C@@H]1CC[C@H](C(N)=O)C[N@H+]1Cc1cc(Cl)cc(F)c1O ZINC000775648839 642071183 /nfs/dbraw/zinc/07/11/83/642071183.db2.gz GNLGQARIJKLXKB-BDAKNGLRSA-N 1 2 300.761 2.271 20 10 DECDLO CCOc1ccc(C[N@@H+]2CCN(CC(C)C)C(=O)[C@H]2C)c(O)c1 ZINC000779202622 642472211 /nfs/dbraw/zinc/47/22/11/642472211.db2.gz QQCFFLREOZCVOC-CQSZACIVSA-N 1 2 320.433 2.480 20 10 DECDLO CCOc1ccc(C[N@H+]2CCN(CC(C)C)C(=O)[C@H]2C)c(O)c1 ZINC000779202622 642472213 /nfs/dbraw/zinc/47/22/13/642472213.db2.gz QQCFFLREOZCVOC-CQSZACIVSA-N 1 2 320.433 2.480 20 10 DECDLO C[C@H]1CN(C)C(=O)C[N@@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC000783735200 643044445 /nfs/dbraw/zinc/04/44/45/643044445.db2.gz ZUTWDVILMIKIOL-HNNXBMFYSA-N 1 2 301.434 2.339 20 10 DECDLO C[C@H]1CN(C)C(=O)C[N@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC000783735200 643044448 /nfs/dbraw/zinc/04/44/48/643044448.db2.gz ZUTWDVILMIKIOL-HNNXBMFYSA-N 1 2 301.434 2.339 20 10 DECDLO CN(Cc1ccccc1O)c1nc(NCCO)c2ccccc2[nH+]1 ZINC000786792407 643410085 /nfs/dbraw/zinc/41/00/85/643410085.db2.gz BEZDXIQGEVFWTG-UHFFFAOYSA-N 1 2 324.384 2.376 20 10 DECDLO Cc1noc(C(C)(C)[NH2+]Cc2ccc(N3CCOCC3)cc2)n1 ZINC000790621995 643874277 /nfs/dbraw/zinc/87/42/77/643874277.db2.gz HPSKFGPDSJYTIH-UHFFFAOYSA-N 1 2 316.405 2.240 20 10 DECDLO COc1ccc(O)c(C[N@@H+]2CCc3cc(Cl)nnc3C2)c1 ZINC000843417702 650970811 /nfs/dbraw/zinc/97/08/11/650970811.db2.gz AOSAPTNNWBALQF-UHFFFAOYSA-N 1 2 305.765 2.403 20 10 DECDLO COc1ccc(O)c(C[N@H+]2CCc3cc(Cl)nnc3C2)c1 ZINC000843417702 650970812 /nfs/dbraw/zinc/97/08/12/650970812.db2.gz AOSAPTNNWBALQF-UHFFFAOYSA-N 1 2 305.765 2.403 20 10 DECDLO CN(C)c1ccc(CN(C(=O)Cc2c[nH+]cn2C)C2CC2)cc1 ZINC000806424038 645829650 /nfs/dbraw/zinc/82/96/50/645829650.db2.gz YRRBCJQKOOPESN-UHFFFAOYSA-N 1 2 312.417 2.220 20 10 DECDLO CCN(CC)c1ccc(CNC(=O)Cc2c[nH+]cn2C)cc1 ZINC000806509502 645838975 /nfs/dbraw/zinc/83/89/75/645838975.db2.gz BLAVJQMAUVDJSH-UHFFFAOYSA-N 1 2 300.406 2.125 20 10 DECDLO C[C@H]([NH2+][C@@H]1CCc2[nH+]c[nH]c2C1)c1cc([N+](=O)[O-])ccc1[O-] ZINC000810253844 646345558 /nfs/dbraw/zinc/34/55/58/646345558.db2.gz DYHRNPVIHQHPBU-VHSXEESVSA-N 1 2 302.334 2.232 20 10 DECDLO COCC[NH2+]CCN[C@H](C)c1ccc(Br)cc1O ZINC000817964443 647395062 /nfs/dbraw/zinc/39/50/62/647395062.db2.gz CWCWROYYIUJWOS-SNVBAGLBSA-N 1 2 317.227 2.041 20 10 DECDLO O=C(C[C@H](n1cc[nH+]c1)C(F)(F)F)NCc1ccccc1O ZINC000821055330 647980008 /nfs/dbraw/zinc/98/00/08/647980008.db2.gz LRVZUOUCANGWTL-LBPRGKRZSA-N 1 2 313.279 2.399 20 10 DECDLO O=C1CC[C@H]2C[N@H+](Cc3cc(Cl)cc(F)c3O)CC[C@H]2N1 ZINC000827133977 648979307 /nfs/dbraw/zinc/97/93/07/648979307.db2.gz YVENFIHHJVVRTE-TVQRCGJNSA-N 1 2 312.772 2.285 20 10 DECDLO O=C1CC[C@H]2C[N@@H+](Cc3cc(Cl)cc(F)c3O)CC[C@H]2N1 ZINC000827133977 648979312 /nfs/dbraw/zinc/97/93/12/648979312.db2.gz YVENFIHHJVVRTE-TVQRCGJNSA-N 1 2 312.772 2.285 20 10 DECDLO C[C@@H](NC(=O)[C@H]1COCC[N@@H+]1C1CCCC1)c1ccccc1O ZINC000827947037 649109902 /nfs/dbraw/zinc/10/99/02/649109902.db2.gz ZAELRDAGLPYFPF-CZUORRHYSA-N 1 2 318.417 2.213 20 10 DECDLO C[C@@H](NC(=O)[C@H]1COCC[N@H+]1C1CCCC1)c1ccccc1O ZINC000827947037 649109904 /nfs/dbraw/zinc/10/99/04/649109904.db2.gz ZAELRDAGLPYFPF-CZUORRHYSA-N 1 2 318.417 2.213 20 10 DECDLO C[C@H](NC(=O)[C@@H]1CCc2c[nH+]cn2C1)c1ccc(N(C)C)cc1 ZINC000844138564 651082489 /nfs/dbraw/zinc/08/24/89/651082489.db2.gz HYOXVXDRFMUHIB-DZGCQCFKSA-N 1 2 312.417 2.389 20 10 DECDLO COc1ccc(O)c([C@@H](C)NC(=O)C[C@@H](C)n2cc[nH+]c2)c1 ZINC000845832739 651287570 /nfs/dbraw/zinc/28/75/70/651287570.db2.gz GKQMRDSUDHDDII-VXGBXAGGSA-N 1 2 303.362 2.426 20 10 DECDLO COc1ccc(O)c([C@H](C)NC(=O)C[C@H](C)n2cc[nH+]c2)c1 ZINC000845832736 651287733 /nfs/dbraw/zinc/28/77/33/651287733.db2.gz GKQMRDSUDHDDII-RYUDHWBXSA-N 1 2 303.362 2.426 20 10 DECDLO COc1ccc(O)c([C@H](C)NC(=O)[C@H](C)Cc2c[nH]c[nH+]2)c1 ZINC000847588792 651404376 /nfs/dbraw/zinc/40/43/76/651404376.db2.gz BZJNTSICOOYVAD-MNOVXSKESA-N 1 2 303.362 2.180 20 10 DECDLO COc1ccc(O)c([C@H](C)NC(=O)[C@H](C)Cc2c[nH+]c[nH]2)c1 ZINC000847588792 651404377 /nfs/dbraw/zinc/40/43/77/651404377.db2.gz BZJNTSICOOYVAD-MNOVXSKESA-N 1 2 303.362 2.180 20 10 DECDLO CN(C)c1ccc(C[NH2+]Cc2nc([C@@H]3CCCO3)n[nH]2)cc1 ZINC000848562451 651471074 /nfs/dbraw/zinc/47/10/74/651471074.db2.gz JXUHOCSMBGEVAC-AWEZNQCLSA-N 1 2 301.394 2.012 20 10 DECDLO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2nc(COC)n[nH]2)cc1 ZINC000850512920 651942190 /nfs/dbraw/zinc/94/21/90/651942190.db2.gz BYHXPYLYYCFZPF-GFCCVEGCSA-N 1 2 303.410 2.258 20 10 DECDLO Oc1c(Br)cccc1C[NH2+]C[C@H]1CC[C@@H](O)C1 ZINC000188845192 684364288 /nfs/dbraw/zinc/36/42/88/684364288.db2.gz OJDZNAOEQTWFMK-GXSJLCMTSA-N 1 2 300.196 2.405 20 10 DECDLO COc1ccc(N2CC[NH+](Cc3nn(C)cc3C)CC2)cc1F ZINC000929825048 694036063 /nfs/dbraw/zinc/03/60/63/694036063.db2.gz ZZFZHVYEVKANDX-UHFFFAOYSA-N 1 2 318.396 2.198 20 10 DECDLO Oc1c(C[NH+]2CCC([C@H](O)c3ncc[nH]3)CC2)ccc(F)c1F ZINC000877479716 690126518 /nfs/dbraw/zinc/12/65/18/690126518.db2.gz WXFSCALTKFHRAQ-HNNXBMFYSA-N 1 2 323.343 2.339 20 10 DECDLO CNC(=O)OC[C@@H]1CCCC[N@@H+]1Cc1ccc(F)c(F)c1O ZINC000877533830 690144294 /nfs/dbraw/zinc/14/42/94/690144294.db2.gz XEPVNBLIQZWNNX-NSHDSACASA-N 1 2 314.332 2.381 20 10 DECDLO CNC(=O)OC[C@@H]1CCCC[N@H+]1Cc1ccc(F)c(F)c1O ZINC000877533830 690144296 /nfs/dbraw/zinc/14/42/96/690144296.db2.gz XEPVNBLIQZWNNX-NSHDSACASA-N 1 2 314.332 2.381 20 10 DECDLO COC(=O)c1cc(C[N@@H+]2Cc3cccc(O)c3C2)n(C)c1C ZINC000877702521 690197112 /nfs/dbraw/zinc/19/71/12/690197112.db2.gz AAINPAMEIKAILN-UHFFFAOYSA-N 1 2 300.358 2.342 20 10 DECDLO COC(=O)c1cc(C[N@H+]2Cc3cccc(O)c3C2)n(C)c1C ZINC000877702521 690197114 /nfs/dbraw/zinc/19/71/14/690197114.db2.gz AAINPAMEIKAILN-UHFFFAOYSA-N 1 2 300.358 2.342 20 10 DECDLO OC[C@H]1C=C[C@@H]([NH2+]Cc2cc(Br)cc(F)c2O)C1 ZINC000883047804 691419509 /nfs/dbraw/zinc/41/95/09/691419509.db2.gz BDAYCIUNZNUVQV-GZMMTYOYSA-N 1 2 316.170 2.320 20 10 DECDLO Oc1c(F)cc(Cl)cc1C[N@@H+]1CC[C@H](C2OCCO2)C1 ZINC000896385665 693000493 /nfs/dbraw/zinc/00/04/93/693000493.db2.gz HZEGQHFFZZCKIS-VIFPVBQESA-N 1 2 301.745 2.380 20 10 DECDLO Oc1c(F)cc(Cl)cc1C[N@H+]1CC[C@H](C2OCCO2)C1 ZINC000896385665 693000496 /nfs/dbraw/zinc/00/04/96/693000496.db2.gz HZEGQHFFZZCKIS-VIFPVBQESA-N 1 2 301.745 2.380 20 10 DECDLO C[C@H]1CN(C2C[NH+](Cc3ccc(Cl)cc3O)C2)C[C@H](C)O1 ZINC001140468379 777201760 /nfs/dbraw/zinc/20/17/60/777201760.db2.gz ISXMOIBGFAJEIF-RYUDHWBXSA-N 1 2 310.825 2.339 20 10 DECDLO CC(C)(C)OC(=O)NC1(C)C[NH+](Cc2cc(O)ccc2O)C1 ZINC001141159327 778317083 /nfs/dbraw/zinc/31/70/83/778317083.db2.gz FBPPIQBJZSOTIX-UHFFFAOYSA-N 1 2 308.378 2.197 20 10 DECDLO C[C@H]1C[N@H+](Cc2cc(Br)c(F)cc2O)CC[C@H]1O ZINC001144298958 790847754 /nfs/dbraw/zinc/84/77/54/790847754.db2.gz MRNGUPNSIFSCKV-QPUJVOFHSA-N 1 2 318.186 2.497 20 10 DECDLO C[C@H]1C[N@@H+](Cc2cc(Br)c(F)cc2O)CC[C@H]1O ZINC001144298958 790847767 /nfs/dbraw/zinc/84/77/67/790847767.db2.gz MRNGUPNSIFSCKV-QPUJVOFHSA-N 1 2 318.186 2.497 20 10 DECDLO CO[C@@H]1C[N@H+](Cc2cccc(Br)c2O)C[C@@H]1OC ZINC000234879306 791644944 /nfs/dbraw/zinc/64/49/44/791644944.db2.gz KCXHIYWAGRFKFN-TXEJJXNPSA-N 1 2 316.195 2.000 20 10 DECDLO CO[C@@H]1C[N@@H+](Cc2cccc(Br)c2O)C[C@@H]1OC ZINC000234879306 791644948 /nfs/dbraw/zinc/64/49/48/791644948.db2.gz KCXHIYWAGRFKFN-TXEJJXNPSA-N 1 2 316.195 2.000 20 10 DECDLO O=C(CCc1ccc(O)c(O)c1)N1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC001182155260 795614476 /nfs/dbraw/zinc/61/44/76/795614476.db2.gz UPFGRDFSUVNSFK-ZDUSSCGKSA-N 1 2 315.373 2.160 20 10 DECDLO COC[C@H]1C[N@H+](Cc2cccc(F)c2O)Cc2cn(C)nc21 ZINC001138125190 796167337 /nfs/dbraw/zinc/16/73/37/796167337.db2.gz KLBAOOZCVUPLQF-CYBMUJFWSA-N 1 2 305.353 2.011 20 10 DECDLO COC[C@H]1C[N@@H+](Cc2cccc(F)c2O)Cc2cn(C)nc21 ZINC001138125190 796167341 /nfs/dbraw/zinc/16/73/41/796167341.db2.gz KLBAOOZCVUPLQF-CYBMUJFWSA-N 1 2 305.353 2.011 20 10 DECDLO CCOc1ccc(N2CC[NH+](Cc3cc(C)n(C)n3)CC2)cc1 ZINC001138831587 796290866 /nfs/dbraw/zinc/29/08/66/796290866.db2.gz MMYSCODIKLYYCS-UHFFFAOYSA-N 1 2 314.433 2.449 20 10 DECDLO OC[C@@H]1CCn2nccc2C[N@@H+]1Cc1ccc(Cl)cc1O ZINC001140464107 796525848 /nfs/dbraw/zinc/52/58/48/796525848.db2.gz BRWXNVGSXUWSJI-AWEZNQCLSA-N 1 2 307.781 2.009 20 10 DECDLO OC[C@@H]1CCn2nccc2C[N@H+]1Cc1ccc(Cl)cc1O ZINC001140464107 796525852 /nfs/dbraw/zinc/52/58/52/796525852.db2.gz BRWXNVGSXUWSJI-AWEZNQCLSA-N 1 2 307.781 2.009 20 10 DECDLO OC[C@@]1(C(F)(F)F)CC[N@H+](Cc2c(O)cc(F)cc2F)C1 ZINC001140583015 796540746 /nfs/dbraw/zinc/54/07/46/796540746.db2.gz TVRIVDKDHCOIFR-GFCCVEGCSA-N 1 2 311.250 2.417 20 10 DECDLO OC[C@@]1(C(F)(F)F)CC[N@@H+](Cc2c(O)cc(F)cc2F)C1 ZINC001140583015 796540750 /nfs/dbraw/zinc/54/07/50/796540750.db2.gz TVRIVDKDHCOIFR-GFCCVEGCSA-N 1 2 311.250 2.417 20 10 DECDLO Oc1cc(F)cc(F)c1C[N@@H+]1CC[C@@H](Oc2cnccn2)C1 ZINC001140585449 796542044 /nfs/dbraw/zinc/54/20/44/796542044.db2.gz IZOLORVWSWOSMV-LLVKDONJSA-N 1 2 307.300 2.114 20 10 DECDLO Oc1cc(F)cc(F)c1C[N@H+]1CC[C@@H](Oc2cnccn2)C1 ZINC001140585449 796542045 /nfs/dbraw/zinc/54/20/45/796542045.db2.gz IZOLORVWSWOSMV-LLVKDONJSA-N 1 2 307.300 2.114 20 10 DECDLO Fc1cc(N2CCOCC2)ccc1C[N@@H+]1CCOC[C@H]1C1CC1 ZINC001140664538 796553078 /nfs/dbraw/zinc/55/30/78/796553078.db2.gz KOYICSAFMWCACC-SFHVURJKSA-N 1 2 320.408 2.273 20 10 DECDLO Fc1cc(N2CCOCC2)ccc1C[N@H+]1CCOC[C@H]1C1CC1 ZINC001140664538 796553081 /nfs/dbraw/zinc/55/30/81/796553081.db2.gz KOYICSAFMWCACC-SFHVURJKSA-N 1 2 320.408 2.273 20 10 DECDLO Cc1cc(N2CC[NH+](Cc3cc(F)c(F)cc3O)CC2)ncn1 ZINC001142530235 796748333 /nfs/dbraw/zinc/74/83/33/796748333.db2.gz ARBCYWBNMDJDFY-UHFFFAOYSA-N 1 2 320.343 2.091 20 10 DECDLO C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc2c[nH+]ccc2[nH]1 ZINC001154024324 797446373 /nfs/dbraw/zinc/44/63/73/797446373.db2.gz ARJNTWJDJDYVRO-SNVBAGLBSA-N 1 2 311.341 2.335 20 10 DECDLO COc1cc(C[N@@H+]2CCO[C@@H](c3ccccn3)C2)c(O)cc1O ZINC001231638326 801702013 /nfs/dbraw/zinc/70/20/13/801702013.db2.gz XSDOXVRSEDSYOF-QGZVFWFLSA-N 1 2 316.357 2.075 20 10 DECDLO COc1cc(C[N@H+]2CCO[C@@H](c3ccccn3)C2)c(O)cc1O ZINC001231638326 801702015 /nfs/dbraw/zinc/70/20/15/801702015.db2.gz XSDOXVRSEDSYOF-QGZVFWFLSA-N 1 2 316.357 2.075 20 10 DECDLO COc1ncnc2c1CC[N@H+](Cc1cccc(Cl)c1O)CC2 ZINC001231911986 801749444 /nfs/dbraw/zinc/74/94/44/801749444.db2.gz VFOHVURAARJLJW-UHFFFAOYSA-N 1 2 319.792 2.445 20 10 DECDLO COc1ncnc2c1CC[N@@H+](Cc1cccc(Cl)c1O)CC2 ZINC001231911986 801749454 /nfs/dbraw/zinc/74/94/54/801749454.db2.gz VFOHVURAARJLJW-UHFFFAOYSA-N 1 2 319.792 2.445 20 10 DECDLO CN(C)c1ccc(C[N@@H+]2CCOC[C@@H]2c2cccnc2)c(O)c1 ZINC001232841038 801970790 /nfs/dbraw/zinc/97/07/90/801970790.db2.gz QFKAQALVIXBPBQ-QGZVFWFLSA-N 1 2 313.401 2.427 20 10 DECDLO CN(C)c1ccc(C[N@H+]2CCOC[C@@H]2c2cccnc2)c(O)c1 ZINC001232841038 801970794 /nfs/dbraw/zinc/97/07/94/801970794.db2.gz QFKAQALVIXBPBQ-QGZVFWFLSA-N 1 2 313.401 2.427 20 10 DECDLO Cc1cncnc1O[C@@H]1CC[N@@H+](Cc2c(O)ccc(F)c2F)C1 ZINC001233336492 802080078 /nfs/dbraw/zinc/08/00/78/802080078.db2.gz NUFAGORKFPKARD-LLVKDONJSA-N 1 2 321.327 2.422 20 10 DECDLO COC(=O)[C@@H](C)[N@H+](C)Cc1cccc(OC(F)(F)F)c1O ZINC001233761589 802200151 /nfs/dbraw/zinc/20/01/51/802200151.db2.gz VXFJMJWUBWPILL-MRVPVSSYSA-N 1 2 307.268 2.284 20 10 DECDLO COC(=O)[C@@H](C)[N@@H+](C)Cc1cccc(OC(F)(F)F)c1O ZINC001233761589 802200156 /nfs/dbraw/zinc/20/01/56/802200156.db2.gz VXFJMJWUBWPILL-MRVPVSSYSA-N 1 2 307.268 2.284 20 10 DECDLO C[C@@H]([NH2+]CC[C@H]1CCSC1)c1cccc(-c2nn[nH]n2)c1O ZINC001603661906 1070031489 /nfs/dbraw/zinc/03/14/89/1070031489.db2.gz DDNMAHXYXQSYKT-MNOVXSKESA-N 1 2 319.434 2.366 20 10 DECDLO C[C@@H]([NH2+]C[C@@H]([NH3+])c1ccccc1)c1cc(C(=O)[O-])ccc1O ZINC001604332145 1070332608 /nfs/dbraw/zinc/33/26/08/1070332608.db2.gz IDVWYCUKXDOQPR-IAQYHMDHSA-N 1 2 300.358 2.441 20 10 DECDLO C[C@H]1[C@H](CO)CC[N@H+]1Cc1cc(Br)cc(F)c1O ZINC001308724550 1147484183 /nfs/dbraw/zinc/48/41/83/1147484183.db2.gz SYCRNSGKNOPDKV-IUCAKERBSA-N 1 2 318.186 2.497 20 10 DECDLO C[C@H]1C[N@H+](Cc2cc(F)c(F)cc2O)C[C@@]2(CCCOC2)O1 ZINC001462156939 1058769820 /nfs/dbraw/zinc/76/98/20/1058769820.db2.gz VKMSSGYQOZRPRV-MEDUHNTESA-N 1 2 313.344 2.440 20 10 DECDLO C[C@H]1C[N@@H+](Cc2cc(F)c(F)cc2O)C[C@@]2(CCCOC2)O1 ZINC001462156939 1058769833 /nfs/dbraw/zinc/76/98/33/1058769833.db2.gz VKMSSGYQOZRPRV-MEDUHNTESA-N 1 2 313.344 2.440 20 10 DECDLO CN(CCCn1cc[nH+]c1)C(=O)c1ccc(N=NC(N)=O)cc1 ZINC001465986213 1059402855 /nfs/dbraw/zinc/40/28/55/1059402855.db2.gz HEUWFTBEJPLTSW-UHFFFAOYSA-N 1 2 314.349 2.208 20 10 DECDLO C[C@H](CN1CCCC1=O)[NH2+]Cc1cc(Cl)cc(F)c1O ZINC001620739391 1076109304 /nfs/dbraw/zinc/10/93/04/1076109304.db2.gz PJNSXDBEZWWMKQ-SECBINFHSA-N 1 2 300.761 2.285 20 10 DECDLO CC[C@@H]([NH2+]C[C@@H](C)CCOC)c1cccc(-c2nn[nH]n2)c1O ZINC001590464875 1076632568 /nfs/dbraw/zinc/63/25/68/1076632568.db2.gz QSDGRFKTFZEDSG-SMDDNHRTSA-N 1 2 319.409 2.286 20 10 DECDLO CC[N@H+](Cc1cc(F)c(F)cc1O)[C@H](C)CS(=O)(=O)CC ZINC001657473363 1080176134 /nfs/dbraw/zinc/17/61/34/1080176134.db2.gz DVYODGAKFMRUEF-SNVBAGLBSA-N 1 2 321.389 2.316 20 10 DECDLO CC[N@@H+](Cc1cc(F)c(F)cc1O)[C@H](C)CS(=O)(=O)CC ZINC001657473363 1080176139 /nfs/dbraw/zinc/17/61/39/1080176139.db2.gz DVYODGAKFMRUEF-SNVBAGLBSA-N 1 2 321.389 2.316 20 10 DECDLO OC[C@H]1CCC[N@H+](Cc2cc(F)cc(Br)c2O)C1 ZINC001235299314 1084378297 /nfs/dbraw/zinc/37/82/97/1084378297.db2.gz UCMPEFNLUCWQDW-VIFPVBQESA-N 1 2 318.186 2.498 20 10 DECDLO OC[C@H]1CCC[N@@H+](Cc2cc(F)cc(Br)c2O)C1 ZINC001235299314 1084378308 /nfs/dbraw/zinc/37/83/08/1084378308.db2.gz UCMPEFNLUCWQDW-VIFPVBQESA-N 1 2 318.186 2.498 20 10 DECDLO CCC[N@H+](CC(=O)NC)Cc1c(O)cccc1Br ZINC000707153395 1086662334 /nfs/dbraw/zinc/66/23/34/1086662334.db2.gz WMQXNHPGAVCFMH-UHFFFAOYSA-N 1 2 315.211 2.113 20 10 DECDLO CCC[N@@H+](CC(=O)NC)Cc1c(O)cccc1Br ZINC000707153395 1086662337 /nfs/dbraw/zinc/66/23/37/1086662337.db2.gz WMQXNHPGAVCFMH-UHFFFAOYSA-N 1 2 315.211 2.113 20 10 DECDLO CN1CC[C@]2(CC[N@H+](Cc3cc(F)cc(Cl)c3O)C2)C1=O ZINC001274441966 1091244800 /nfs/dbraw/zinc/24/48/00/1091244800.db2.gz KEKDIZHGQOHOET-OAHLLOKOSA-N 1 2 312.772 2.239 20 10 DECDLO CN1CC[C@]2(CC[N@@H+](Cc3cc(F)cc(Cl)c3O)C2)C1=O ZINC001274441966 1091244811 /nfs/dbraw/zinc/24/48/11/1091244811.db2.gz KEKDIZHGQOHOET-OAHLLOKOSA-N 1 2 312.772 2.239 20 10 DECDLO COc1cc(O)c(C[N@@H+]2CCO[C@]3(CCOC3)C2)c(Cl)c1 ZINC001236797532 1138431121 /nfs/dbraw/zinc/43/11/21/1138431121.db2.gz FXXWMJAPXGRNLZ-OAHLLOKOSA-N 1 2 313.781 2.046 20 10 DECDLO COc1cc(O)c(C[N@H+]2CCO[C@]3(CCOC3)C2)c(Cl)c1 ZINC001236797532 1138431126 /nfs/dbraw/zinc/43/11/26/1138431126.db2.gz FXXWMJAPXGRNLZ-OAHLLOKOSA-N 1 2 313.781 2.046 20 10 DECDLO CN1C(=O)CC[C@@H]2[C@H]1CC[N@H+]2Cc1cc(F)cc(Cl)c1O ZINC001237798801 1138791272 /nfs/dbraw/zinc/79/12/72/1138791272.db2.gz BJTHKSLCFBPYIW-CHWSQXEVSA-N 1 2 312.772 2.380 20 10 DECDLO C[C@H](CCS(C)(=O)=O)[NH2+]Cc1cc(Cl)cc(F)c1O ZINC001308329335 1147466991 /nfs/dbraw/zinc/46/69/91/1147466991.db2.gz VYGQFWQYRSXMEN-MRVPVSSYSA-N 1 2 309.790 2.098 20 10 DECDLO C[C@H]1[C@H](CO)CC[N@@H+]1Cc1cc(Br)cc(F)c1O ZINC001308724550 1147484176 /nfs/dbraw/zinc/48/41/76/1147484176.db2.gz SYCRNSGKNOPDKV-IUCAKERBSA-N 1 2 318.186 2.497 20 10 DECDLO C[C@@H](C[NH2+][C@@H](C)c1ccc(F)c(F)c1O)CN1CCOCC1 ZINC000187728717 295972108 /nfs/dbraw/zinc/97/21/08/295972108.db2.gz NEFHIGQEZMVFBO-RYUDHWBXSA-N 1 2 314.376 2.289 20 10 DECDLO C[C@H]([NH2+]CCN1CCSCC1)c1ccc(F)c(F)c1O ZINC000276971011 299298147 /nfs/dbraw/zinc/29/81/47/299298147.db2.gz UDIGOQRBWBCZCZ-JTQLQIEISA-N 1 2 302.390 2.370 20 10 DECDLO COc1c(C)c[nH+]c(CN(C)C(=O)c2cccc(O)c2O)c1C ZINC000192992682 533409786 /nfs/dbraw/zinc/40/97/86/533409786.db2.gz UGPCDLXDCAKSNI-UHFFFAOYSA-N 1 2 316.357 2.390 20 10 DECDLO CCc1nnc([C@@H](C)[NH2+][C@@H](C)c2cc(C(=O)OC)ccc2O)[nH]1 ZINC000273347974 130109731 /nfs/dbraw/zinc/10/97/31/130109731.db2.gz BCSJNDAPNXTHIH-VHSXEESVSA-N 1 2 318.377 2.271 20 10 DECDLO COC(=O)[C@@]1(F)CC[N@H+](Cc2cc(Cl)cc(OC)c2O)C1 ZINC000273703527 130154797 /nfs/dbraw/zinc/15/47/97/130154797.db2.gz DRLGYZBYYYONQH-CQSZACIVSA-N 1 2 317.744 2.141 20 10 DECDLO COC(=O)[C@@]1(F)CC[N@@H+](Cc2cc(Cl)cc(OC)c2O)C1 ZINC000273703527 130154799 /nfs/dbraw/zinc/15/47/99/130154799.db2.gz DRLGYZBYYYONQH-CQSZACIVSA-N 1 2 317.744 2.141 20 10 DECDLO CC(=O)c1cc(Cl)cc(C[NH2+][C@H](C)c2nncn2C)c1O ZINC000275202683 130298429 /nfs/dbraw/zinc/29/84/29/130298429.db2.gz QRXSZJNZLPSHAA-MRVPVSSYSA-N 1 2 308.769 2.228 20 10 DECDLO C[C@H]([NH2+]C[C@H]1CCCS(=O)(=O)C1)c1ccc(F)c(F)c1O ZINC000287136614 131266317 /nfs/dbraw/zinc/26/63/17/131266317.db2.gz RYNGQLIKLSPNIK-VHSXEESVSA-N 1 2 319.373 2.146 20 10 DECDLO C[C@H]([C@H](C)[N@H+](C)Cc1cccc(Cl)c1O)S(C)(=O)=O ZINC000180260074 402611524 /nfs/dbraw/zinc/61/15/24/402611524.db2.gz JRIPAZJWOJWVAY-VHSXEESVSA-N 1 2 305.827 2.299 20 10 DECDLO C[C@H]([C@H](C)[N@@H+](C)Cc1cccc(Cl)c1O)S(C)(=O)=O ZINC000180260074 402611525 /nfs/dbraw/zinc/61/15/25/402611525.db2.gz JRIPAZJWOJWVAY-VHSXEESVSA-N 1 2 305.827 2.299 20 10 DECDLO CCn1ncnc1C[N@@H+](Cc1ccccc1O)C[C@H]1CCCO1 ZINC000193425908 402770984 /nfs/dbraw/zinc/77/09/84/402770984.db2.gz CZIWZBJRHUTXDJ-OAHLLOKOSA-N 1 2 316.405 2.185 20 10 DECDLO CCn1ncnc1C[N@H+](Cc1ccccc1O)C[C@H]1CCCO1 ZINC000193425908 402770986 /nfs/dbraw/zinc/77/09/86/402770986.db2.gz CZIWZBJRHUTXDJ-OAHLLOKOSA-N 1 2 316.405 2.185 20 10 DECDLO CCCOc1ccc(C[N@@H+]2CCOC[C@@]23CCOC3)c(O)c1 ZINC000195017341 402826955 /nfs/dbraw/zinc/82/69/55/402826955.db2.gz DVNJZAMYZPGMTK-KRWDZBQOSA-N 1 2 307.390 2.172 20 10 DECDLO CCCOc1ccc(C[N@H+]2CCOC[C@@]23CCOC3)c(O)c1 ZINC000195017341 402826957 /nfs/dbraw/zinc/82/69/57/402826957.db2.gz DVNJZAMYZPGMTK-KRWDZBQOSA-N 1 2 307.390 2.172 20 10 DECDLO COc1ccc(O)c(CNc2nc(N(C)C)nc(C(C)C)[nH+]2)c1 ZINC000301893601 403697380 /nfs/dbraw/zinc/69/73/80/403697380.db2.gz ASHBLNOIQDTNGM-UHFFFAOYSA-N 1 2 317.393 2.387 20 10 DECDLO COc1ccc(O)c(CNc2nc(C(C)C)[nH+]c(N(C)C)n2)c1 ZINC000301893601 403697385 /nfs/dbraw/zinc/69/73/85/403697385.db2.gz ASHBLNOIQDTNGM-UHFFFAOYSA-N 1 2 317.393 2.387 20 10 DECDLO C[C@H]([C@H](C)S(C)(=O)=O)[N@H+](C)Cc1cc(Cl)c(F)cc1O ZINC000295455600 403933891 /nfs/dbraw/zinc/93/38/91/403933891.db2.gz VLXHKJGPZCVLRK-BDAKNGLRSA-N 1 2 323.817 2.438 20 10 DECDLO C[C@H]([C@H](C)S(C)(=O)=O)[N@@H+](C)Cc1cc(Cl)c(F)cc1O ZINC000295455600 403933894 /nfs/dbraw/zinc/93/38/94/403933894.db2.gz VLXHKJGPZCVLRK-BDAKNGLRSA-N 1 2 323.817 2.438 20 10 DECDLO CC[C@@H]([NH2+]CCCn1cc(CO)nn1)c1cccc(Cl)c1O ZINC000289627817 403989537 /nfs/dbraw/zinc/98/95/37/403989537.db2.gz FAOAXZQUVIASMR-CQSZACIVSA-N 1 2 324.812 2.260 20 10 DECDLO Cc1cn[nH]c1C[N@@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000290557802 404219840 /nfs/dbraw/zinc/21/98/40/404219840.db2.gz XGXWANVWJIMMCF-UHFFFAOYSA-N 1 2 300.406 2.187 20 10 DECDLO Cc1cc(Br)cc(C[NH2+][C@@]2(C)CCOC2=O)c1O ZINC000291044581 404371583 /nfs/dbraw/zinc/37/15/83/404371583.db2.gz ZJQGFSFFXVXLIW-ZDUSSCGKSA-N 1 2 314.179 2.258 20 10 DECDLO COC(=O)[C@H]1C[C@H](OC)CC[N@@H+]1Cc1ccc(N(C)C)c(F)c1 ZINC000359993969 404811545 /nfs/dbraw/zinc/81/15/45/404811545.db2.gz AMQNOCXZZURYGW-CZUORRHYSA-N 1 2 324.396 2.044 20 10 DECDLO COC(=O)[C@H]1C[C@H](OC)CC[N@H+]1Cc1ccc(N(C)C)c(F)c1 ZINC000359993969 404811547 /nfs/dbraw/zinc/81/15/47/404811547.db2.gz AMQNOCXZZURYGW-CZUORRHYSA-N 1 2 324.396 2.044 20 10 DECDLO CCOC[C@@H]1C[N@H+](Cc2c(O)ccc(Cl)c2F)CCO1 ZINC000529667208 405763388 /nfs/dbraw/zinc/76/33/88/405763388.db2.gz SKZBRJXJXDPCFL-JTQLQIEISA-N 1 2 303.761 2.422 20 10 DECDLO CCOC[C@@H]1C[N@@H+](Cc2c(O)ccc(Cl)c2F)CCO1 ZINC000529667208 405763392 /nfs/dbraw/zinc/76/33/92/405763392.db2.gz SKZBRJXJXDPCFL-JTQLQIEISA-N 1 2 303.761 2.422 20 10 DECDLO C[C@H]([NH2+][C@@H]1CCCN(CCCO)C1)c1cc(F)cc(F)c1O ZINC000834849556 649854190 /nfs/dbraw/zinc/85/41/90/649854190.db2.gz BYTQORKBYHGXCC-WCQYABFASA-N 1 2 314.376 2.168 20 10 DECDLO O=C(C=Cc1ccc(O)c(O)c1)N1CCC(c2c[nH+]c[nH]2)CC1 ZINC000364977398 333333643 /nfs/dbraw/zinc/33/36/43/333333643.db2.gz GPYUMKRXEWYXJR-DUXPYHPUSA-N 1 2 313.357 2.240 20 10 DECDLO O=C(C=Cc1ccc(O)c(O)c1)N1CCC(c2c[nH]c[nH+]2)CC1 ZINC000364977398 333333645 /nfs/dbraw/zinc/33/36/45/333333645.db2.gz GPYUMKRXEWYXJR-DUXPYHPUSA-N 1 2 313.357 2.240 20 10 DECDLO COC(=O)C[C@H]1COCC[N@@H+]1Cc1cc(Cl)cc(C)c1O ZINC000377869885 533735264 /nfs/dbraw/zinc/73/52/64/533735264.db2.gz RLOLVGLPVNCCCB-ZDUSSCGKSA-N 1 2 313.781 2.118 20 10 DECDLO COC(=O)C[C@H]1COCC[N@H+]1Cc1cc(Cl)cc(C)c1O ZINC000377869885 533735268 /nfs/dbraw/zinc/73/52/68/533735268.db2.gz RLOLVGLPVNCCCB-ZDUSSCGKSA-N 1 2 313.781 2.118 20 10 DECDLO CCS(=O)(=O)NCCC[N@H+](C)c1ccc(OC(C)C)cc1 ZINC000191593428 521672569 /nfs/dbraw/zinc/67/25/69/521672569.db2.gz IZGCLZUVGYFBBV-UHFFFAOYSA-N 1 2 314.451 2.239 20 10 DECDLO CCS(=O)(=O)NCCC[N@@H+](C)c1ccc(OC(C)C)cc1 ZINC000191593428 521672570 /nfs/dbraw/zinc/67/25/70/521672570.db2.gz IZGCLZUVGYFBBV-UHFFFAOYSA-N 1 2 314.451 2.239 20 10 DECDLO NC(=O)C1CC[NH+](Cc2cc(Cl)cc(Cl)c2O)CC1 ZINC000158610604 526857899 /nfs/dbraw/zinc/85/78/99/526857899.db2.gz SLNNPAICZMMXPQ-UHFFFAOYSA-N 1 2 303.189 2.396 20 10 DECDLO CCN1CCC[N@H+](Cc2cc(Cl)c(F)cc2O)CC1=O ZINC000294577044 529041867 /nfs/dbraw/zinc/04/18/67/529041867.db2.gz GTNPHSMEYDQVHZ-UHFFFAOYSA-N 1 2 300.761 2.239 20 10 DECDLO CCN1CCC[N@@H+](Cc2cc(Cl)c(F)cc2O)CC1=O ZINC000294577044 529041871 /nfs/dbraw/zinc/04/18/71/529041871.db2.gz GTNPHSMEYDQVHZ-UHFFFAOYSA-N 1 2 300.761 2.239 20 10 DECDLO Cc1nocc1C[NH2+]Cc1ccc(N2CCN(C)CC2)c(F)c1 ZINC001330600476 1149208109 /nfs/dbraw/zinc/20/81/09/1149208109.db2.gz ISODEWHBEHLWAV-UHFFFAOYSA-N 1 2 318.396 2.164 20 10 DECDLO Oc1c(Br)cccc1C[NH2+][C@@H]1CCN(C2CC2)C1 ZINC000044687825 623690265 /nfs/dbraw/zinc/69/02/65/623690265.db2.gz RMPJFNIIUOLXGP-LLVKDONJSA-N 1 2 311.223 2.481 20 10 DECDLO CCOC(=O)N1CCC[N@H+](Cc2cc(F)cc(F)c2O)CC1 ZINC000893984241 636083309 /nfs/dbraw/zinc/08/33/09/636083309.db2.gz MBYVANXWPRBOEM-UHFFFAOYSA-N 1 2 314.332 2.335 20 10 DECDLO CCOC(=O)N1CCC[N@@H+](Cc2cc(F)cc(F)c2O)CC1 ZINC000893984241 636083312 /nfs/dbraw/zinc/08/33/12/636083312.db2.gz MBYVANXWPRBOEM-UHFFFAOYSA-N 1 2 314.332 2.335 20 10 DECDLO Cc1nnc([C@@H]2CCC[N@H+](Cc3cc(F)cc(F)c3O)C2)[nH]1 ZINC000894093875 636110725 /nfs/dbraw/zinc/11/07/25/636110725.db2.gz HRHMTPVJHPDLJN-SNVBAGLBSA-N 1 2 308.332 2.477 20 10 DECDLO Cc1nnc([C@@H]2CCC[N@@H+](Cc3cc(F)cc(F)c3O)C2)[nH]1 ZINC000894093875 636110726 /nfs/dbraw/zinc/11/07/26/636110726.db2.gz HRHMTPVJHPDLJN-SNVBAGLBSA-N 1 2 308.332 2.477 20 10 DECDLO Cc1nnc([C@@H](C)[N@H+](C)Cc2ccc(N3CCOCC3)cc2)[nH]1 ZINC000839459761 637883816 /nfs/dbraw/zinc/88/38/16/637883816.db2.gz SGWWIDXPWQBHDO-CYBMUJFWSA-N 1 2 315.421 2.143 20 10 DECDLO Cc1nnc([C@@H](C)[N@@H+](C)Cc2ccc(N3CCOCC3)cc2)[nH]1 ZINC000839459761 637883825 /nfs/dbraw/zinc/88/38/25/637883825.db2.gz SGWWIDXPWQBHDO-CYBMUJFWSA-N 1 2 315.421 2.143 20 10 DECDLO C[C@@H](NC(=O)C1=CC(=O)CS1)C1([NH+]2CCOCC2)CCCC1 ZINC000748351057 638545023 /nfs/dbraw/zinc/54/50/23/638545023.db2.gz NUVSWVIHMHLBPL-GFCCVEGCSA-N 1 2 324.446 2.217 20 10 DECDLO C[C@@H]([NH2+]CC1CCS(=O)(=O)CC1)c1cc(F)cc(F)c1O ZINC000756774900 639694020 /nfs/dbraw/zinc/69/40/20/639694020.db2.gz DXKCBPOGEDHQKO-SECBINFHSA-N 1 2 319.373 2.146 20 10 DECDLO C[C@H]1C[N@H+](CCO)[C@@H](C)CN1Cc1cc(Cl)cc(F)c1O ZINC000841891365 650594394 /nfs/dbraw/zinc/59/43/94/650594394.db2.gz KQVRRJZDCXUUSE-QWRGUYRKSA-N 1 2 316.804 2.072 20 10 DECDLO C[C@H]1C[N@@H+](CCO)[C@@H](C)CN1Cc1cc(Cl)cc(F)c1O ZINC000841891365 650594396 /nfs/dbraw/zinc/59/43/96/650594396.db2.gz KQVRRJZDCXUUSE-QWRGUYRKSA-N 1 2 316.804 2.072 20 10 DECDLO COC(=O)c1cc(C2C[NH+](Cc3cccc(Cl)c3O)C2)[nH]n1 ZINC000898004837 640990750 /nfs/dbraw/zinc/99/07/50/640990750.db2.gz NRAWDCSULUBSEF-UHFFFAOYSA-N 1 2 321.764 2.155 20 10 DECDLO COc1c(O)c(C[N@@H+]2C[C@H](C)O[C@@H](C)[C@H]2C)ccc1[N+](=O)[O-] ZINC000775097977 642006637 /nfs/dbraw/zinc/00/66/37/642006637.db2.gz MZYHPYDOKTVONP-AXFHLTTASA-N 1 2 310.350 2.307 20 10 DECDLO COc1c(O)c(C[N@H+]2C[C@H](C)O[C@@H](C)[C@H]2C)ccc1[N+](=O)[O-] ZINC000775097977 642006641 /nfs/dbraw/zinc/00/66/41/642006641.db2.gz MZYHPYDOKTVONP-AXFHLTTASA-N 1 2 310.350 2.307 20 10 DECDLO C[C@H](NC(=O)[C@H]1CCn2c[nH+]cc2C1)c1ccc(N(C)C)cc1 ZINC000775402421 642039573 /nfs/dbraw/zinc/03/95/73/642039573.db2.gz ARMGPCAXBISNTD-ZFWWWQNUSA-N 1 2 312.417 2.389 20 10 DECDLO Oc1c(Cl)cccc1CN1CC[NH+](C[C@H]2CCCO2)CC1 ZINC000775645699 642071520 /nfs/dbraw/zinc/07/15/20/642071520.db2.gz FQTNIWBDZGZCAJ-CQSZACIVSA-N 1 2 310.825 2.342 20 10 DECDLO C[N@H+](Cc1cc(Cl)cc(F)c1O)[C@H]1CCCCNC1=O ZINC000775666984 642075194 /nfs/dbraw/zinc/07/51/94/642075194.db2.gz BSAMYUIGCMVPIR-LBPRGKRZSA-N 1 2 300.761 2.285 20 10 DECDLO C[N@@H+](Cc1cc(Cl)cc(F)c1O)[C@H]1CCCCNC1=O ZINC000775666984 642075195 /nfs/dbraw/zinc/07/51/95/642075195.db2.gz BSAMYUIGCMVPIR-LBPRGKRZSA-N 1 2 300.761 2.285 20 10 DECDLO NC(=O)C[C@H]1CCC[N@H+](Cc2cc(Cl)cc(F)c2O)C1 ZINC000775727212 642085223 /nfs/dbraw/zinc/08/52/23/642085223.db2.gz MKCRQIBAUPUQIG-SECBINFHSA-N 1 2 300.761 2.272 20 10 DECDLO NC(=O)C[C@H]1CCC[N@@H+](Cc2cc(Cl)cc(F)c2O)C1 ZINC000775727212 642085227 /nfs/dbraw/zinc/08/52/27/642085227.db2.gz MKCRQIBAUPUQIG-SECBINFHSA-N 1 2 300.761 2.272 20 10 DECDLO COCCO[C@H]1CC[N@H+](Cc2cc(Cl)cc(F)c2O)C1 ZINC000783715163 643041759 /nfs/dbraw/zinc/04/17/59/643041759.db2.gz INKZSINJZSARDF-LBPRGKRZSA-N 1 2 303.761 2.422 20 10 DECDLO COCCO[C@H]1CC[N@@H+](Cc2cc(Cl)cc(F)c2O)C1 ZINC000783715163 643041760 /nfs/dbraw/zinc/04/17/60/643041760.db2.gz INKZSINJZSARDF-LBPRGKRZSA-N 1 2 303.761 2.422 20 10 DECDLO C[C@@H]([NH2+]Cc1cccc(Br)c1O)c1ncnn1C ZINC000788972038 643666790 /nfs/dbraw/zinc/66/67/90/643666790.db2.gz UCSMIABXKQNIHJ-MRVPVSSYSA-N 1 2 311.183 2.134 20 10 DECDLO Cc1cc(NC(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)c(C)c[nH+]1 ZINC000797639065 644903476 /nfs/dbraw/zinc/90/34/76/644903476.db2.gz FQZFJABMCOCWEA-LBPRGKRZSA-N 1 2 315.373 2.284 20 10 DECDLO COc1ccc(O)c([C@H](C)NC(=O)[C@@H]2C[C@H]2c2c[nH]c[nH+]2)c1 ZINC000821064679 647982880 /nfs/dbraw/zinc/98/28/80/647982880.db2.gz FTXFSGXONQICMH-ZWKOPEQDSA-N 1 2 301.346 2.105 20 10 DECDLO COc1ccc(O)c([C@H](C)NC(=O)[C@@H]2C[C@H]2c2c[nH+]c[nH]2)c1 ZINC000821064679 647982884 /nfs/dbraw/zinc/98/28/84/647982884.db2.gz FTXFSGXONQICMH-ZWKOPEQDSA-N 1 2 301.346 2.105 20 10 DECDLO C[N@H+](Cc1c[nH]cn1)Cc1ccc(N2CCOCC2)c(F)c1 ZINC000826770164 648924185 /nfs/dbraw/zinc/92/41/85/648924185.db2.gz UPVWKDJGZSBJOC-UHFFFAOYSA-N 1 2 304.369 2.017 20 10 DECDLO C[N@@H+](Cc1c[nH]cn1)Cc1ccc(N2CCOCC2)c(F)c1 ZINC000826770164 648924190 /nfs/dbraw/zinc/92/41/90/648924190.db2.gz UPVWKDJGZSBJOC-UHFFFAOYSA-N 1 2 304.369 2.017 20 10 DECDLO Oc1ccc2c(c1)C[N@@H+](Cc1cc3c(cc1O)OCO3)CCO2 ZINC000827656637 649061962 /nfs/dbraw/zinc/06/19/62/649061962.db2.gz KHXOQPIJZIRTLF-UHFFFAOYSA-N 1 2 315.325 2.221 20 10 DECDLO Oc1ccc2c(c1)C[N@H+](Cc1cc3c(cc1O)OCO3)CCO2 ZINC000827656637 649061967 /nfs/dbraw/zinc/06/19/67/649061967.db2.gz KHXOQPIJZIRTLF-UHFFFAOYSA-N 1 2 315.325 2.221 20 10 DECDLO CC[C@H]([NH2+]Cc1nc(COC)n[nH]1)c1ccc(N(C)C)cc1 ZINC000850515542 651942377 /nfs/dbraw/zinc/94/23/77/651942377.db2.gz YFAHGMPOTRVHMB-AWEZNQCLSA-N 1 2 303.410 2.258 20 10 DECDLO COc1ccc(N2CCN(Cc3[nH]c(C)c(C)[nH+]3)CC2)cc1F ZINC000862251552 686265694 /nfs/dbraw/zinc/26/56/94/686265694.db2.gz HDGIQVUCAZHPFC-UHFFFAOYSA-N 1 2 318.396 2.496 20 10 DECDLO CCC(CC)[C@H](C(=O)N(C)c1ccc(N)cc1)[NH+]1CCOCC1 ZINC000877077527 690013781 /nfs/dbraw/zinc/01/37/81/690013781.db2.gz LRSRVEBKFSHLDM-QGZVFWFLSA-N 1 2 319.449 2.369 20 10 DECDLO CN(C)C(=O)O[C@H]1CCC[N@H+](Cc2ccc(F)c(F)c2O)C1 ZINC000877560567 690152383 /nfs/dbraw/zinc/15/23/83/690152383.db2.gz VDQDSWWOJWXKEW-NSHDSACASA-N 1 2 314.332 2.333 20 10 DECDLO CN(C)C(=O)O[C@H]1CCC[N@@H+](Cc2ccc(F)c(F)c2O)C1 ZINC000877560567 690152384 /nfs/dbraw/zinc/15/23/84/690152384.db2.gz VDQDSWWOJWXKEW-NSHDSACASA-N 1 2 314.332 2.333 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@@H+](C)[C@@H](CC(C)C)C(N)=O)c1O ZINC000880590946 690936180 /nfs/dbraw/zinc/93/61/80/690936180.db2.gz RICLBDHKLAHZSC-AWEZNQCLSA-N 1 2 310.369 2.066 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@H+](C)[C@@H](CC(C)C)C(N)=O)c1O ZINC000880590946 690936182 /nfs/dbraw/zinc/93/61/82/690936182.db2.gz RICLBDHKLAHZSC-AWEZNQCLSA-N 1 2 310.369 2.066 20 10 DECDLO O=C(c1cccc(O)c1O)N1CC[N@@H+]2CCc3ccccc3[C@H]2C1 ZINC001148218424 791713028 /nfs/dbraw/zinc/71/30/28/791713028.db2.gz CGWBJLGOUQCACN-MRXNPFEDSA-N 1 2 324.380 2.153 20 10 DECDLO O=C(c1cccc(O)c1O)N1CC[N@H+]2CCc3ccccc3[C@H]2C1 ZINC001148218424 791713032 /nfs/dbraw/zinc/71/30/32/791713032.db2.gz CGWBJLGOUQCACN-MRXNPFEDSA-N 1 2 324.380 2.153 20 10 DECDLO C[C@H](C[NH2+]Cc1cc(Br)cc(F)c1O)N(C)C ZINC000715778460 792511603 /nfs/dbraw/zinc/51/16/03/792511603.db2.gz METWYEHAYLYXQG-MRVPVSSYSA-N 1 2 305.191 2.334 20 10 DECDLO COc1cc(C[N@H+](C)Cc2cn(C)nn2)c(O)c(C(C)(C)C)c1 ZINC001118532605 795198031 /nfs/dbraw/zinc/19/80/31/795198031.db2.gz WQCBWGILDZJNOM-UHFFFAOYSA-N 1 2 318.421 2.459 20 10 DECDLO COc1cc(C[N@@H+](C)Cc2cn(C)nn2)c(O)c(C(C)(C)C)c1 ZINC001118532605 795198035 /nfs/dbraw/zinc/19/80/35/795198035.db2.gz WQCBWGILDZJNOM-UHFFFAOYSA-N 1 2 318.421 2.459 20 10 DECDLO Nc1ccc(CC(=O)N2CCC(Nc3cccc[nH+]3)CC2)cc1 ZINC001122224128 795737422 /nfs/dbraw/zinc/73/74/22/795737422.db2.gz FVLYWMZEYXQGLH-UHFFFAOYSA-N 1 2 310.401 2.309 20 10 DECDLO COCCCN1CC[NH+](Cc2ccc3c(c2)CCCN3C)CC1 ZINC001138356381 796204270 /nfs/dbraw/zinc/20/42/70/796204270.db2.gz NNJRXJVOGFYEHX-UHFFFAOYSA-N 1 2 317.477 2.223 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CCCC12COC2 ZINC001139129231 796328694 /nfs/dbraw/zinc/32/86/94/796328694.db2.gz RGCMUOOGXGXLDP-UHFFFAOYSA-N 1 2 301.342 2.172 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CCCC12COC2 ZINC001139129231 796328697 /nfs/dbraw/zinc/32/86/97/796328697.db2.gz RGCMUOOGXGXLDP-UHFFFAOYSA-N 1 2 301.342 2.172 20 10 DECDLO COC[C@@H]1C[N@@H+](Cc2cc(F)ccc2O)Cc2ncn(C)c21 ZINC001140054300 796470733 /nfs/dbraw/zinc/47/07/33/796470733.db2.gz PADSACVDRDXLMQ-LBPRGKRZSA-N 1 2 305.353 2.011 20 10 DECDLO CCOC(=O)CC[N@H+](CC(=O)OCC)Cc1cc(C)ccc1O ZINC001140620866 796546736 /nfs/dbraw/zinc/54/67/36/796546736.db2.gz BXGOQPABABZIJM-UHFFFAOYSA-N 1 2 323.389 2.019 20 10 DECDLO CCOC(=O)CC[N@@H+](CC(=O)OCC)Cc1cc(C)ccc1O ZINC001140620866 796546740 /nfs/dbraw/zinc/54/67/40/796546740.db2.gz BXGOQPABABZIJM-UHFFFAOYSA-N 1 2 323.389 2.019 20 10 DECDLO C[C@@H]1CC[N@H+](Cc2ccc(N3CCOCC3)cc2F)CCC1=O ZINC001140660253 796552046 /nfs/dbraw/zinc/55/20/46/796552046.db2.gz LUNRTASEXYPVQE-CQSZACIVSA-N 1 2 320.408 2.463 20 10 DECDLO C[C@@H]1CC[N@@H+](Cc2ccc(N3CCOCC3)cc2F)CCC1=O ZINC001140660253 796552047 /nfs/dbraw/zinc/55/20/47/796552047.db2.gz LUNRTASEXYPVQE-CQSZACIVSA-N 1 2 320.408 2.463 20 10 DECDLO CC(=O)N1CC[N@@H+](Cc2ccc(N(C)C)cc2Cl)C[C@@H]1C ZINC001140926710 796598353 /nfs/dbraw/zinc/59/83/53/796598353.db2.gz RJDBMLMHWIVRRB-LBPRGKRZSA-N 1 2 309.841 2.459 20 10 DECDLO CC(=O)N1CC[N@H+](Cc2ccc(N(C)C)cc2Cl)C[C@@H]1C ZINC001140926710 796598358 /nfs/dbraw/zinc/59/83/58/796598358.db2.gz RJDBMLMHWIVRRB-LBPRGKRZSA-N 1 2 309.841 2.459 20 10 DECDLO CC(=O)N1CC[N@H+](Cc2ccc(N(C)C)cc2Cl)[C@@H](C)C1 ZINC001140926006 796598750 /nfs/dbraw/zinc/59/87/50/796598750.db2.gz XDKRRLUVVHRTIF-LBPRGKRZSA-N 1 2 309.841 2.459 20 10 DECDLO CC(=O)N1CC[N@@H+](Cc2ccc(N(C)C)cc2Cl)[C@@H](C)C1 ZINC001140926006 796598756 /nfs/dbraw/zinc/59/87/56/796598756.db2.gz XDKRRLUVVHRTIF-LBPRGKRZSA-N 1 2 309.841 2.459 20 10 DECDLO CCOC(=O)C[N@H+](Cc1ccc2c(c1)OCCN2C)C1CC1 ZINC001141146445 796639682 /nfs/dbraw/zinc/63/96/82/796639682.db2.gz VMNKXCJXEYISTP-UHFFFAOYSA-N 1 2 304.390 2.043 20 10 DECDLO CCOC(=O)C[N@@H+](Cc1ccc2c(c1)OCCN2C)C1CC1 ZINC001141146445 796639683 /nfs/dbraw/zinc/63/96/83/796639683.db2.gz VMNKXCJXEYISTP-UHFFFAOYSA-N 1 2 304.390 2.043 20 10 DECDLO COc1ccc(N2CC[NH+](Cc3cnc(C)nc3)CC2)c(C)c1 ZINC001203120973 796744193 /nfs/dbraw/zinc/74/41/93/796744193.db2.gz JCOADJANDFBDJB-UHFFFAOYSA-N 1 2 312.417 2.424 20 10 DECDLO CCOCc1ncn2c1C[N@H+](Cc1cc(OC)ccc1O)CC2 ZINC001203672728 800103302 /nfs/dbraw/zinc/10/33/02/800103302.db2.gz CJWGWAZSXVUVBH-UHFFFAOYSA-N 1 2 317.389 2.150 20 10 DECDLO CCOCc1ncn2c1C[N@@H+](Cc1cc(OC)ccc1O)CC2 ZINC001203672728 800103306 /nfs/dbraw/zinc/10/33/06/800103306.db2.gz CJWGWAZSXVUVBH-UHFFFAOYSA-N 1 2 317.389 2.150 20 10 DECDLO Cn1nccc1[C@@H]1C[N@H+](Cc2ccc(Cl)cc2O)CCO1 ZINC001207684852 800806206 /nfs/dbraw/zinc/80/62/06/800806206.db2.gz KACHYNPULZPRIH-HNNXBMFYSA-N 1 2 307.781 2.353 20 10 DECDLO Cn1nccc1[C@@H]1C[N@@H+](Cc2ccc(Cl)cc2O)CCO1 ZINC001207684852 800806214 /nfs/dbraw/zinc/80/62/14/800806214.db2.gz KACHYNPULZPRIH-HNNXBMFYSA-N 1 2 307.781 2.353 20 10 DECDLO CCn1nnc2c1CC[N@H+](Cc1cccc(C)c1O)[C@@H]2COC ZINC001231591446 801690456 /nfs/dbraw/zinc/69/04/56/801690456.db2.gz CTJPSNXBIPZMHR-OAHLLOKOSA-N 1 2 316.405 2.058 20 10 DECDLO CCn1nnc2c1CC[N@@H+](Cc1cccc(C)c1O)[C@@H]2COC ZINC001231591446 801690458 /nfs/dbraw/zinc/69/04/58/801690458.db2.gz CTJPSNXBIPZMHR-OAHLLOKOSA-N 1 2 316.405 2.058 20 10 DECDLO Cc1ncc(C[N@@H+](C)Cc2ccc(N3CCOCC3)cc2)[nH]1 ZINC001232461731 801888348 /nfs/dbraw/zinc/88/83/48/801888348.db2.gz DWIAYWJLOLBIRX-UHFFFAOYSA-N 1 2 300.406 2.187 20 10 DECDLO Cc1ncc(C[N@H+](C)Cc2ccc(N3CCOCC3)cc2)[nH]1 ZINC001232461731 801888355 /nfs/dbraw/zinc/88/83/55/801888355.db2.gz DWIAYWJLOLBIRX-UHFFFAOYSA-N 1 2 300.406 2.187 20 10 DECDLO Cc1nc(C[N@@H+](C)Cc2ccc(N3CCOCC3)cc2)c[nH]1 ZINC001232461731 801888362 /nfs/dbraw/zinc/88/83/62/801888362.db2.gz DWIAYWJLOLBIRX-UHFFFAOYSA-N 1 2 300.406 2.187 20 10 DECDLO Cc1nc(C[N@H+](C)Cc2ccc(N3CCOCC3)cc2)c[nH]1 ZINC001232461731 801888370 /nfs/dbraw/zinc/88/83/70/801888370.db2.gz DWIAYWJLOLBIRX-UHFFFAOYSA-N 1 2 300.406 2.187 20 10 DECDLO C[C@H]1C[N@H+](Cc2c(O)cc(Br)cc2F)C[C@@H]1O ZINC001233028916 802006957 /nfs/dbraw/zinc/00/69/57/802006957.db2.gz VRHNGYUAPBLIRH-MADCSZMMSA-N 1 2 304.159 2.106 20 10 DECDLO C[C@H]1C[N@@H+](Cc2c(O)cc(Br)cc2F)C[C@@H]1O ZINC001233028916 802006964 /nfs/dbraw/zinc/00/69/64/802006964.db2.gz VRHNGYUAPBLIRH-MADCSZMMSA-N 1 2 304.159 2.106 20 10 DECDLO CN1CC[N@@H+](Cc2cc(O)c(O)cc2O)[C@H](c2ccccc2)C1 ZINC001233482192 802126312 /nfs/dbraw/zinc/12/63/12/802126312.db2.gz DNAOMCDJASPZEL-HNNXBMFYSA-N 1 2 314.385 2.292 20 10 DECDLO CN1CC[N@H+](Cc2cc(O)c(O)cc2O)[C@H](c2ccccc2)C1 ZINC001233482192 802126308 /nfs/dbraw/zinc/12/63/08/802126308.db2.gz DNAOMCDJASPZEL-HNNXBMFYSA-N 1 2 314.385 2.292 20 10 DECDLO CC(C)C[C@H]([NH3+])C[N@H+](CC(=O)[O-])Cc1cc(Cl)ccc1O ZINC001591161461 991914408 /nfs/dbraw/zinc/91/44/08/991914408.db2.gz KDCCAJKWMVOTAL-ZDUSSCGKSA-N 1 2 314.813 2.306 20 10 DECDLO CC(C)C[C@H]([NH3+])C[N@@H+](CC(=O)[O-])Cc1cc(Cl)ccc1O ZINC001591161461 991914413 /nfs/dbraw/zinc/91/44/13/991914413.db2.gz KDCCAJKWMVOTAL-ZDUSSCGKSA-N 1 2 314.813 2.306 20 10 DECDLO CC[C@@H]([NH2+]C[C@H]1CCCOC1)c1cccc(-c2nn[nH]n2)c1O ZINC001604056249 1070189146 /nfs/dbraw/zinc/18/91/46/1070189146.db2.gz RLNSFKDYIUOPDM-BXUZGUMPSA-N 1 2 317.393 2.040 20 10 DECDLO CC[C@H]([NH2+]C[C@@H]1CC[C@@H](C)O1)c1cccc(-c2nn[nH]n2)c1O ZINC001604056494 1070191317 /nfs/dbraw/zinc/19/13/17/1070191317.db2.gz ULWQBYFWZHOBCB-SUNKGSAMSA-N 1 2 317.393 2.181 20 10 DECDLO COC(C)(C)[C@H](C)[NH2+][C@H](C)c1cccc(-c2nn[nH]n2)c1O ZINC001604995480 1070558086 /nfs/dbraw/zinc/55/80/86/1070558086.db2.gz IXYAHMKSIKZDPQ-ZJUUUORDSA-N 1 2 305.382 2.036 20 10 DECDLO COc1cc(N(C)Cc2ccc[nH+]c2N)cc(OC)c1OC ZINC001462074004 1058757602 /nfs/dbraw/zinc/75/76/02/1058757602.db2.gz IZFUDSNEYWDWCV-UHFFFAOYSA-N 1 2 303.362 2.326 20 10 DECDLO CC(C)C[C@H](C(=O)NCc1cccc(O)c1O)n1cc[nH+]c1 ZINC001521852379 1069276809 /nfs/dbraw/zinc/27/68/09/1069276809.db2.gz VDWJDZVWRJRQMP-CYBMUJFWSA-N 1 2 303.362 2.198 20 10 DECDLO CC[C@H](C)N1C[C@@]2(F)C[N@H+](Cc3ccccc3O)C[C@@]2(F)C1=O ZINC001272619829 1079016720 /nfs/dbraw/zinc/01/67/20/1079016720.db2.gz ZVLGFTZXLRHVLL-AFAVFJNCSA-N 1 2 324.371 2.265 20 10 DECDLO CC[C@H](C)N1C[C@@]2(F)C[N@@H+](Cc3ccccc3O)C[C@@]2(F)C1=O ZINC001272619829 1079016727 /nfs/dbraw/zinc/01/67/27/1079016727.db2.gz ZVLGFTZXLRHVLL-AFAVFJNCSA-N 1 2 324.371 2.265 20 10 DECDLO Cc1cc(CNCc2ccc(N3CC[NH+](C)CC3)c(F)c2)on1 ZINC001560320741 1075137230 /nfs/dbraw/zinc/13/72/30/1075137230.db2.gz MNNRTLUDRDSWCA-UHFFFAOYSA-N 1 2 318.396 2.164 20 10 DECDLO CC[C@@H]([NH2+]CC1(COC)CC1)c1cccc(-c2nn[nH]n2)c1O ZINC001590466556 1076633384 /nfs/dbraw/zinc/63/33/84/1076633384.db2.gz YIWSSNDTIOISOW-CYBMUJFWSA-N 1 2 317.393 2.040 20 10 DECDLO CC[C@H]([NH2+]CCc1ccccn1)c1cccc(-c2nn[nH]n2)c1O ZINC001590471105 1076635905 /nfs/dbraw/zinc/63/59/05/1076635905.db2.gz WHVVKWNQKZJXOB-HNNXBMFYSA-N 1 2 324.388 2.251 20 10 DECDLO CO[C@](C)(C[NH2+][C@@H](C)c1cccc(-c2nn[nH]n2)c1O)C1CC1 ZINC001591317589 1076720898 /nfs/dbraw/zinc/72/08/98/1076720898.db2.gz GNVVPXVCXUVMAA-MGPLVRAMSA-N 1 2 317.393 2.038 20 10 DECDLO Cc1nn(C)c(C)c1[C@@H](O)C[NH2+]Cc1cccc(Cl)c1O ZINC001653246510 1079920159 /nfs/dbraw/zinc/92/01/59/1079920159.db2.gz QCCFGJGJXVEJNA-ZDUSSCGKSA-N 1 2 309.797 2.219 20 10 DECDLO NC(=O)c1cc2c([nH]1)C[N@H+](Cc1ccc(N3CCCC3)cc1)CC2 ZINC001277210079 1083848324 /nfs/dbraw/zinc/84/83/24/1083848324.db2.gz OCSVUNJNPGKIMO-UHFFFAOYSA-N 1 2 324.428 2.272 20 10 DECDLO NC(=O)c1cc2c([nH]1)C[N@@H+](Cc1ccc(N3CCCC3)cc1)CC2 ZINC001277210079 1083848331 /nfs/dbraw/zinc/84/83/31/1083848331.db2.gz OCSVUNJNPGKIMO-UHFFFAOYSA-N 1 2 324.428 2.272 20 10 DECDLO CC(C)(C)NC(=O)[C@H]1CC12C[NH+](Cc1c(O)cccc1F)C2 ZINC001277485310 1083999443 /nfs/dbraw/zinc/99/94/43/1083999443.db2.gz ZDOUBCNYZXBFCR-GFCCVEGCSA-N 1 2 306.381 2.268 20 10 DECDLO C[N@H+](Cc1ccc(N2CCOCC2)cc1)Cc1ncc(F)cn1 ZINC001235006318 1084271436 /nfs/dbraw/zinc/27/14/36/1084271436.db2.gz UTVCZKCCAJWBGP-UHFFFAOYSA-N 1 2 316.380 2.084 20 10 DECDLO C[N@@H+](Cc1ccc(N2CCOCC2)cc1)Cc1ncc(F)cn1 ZINC001235006318 1084271445 /nfs/dbraw/zinc/27/14/45/1084271445.db2.gz UTVCZKCCAJWBGP-UHFFFAOYSA-N 1 2 316.380 2.084 20 10 DECDLO C[C@@H]1C[C@@H](O)C[N@@H+]1Cc1cc(F)cc(Br)c1O ZINC001235296254 1084376194 /nfs/dbraw/zinc/37/61/94/1084376194.db2.gz HUFGYWHCVLHVRX-GMSGAONNSA-N 1 2 304.159 2.249 20 10 DECDLO C[C@@H]1C[C@@H](O)C[N@H+]1Cc1cc(F)cc(Br)c1O ZINC001235296254 1084376204 /nfs/dbraw/zinc/37/62/04/1084376204.db2.gz HUFGYWHCVLHVRX-GMSGAONNSA-N 1 2 304.159 2.249 20 10 DECDLO Oc1cccc(F)c1C[NH+]1CCN(c2nccc(Cl)n2)CC1 ZINC001137838686 1086634490 /nfs/dbraw/zinc/63/44/90/1086634490.db2.gz HMHXADZAJUQYKI-UHFFFAOYSA-N 1 2 322.771 2.297 20 10 DECDLO CNC(=O)N[C@H]1CCC[N@H+](Cc2cc(F)cc(Cl)c2O)C1 ZINC001237803997 1138794732 /nfs/dbraw/zinc/79/47/32/1138794732.db2.gz XTWXBQPIWYZRNX-NSHDSACASA-N 1 2 315.776 2.078 20 10 DECDLO CNC(=O)N[C@H]1CCC[N@@H+](Cc2cc(F)cc(Cl)c2O)C1 ZINC001237803997 1138794744 /nfs/dbraw/zinc/79/47/44/1138794744.db2.gz XTWXBQPIWYZRNX-NSHDSACASA-N 1 2 315.776 2.078 20 10 DECDLO Oc1c(Cl)cc(F)cc1C[NH+]1CCC2(C[C@@H](O)CO2)CC1 ZINC001237807453 1138797262 /nfs/dbraw/zinc/79/72/62/1138797262.db2.gz JAMZQTKKAYAJKX-GFCCVEGCSA-N 1 2 315.772 2.301 20 10 DECDLO CN(C)c1ccc(CN(C)C(=O)[C@H]2CCc3[nH+]ccn3C2)cc1 ZINC000372952954 529779938 /nfs/dbraw/zinc/77/99/38/529779938.db2.gz YKPDPMSNWRRMQX-HNNXBMFYSA-N 1 2 312.417 2.170 20 10 DECDLO CN(C)c1ccc(C[N@@H+]2CCOC[C@@H]2[C@@H]2CCCC2=O)cc1F ZINC000375469252 529780484 /nfs/dbraw/zinc/78/04/84/529780484.db2.gz NCKBBQRFJAQBKR-WMLDXEAASA-N 1 2 320.408 2.462 20 10 DECDLO CN(C)c1ccc(C[N@H+]2CCOC[C@@H]2[C@@H]2CCCC2=O)cc1F ZINC000375469252 529780486 /nfs/dbraw/zinc/78/04/86/529780486.db2.gz NCKBBQRFJAQBKR-WMLDXEAASA-N 1 2 320.408 2.462 20 10 DECDLO C[C@H]([NH2+]CC1(N(C)C)CCOCC1)c1ccc(F)c(F)c1O ZINC000187719446 299281555 /nfs/dbraw/zinc/28/15/55/299281555.db2.gz QEGRSYGICYZQPQ-NSHDSACASA-N 1 2 314.376 2.432 20 10 DECDLO COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@@H]2CCn3ccnc32)c1 ZINC000834829923 649852623 /nfs/dbraw/zinc/85/26/23/649852623.db2.gz ABNFCFJAWIGHCV-GXFFZTMASA-N 1 2 301.346 2.171 20 10 DECDLO C[C@@H](CN1CCOCC1)[NH2+][C@@H](C)c1ccc(F)c(F)c1O ZINC000191204597 402650324 /nfs/dbraw/zinc/65/03/24/402650324.db2.gz MXADZURULGTLJZ-QWRGUYRKSA-N 1 2 300.349 2.042 20 10 DECDLO C[N@H+](CCS(=O)(=O)c1ccc(F)cc1)Cc1ccccc1O ZINC000192669546 402743854 /nfs/dbraw/zinc/74/38/54/402743854.db2.gz BSGLNRQSBSMCLG-UHFFFAOYSA-N 1 2 323.389 2.437 20 10 DECDLO C[N@@H+](CCS(=O)(=O)c1ccc(F)cc1)Cc1ccccc1O ZINC000192669546 402743858 /nfs/dbraw/zinc/74/38/58/402743858.db2.gz BSGLNRQSBSMCLG-UHFFFAOYSA-N 1 2 323.389 2.437 20 10 DECDLO COc1cc(Cl)cc(C[N@@H+]2CCOC[C@]23CCOC3)c1O ZINC000195019105 402827318 /nfs/dbraw/zinc/82/73/18/402827318.db2.gz BHJAOEZXJDASCV-OAHLLOKOSA-N 1 2 313.781 2.046 20 10 DECDLO COc1cc(Cl)cc(C[N@H+]2CCOC[C@]23CCOC3)c1O ZINC000195019105 402827320 /nfs/dbraw/zinc/82/73/20/402827320.db2.gz BHJAOEZXJDASCV-OAHLLOKOSA-N 1 2 313.781 2.046 20 10 DECDLO COCc1noc(C[N@H+](Cc2ccc(N(C)C)cc2)C2CC2)n1 ZINC000272047087 402891161 /nfs/dbraw/zinc/89/11/61/402891161.db2.gz GXMJDGIHNOVIPF-UHFFFAOYSA-N 1 2 316.405 2.447 20 10 DECDLO COCc1noc(C[N@@H+](Cc2ccc(N(C)C)cc2)C2CC2)n1 ZINC000272047087 402891164 /nfs/dbraw/zinc/89/11/64/402891164.db2.gz GXMJDGIHNOVIPF-UHFFFAOYSA-N 1 2 316.405 2.447 20 10 DECDLO CCN(CC)c1ccc(C[NH2+]Cc2cc(C(N)=O)no2)cc1F ZINC000273409916 403002245 /nfs/dbraw/zinc/00/22/45/403002245.db2.gz OGEKXKAZWYONNA-UHFFFAOYSA-N 1 2 320.368 2.049 20 10 DECDLO COC(=O)[C@@H]([NH2+]Cc1cc(-c2ccccc2)ccc1O)[C@@H](C)O ZINC000276438451 403175252 /nfs/dbraw/zinc/17/52/52/403175252.db2.gz IKHQAAMABVQIHZ-PXAZEXFGSA-N 1 2 315.369 2.071 20 10 DECDLO CCOC(=O)[C@H](C)[N@H+](Cc1cc2c(cc1O)OCO2)C1CC1 ZINC000276247203 403157404 /nfs/dbraw/zinc/15/74/04/403157404.db2.gz UWAYTGBWNTVMRO-JTQLQIEISA-N 1 2 307.346 2.037 20 10 DECDLO CCOC(=O)[C@H](C)[N@@H+](Cc1cc2c(cc1O)OCO2)C1CC1 ZINC000276247203 403157406 /nfs/dbraw/zinc/15/74/06/403157406.db2.gz UWAYTGBWNTVMRO-JTQLQIEISA-N 1 2 307.346 2.037 20 10 DECDLO COC(=O)[C@@H](Cc1ccccc1)[NH2+]Cc1cc(OC)ccc1O ZINC000276471894 403178594 /nfs/dbraw/zinc/17/85/94/403178594.db2.gz MVDULWRFPTZILR-MRXNPFEDSA-N 1 2 315.369 2.275 20 10 DECDLO CCOCc1cc(C[NH2+][C@@H](C)c2ncnn2C)ccc1OC ZINC000276647197 403192566 /nfs/dbraw/zinc/19/25/66/403192566.db2.gz IBKPJJMPXXHDST-LBPRGKRZSA-N 1 2 304.394 2.211 20 10 DECDLO OC[C@@H]1CC[C@H](C[NH2+]Cc2cc(Cl)cc(Cl)c2O)O1 ZINC000292781930 403377305 /nfs/dbraw/zinc/37/73/05/403377305.db2.gz UENMWMTWCQXODT-MNOVXSKESA-N 1 2 306.189 2.329 20 10 DECDLO O=C(NCc1ccc(N2CCCC2)cc1)[C@@H]1CCc2[nH+]ccn2C1 ZINC000363181455 404105715 /nfs/dbraw/zinc/10/57/15/404105715.db2.gz ZKZJYMNEYORWNM-MRXNPFEDSA-N 1 2 324.428 2.362 20 10 DECDLO C[C@@H]([NH2+]C[C@H]1CCCCN1CCO)c1cc(F)cc(F)c1O ZINC000834849818 649854187 /nfs/dbraw/zinc/85/41/87/649854187.db2.gz GBRIJZSUSPTXQB-DGCLKSJQSA-N 1 2 314.376 2.168 20 10 DECDLO NC(=O)[C@@H]1[C@H]2CCC[C@@H]2C[N@@H+]1Cc1c(O)ccc(Cl)c1F ZINC000364586606 303320482 /nfs/dbraw/zinc/32/04/82/303320482.db2.gz ZJRIHFOEHJTRCV-ITMYJUKJSA-N 1 2 312.772 2.271 20 10 DECDLO NC(=O)[C@@H]1[C@H]2CCC[C@@H]2C[N@H+]1Cc1c(O)ccc(Cl)c1F ZINC000364586606 303320483 /nfs/dbraw/zinc/32/04/83/303320483.db2.gz ZJRIHFOEHJTRCV-ITMYJUKJSA-N 1 2 312.772 2.271 20 10 DECDLO Cn1cc[nH+]c1C[C@@H]1CCCN(C(=O)C2=CC(=O)CS2)C1 ZINC001330167104 1149058251 /nfs/dbraw/zinc/05/82/51/1149058251.db2.gz BONZGUUNUWSTIX-NSHDSACASA-N 1 2 305.403 2.282 20 10 DECDLO OCCCN1CCC[C@H]([NH2+]Cc2cc(Cl)c(F)cc2O)C1 ZINC000294697492 534360717 /nfs/dbraw/zinc/36/07/17/534360717.db2.gz CDASKXNLXKNKOY-LBPRGKRZSA-N 1 2 316.804 2.121 20 10 DECDLO C[C@H](CN1CCOCC1)[NH2+][C@@H](C)c1ccc(F)c(F)c1O ZINC000191204616 524356881 /nfs/dbraw/zinc/35/68/81/524356881.db2.gz MXADZURULGTLJZ-MNOVXSKESA-N 1 2 300.349 2.042 20 10 DECDLO C[C@H](CS(C)(=O)=O)[N@H+](Cc1cccc(Cl)c1O)C1CC1 ZINC000180245483 524602319 /nfs/dbraw/zinc/60/23/19/524602319.db2.gz NXKLNPMLHDYMAJ-SNVBAGLBSA-N 1 2 317.838 2.443 20 10 DECDLO C[C@H](CS(C)(=O)=O)[N@@H+](Cc1cccc(Cl)c1O)C1CC1 ZINC000180245483 524602330 /nfs/dbraw/zinc/60/23/30/524602330.db2.gz NXKLNPMLHDYMAJ-SNVBAGLBSA-N 1 2 317.838 2.443 20 10 DECDLO CCN(CC)c1ccc(C[N@@H+]2CCOC[C@@H]2CC(=O)OC)cc1 ZINC000377833090 528299724 /nfs/dbraw/zinc/29/97/24/528299724.db2.gz DIKCTFVJPOVNLC-KRWDZBQOSA-N 1 2 320.433 2.297 20 10 DECDLO CCN(CC)c1ccc(C[N@H+]2CCOC[C@@H]2CC(=O)OC)cc1 ZINC000377833090 528299729 /nfs/dbraw/zinc/29/97/29/528299729.db2.gz DIKCTFVJPOVNLC-KRWDZBQOSA-N 1 2 320.433 2.297 20 10 DECDLO O=C1[C@H]([NH2+]Cc2cc(Cl)cc(F)c2O)C[C@H]2CCCCN12 ZINC000835072798 649875445 /nfs/dbraw/zinc/87/54/45/649875445.db2.gz JZNOBTVXGZCVHW-DGCLKSJQSA-N 1 2 312.772 2.428 20 10 DECDLO CC[N@H+](CCCO)Cc1cc(Br)cc(F)c1O ZINC000894053771 636100209 /nfs/dbraw/zinc/10/02/09/636100209.db2.gz IWBVIPDCJWBWIZ-UHFFFAOYSA-N 1 2 306.175 2.498 20 10 DECDLO CC[N@@H+](CCCO)Cc1cc(Br)cc(F)c1O ZINC000894053771 636100212 /nfs/dbraw/zinc/10/02/12/636100212.db2.gz IWBVIPDCJWBWIZ-UHFFFAOYSA-N 1 2 306.175 2.498 20 10 DECDLO C[C@@H]1C[N@H+](Cc2cc(Br)cc(F)c2O)CC[C@H]1O ZINC000894498070 637070417 /nfs/dbraw/zinc/07/04/17/637070417.db2.gz SQHZEXZKZPYROO-PRHODGIISA-N 1 2 318.186 2.497 20 10 DECDLO C[C@@H]1C[N@@H+](Cc2cc(Br)cc(F)c2O)CC[C@H]1O ZINC000894498070 637070421 /nfs/dbraw/zinc/07/04/21/637070421.db2.gz SQHZEXZKZPYROO-PRHODGIISA-N 1 2 318.186 2.497 20 10 DECDLO Oc1c(F)cc(F)cc1C[N@H+]1C[C@@H](O)[C@H](Oc2ccccc2)C1 ZINC000895418697 638013597 /nfs/dbraw/zinc/01/35/97/638013597.db2.gz OLPLNZFCVHJBKF-HZPDHXFCSA-N 1 2 321.323 2.295 20 10 DECDLO Cc1cc(O)c(C[N@@H+]2CCC[C@@H](S(C)(=O)=O)C2)c(Cl)c1 ZINC000840938243 650389216 /nfs/dbraw/zinc/38/92/16/650389216.db2.gz AABZUMHGSDSJTG-LLVKDONJSA-N 1 2 317.838 2.363 20 10 DECDLO Cc1cc(O)c(C[N@H+]2CCC[C@@H](S(C)(=O)=O)C2)c(Cl)c1 ZINC000840938243 650389219 /nfs/dbraw/zinc/38/92/19/650389219.db2.gz AABZUMHGSDSJTG-LLVKDONJSA-N 1 2 317.838 2.363 20 10 DECDLO COC(=O)[C@H](CC1CCOCC1)[NH2+]Cc1cccc(C)c1O ZINC000895591622 638105883 /nfs/dbraw/zinc/10/58/83/638105883.db2.gz QMYBJGPXCJIXNO-HNNXBMFYSA-N 1 2 307.390 2.149 20 10 DECDLO Cc1cc(Br)cc(C[N@@H+]2CC[C@H](O)[C@@H](F)C2)c1O ZINC000898188860 641054469 /nfs/dbraw/zinc/05/44/69/641054469.db2.gz VBCNJKUEAVIFMC-RYUDHWBXSA-N 1 2 318.186 2.368 20 10 DECDLO Cc1cc(Br)cc(C[N@H+]2CC[C@H](O)[C@@H](F)C2)c1O ZINC000898188860 641054470 /nfs/dbraw/zinc/05/44/70/641054470.db2.gz VBCNJKUEAVIFMC-RYUDHWBXSA-N 1 2 318.186 2.368 20 10 DECDLO C[C@H]1C[N@H+](Cc2ccc(N3CCOCC3)c(F)c2)[C@@H](C)CO1 ZINC000768537128 641093318 /nfs/dbraw/zinc/09/33/18/641093318.db2.gz NJQFATQLCSGNDR-KBPBESRZSA-N 1 2 308.397 2.272 20 10 DECDLO C[C@H]1C[N@@H+](Cc2ccc(N3CCOCC3)c(F)c2)[C@@H](C)CO1 ZINC000768537128 641093321 /nfs/dbraw/zinc/09/33/21/641093321.db2.gz NJQFATQLCSGNDR-KBPBESRZSA-N 1 2 308.397 2.272 20 10 DECDLO CC[C@H](C(=O)N(C)Cc1ccccc1O)[N@@H+]1CCO[C@H](CC)C1 ZINC000774043034 641855264 /nfs/dbraw/zinc/85/52/64/641855264.db2.gz IMNVPCMSLIPXNH-HZPDHXFCSA-N 1 2 320.433 2.240 20 10 DECDLO CC[C@H](C(=O)N(C)Cc1ccccc1O)[N@H+]1CCO[C@H](CC)C1 ZINC000774043034 641855269 /nfs/dbraw/zinc/85/52/69/641855269.db2.gz IMNVPCMSLIPXNH-HZPDHXFCSA-N 1 2 320.433 2.240 20 10 DECDLO C[C@@H]([NH2+]CC1(N2CCOCC2)CC1)c1cc(F)cc(F)c1O ZINC000774382050 641897533 /nfs/dbraw/zinc/89/75/33/641897533.db2.gz FBDAKISZBPOURE-LLVKDONJSA-N 1 2 312.360 2.186 20 10 DECDLO CN(C)C(=O)C1CC[NH+](Cc2cc(Cl)cc(F)c2O)CC1 ZINC000775647620 642072301 /nfs/dbraw/zinc/07/23/01/642072301.db2.gz ZJIVAHSECAQPAC-UHFFFAOYSA-N 1 2 314.788 2.485 20 10 DECDLO CCC[N@H+](CC(=O)N(C)C)Cc1cc(Cl)cc(F)c1O ZINC000775663563 642075677 /nfs/dbraw/zinc/07/56/77/642075677.db2.gz NLPFLTWQWYBJMJ-UHFFFAOYSA-N 1 2 302.777 2.485 20 10 DECDLO CCC[N@@H+](CC(=O)N(C)C)Cc1cc(Cl)cc(F)c1O ZINC000775663563 642075682 /nfs/dbraw/zinc/07/56/82/642075682.db2.gz NLPFLTWQWYBJMJ-UHFFFAOYSA-N 1 2 302.777 2.485 20 10 DECDLO O=c1cc2c(n[nH]1)CC[N@@H+](Cc1cc(Cl)cc(F)c1O)C2 ZINC000775993622 642120085 /nfs/dbraw/zinc/12/00/85/642120085.db2.gz BIJNWUSDVQYNBG-UHFFFAOYSA-N 1 2 309.728 2.239 20 10 DECDLO O=c1cc2c(n[nH]1)CC[N@H+](Cc1cc(Cl)cc(F)c1O)C2 ZINC000775993622 642120087 /nfs/dbraw/zinc/12/00/87/642120087.db2.gz BIJNWUSDVQYNBG-UHFFFAOYSA-N 1 2 309.728 2.239 20 10 DECDLO C[C@@H](NC(=O)[C@@H]1CCc2[nH+]ccn2C1)c1ccc(N(C)C)cc1 ZINC000787299544 643478571 /nfs/dbraw/zinc/47/85/71/643478571.db2.gz IZMNPVAVHAFVDO-UKRRQHHQSA-N 1 2 312.417 2.389 20 10 DECDLO Cc1cn(C(C)(C)C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)c[nH+]1 ZINC000907272063 644488373 /nfs/dbraw/zinc/48/83/73/644488373.db2.gz DHNQUDGFMRNFQT-NSHDSACASA-N 1 2 317.389 2.085 20 10 DECDLO COC(=O)c1cnoc1C[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000796009425 644672058 /nfs/dbraw/zinc/67/20/58/644672058.db2.gz CQXDPUSWSURJKW-NSHDSACASA-N 1 2 303.362 2.378 20 10 DECDLO CC[C@H]1C(=O)NCC[N@H+]1Cc1cc(OC)cc(C(C)(C)C)c1O ZINC000164304713 646434792 /nfs/dbraw/zinc/43/47/92/646434792.db2.gz BMZINQUDWMXIJX-HNNXBMFYSA-N 1 2 320.433 2.409 20 10 DECDLO CC[C@H]1C(=O)NCC[N@@H+]1Cc1cc(OC)cc(C(C)(C)C)c1O ZINC000164304713 646434795 /nfs/dbraw/zinc/43/47/95/646434795.db2.gz BMZINQUDWMXIJX-HNNXBMFYSA-N 1 2 320.433 2.409 20 10 DECDLO Oc1ccc(CCNc2cc(N3CCCC3)nc[nH+]2)cc1O ZINC000811811241 646580932 /nfs/dbraw/zinc/58/09/32/646580932.db2.gz PXUREIULRMORBD-UHFFFAOYSA-N 1 2 300.362 2.143 20 10 DECDLO Oc1ccc(CCNc2cc(N3CCCC3)[nH+]cn2)cc1O ZINC000811811241 646580935 /nfs/dbraw/zinc/58/09/35/646580935.db2.gz PXUREIULRMORBD-UHFFFAOYSA-N 1 2 300.362 2.143 20 10 DECDLO COc1cccc(C[NH2+]Cc2ncn(-c3ccccc3)n2)c1O ZINC000815162325 646982849 /nfs/dbraw/zinc/98/28/49/646982849.db2.gz JHDMEACYTXVFBW-UHFFFAOYSA-N 1 2 310.357 2.271 20 10 DECDLO CN(C)c1ccc(CN(C)C(=O)[C@@H]2CCc3c[nH+]cn3C2)cc1 ZINC000816822407 647186867 /nfs/dbraw/zinc/18/68/67/647186867.db2.gz JIIIAQDPGJEQAF-OAHLLOKOSA-N 1 2 312.417 2.170 20 10 DECDLO Oc1c(Br)cccc1C[N@@H+]1CC[C@](O)(C(F)F)C1 ZINC000824726611 648643593 /nfs/dbraw/zinc/64/35/93/648643593.db2.gz PQJQXSQYFOOWMV-GFCCVEGCSA-N 1 2 322.149 2.357 20 10 DECDLO COC(=O)[C@]1(F)CC[N@H+](Cc2cc(Cl)c(C)cc2O)C1 ZINC000824913507 648671745 /nfs/dbraw/zinc/67/17/45/648671745.db2.gz UXAIPBFGZLXSQI-AWEZNQCLSA-N 1 2 301.745 2.441 20 10 DECDLO COC(=O)[C@]1(F)CC[N@@H+](Cc2cc(Cl)c(C)cc2O)C1 ZINC000824913507 648671747 /nfs/dbraw/zinc/67/17/47/648671747.db2.gz UXAIPBFGZLXSQI-AWEZNQCLSA-N 1 2 301.745 2.441 20 10 DECDLO COc1ccc(O)c([C@H](C)[NH2+]Cc2nc([C@@H](C)OC)no2)c1 ZINC000182348252 648886554 /nfs/dbraw/zinc/88/65/54/648886554.db2.gz CTOSMNTUOJGHBM-VHSXEESVSA-N 1 2 307.350 2.342 20 10 DECDLO COc1c(O)c(CN[C@@H]2CC[N@@H+](C(C)(C)C)C2)ccc1[N+](=O)[O-] ZINC000826867772 648939369 /nfs/dbraw/zinc/93/93/69/648939369.db2.gz LHRYPMJVJGSSCY-GFCCVEGCSA-N 1 2 323.393 2.271 20 10 DECDLO COc1c(O)c(CN[C@@H]2CC[N@H+](C(C)(C)C)C2)ccc1[N+](=O)[O-] ZINC000826867772 648939371 /nfs/dbraw/zinc/93/93/71/648939371.db2.gz LHRYPMJVJGSSCY-GFCCVEGCSA-N 1 2 323.393 2.271 20 10 DECDLO O=C1CCCN1C[C@@H]1CC[N@@H+](Cc2cccc(Cl)c2O)C1 ZINC000827633873 649060085 /nfs/dbraw/zinc/06/00/85/649060085.db2.gz DKAKYYKMXGKZPZ-GFCCVEGCSA-N 1 2 308.809 2.490 20 10 DECDLO O=C1CCCN1C[C@@H]1CC[N@H+](Cc2cccc(Cl)c2O)C1 ZINC000827633873 649060086 /nfs/dbraw/zinc/06/00/86/649060086.db2.gz DKAKYYKMXGKZPZ-GFCCVEGCSA-N 1 2 308.809 2.490 20 10 DECDLO COc1cc(C[N@@H+]2CCc3nn[nH]c3C2)c(O)c(C(C)(C)C)c1 ZINC000827876727 649098226 /nfs/dbraw/zinc/09/82/26/649098226.db2.gz CCLJIPULQWOZLX-UHFFFAOYSA-N 1 2 316.405 2.375 20 10 DECDLO COc1cc(C[N@H+]2CCc3nn[nH]c3C2)c(O)c(C(C)(C)C)c1 ZINC000827876727 649098229 /nfs/dbraw/zinc/09/82/29/649098229.db2.gz CCLJIPULQWOZLX-UHFFFAOYSA-N 1 2 316.405 2.375 20 10 DECDLO CCN1C[C@@H](C[NH2+]Cc2cc(Cl)cc(F)c2O)CC1=O ZINC000846097841 651307698 /nfs/dbraw/zinc/30/76/98/651307698.db2.gz WRLFLZUQIMUETC-SECBINFHSA-N 1 2 300.761 2.143 20 10 DECDLO O=C(NCc1cc(Cl)ccc1O)[C@H]1CCc2c[nH+]cn2C1 ZINC000846661260 651343722 /nfs/dbraw/zinc/34/37/22/651343722.db2.gz PEUKFCXQAOWGTO-JTQLQIEISA-N 1 2 305.765 2.121 20 10 DECDLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)NCCCSc1nccs1 ZINC000847488292 651398409 /nfs/dbraw/zinc/39/84/09/651398409.db2.gz WFNYWVVWCYLEBL-JTQLQIEISA-N 1 2 310.448 2.343 20 10 DECDLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)NCCCSc1nccs1 ZINC000847488292 651398411 /nfs/dbraw/zinc/39/84/11/651398411.db2.gz WFNYWVVWCYLEBL-JTQLQIEISA-N 1 2 310.448 2.343 20 10 DECDLO CCOC(=O)[C@H]([NH2+]Cc1cccc(CC)c1O)C1CCOCC1 ZINC000848905940 651553631 /nfs/dbraw/zinc/55/36/31/651553631.db2.gz NHVQXVZMBXYQFX-MRXNPFEDSA-N 1 2 321.417 2.403 20 10 DECDLO COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@@H]2C[C@H](C)n3ncnc32)c1 ZINC000850499337 651940700 /nfs/dbraw/zinc/94/07/00/651940700.db2.gz NOTDQDPVBPYPOI-OUJBWJOFSA-N 1 2 316.361 2.127 20 10 DECDLO CC[C@H]([NH2+]Cc1nc(C(N)=O)cs1)c1ccc(F)cc1O ZINC000850539431 651948625 /nfs/dbraw/zinc/94/86/25/651948625.db2.gz CMYLDELBHYONKJ-JTQLQIEISA-N 1 2 309.366 2.328 20 10 DECDLO CC1(O)CCN(c2cc(NCc3ccccc3O)[nH+]cn2)CC1 ZINC000853244347 652528349 /nfs/dbraw/zinc/52/83/49/652528349.db2.gz IUUMFEZCWZZCPV-UHFFFAOYSA-N 1 2 314.389 2.146 20 10 DECDLO CC1(O)CCN(c2cc(NCc3ccccc3O)nc[nH+]2)CC1 ZINC000853244347 652528362 /nfs/dbraw/zinc/52/83/62/652528362.db2.gz IUUMFEZCWZZCPV-UHFFFAOYSA-N 1 2 314.389 2.146 20 10 DECDLO COC(=O)[C@H]1C[N@H+](Cc2ccc(N3CCCCC3)cc2)CCO1 ZINC000093081681 684048206 /nfs/dbraw/zinc/04/82/06/684048206.db2.gz LDBLVTPOHSPVBC-QGZVFWFLSA-N 1 2 318.417 2.051 20 10 DECDLO COC(=O)[C@H]1C[N@@H+](Cc2ccc(N3CCCCC3)cc2)CCO1 ZINC000093081681 684048208 /nfs/dbraw/zinc/04/82/08/684048208.db2.gz LDBLVTPOHSPVBC-QGZVFWFLSA-N 1 2 318.417 2.051 20 10 DECDLO Fc1cc(C[N@@H+]2CCOCC23CCC3)ccc1N1CCOCC1 ZINC000093510125 684050162 /nfs/dbraw/zinc/05/01/62/684050162.db2.gz RUHHNEUEWQXAHB-UHFFFAOYSA-N 1 2 320.408 2.417 20 10 DECDLO Fc1cc(C[N@H+]2CCOCC23CCC3)ccc1N1CCOCC1 ZINC000093510125 684050164 /nfs/dbraw/zinc/05/01/64/684050164.db2.gz RUHHNEUEWQXAHB-UHFFFAOYSA-N 1 2 320.408 2.417 20 10 DECDLO CC1(C)[C@@H](O)C[C@@H]1[NH2+]Cc1cccc(Br)c1O ZINC000128201354 684169341 /nfs/dbraw/zinc/16/93/41/684169341.db2.gz IRTOGYAZYGITKP-QWRGUYRKSA-N 1 2 300.196 2.404 20 10 DECDLO C[C@@H]([NH3+])[C@H]1CN(Cc2cc(Cl)cc(Cl)c2O)CCO1 ZINC000132560906 684210618 /nfs/dbraw/zinc/21/06/18/684210618.db2.gz RIYKDKADOPLCHY-PRHODGIISA-N 1 2 305.205 2.247 20 10 DECDLO COC(=O)[C@H](C[C@H]1CCCOC1)[NH2+]Cc1cccc(C)c1O ZINC000862516352 686313783 /nfs/dbraw/zinc/31/37/83/686313783.db2.gz PLTOOVMCFLOESI-HIFRSBDPSA-N 1 2 307.390 2.149 20 10 DECDLO CCOC(=O)[C@H]([NH2+]Cc1ccc(C)cc1O)C1CCOCC1 ZINC000877470053 690123075 /nfs/dbraw/zinc/12/30/75/690123075.db2.gz XVPLRQGXUWWFEB-MRXNPFEDSA-N 1 2 307.390 2.149 20 10 DECDLO COC(=O)[C@@H](C[C@H]1CCCOC1)[NH2+]Cc1ccc(C)cc1O ZINC000877656282 690181251 /nfs/dbraw/zinc/18/12/51/690181251.db2.gz DAVMGHFWOUEYMV-UKRRQHHQSA-N 1 2 307.390 2.149 20 10 DECDLO COc1ccc(N2CC[NH+](Cc3cncs3)CC2)c(OC)c1 ZINC000877708569 690199220 /nfs/dbraw/zinc/19/92/20/690199220.db2.gz OYTLBRFNGJWKAJ-UHFFFAOYSA-N 1 2 319.430 2.483 20 10 DECDLO OCc1cc[nH+]c(NCc2ccc(N3CCOCC3)c(F)c2)c1 ZINC000881824764 691169347 /nfs/dbraw/zinc/16/93/47/691169347.db2.gz SWZHJQJVNZRXNS-UHFFFAOYSA-N 1 2 317.364 2.162 20 10 DECDLO Cc1c(O)ccc(C[NH+]2CC(NC(=O)OC(C)(C)C)C2)c1O ZINC001140742038 777736389 /nfs/dbraw/zinc/73/63/89/777736389.db2.gz HZFOAISBGSYHNL-UHFFFAOYSA-N 1 2 308.378 2.115 20 10 DECDLO Oc1cc(O)c(CCNc2ccc(N3CCCC3)[nH+]c2)cc1O ZINC001168005474 779270013 /nfs/dbraw/zinc/27/00/13/779270013.db2.gz ICHJILUUYSHFGH-UHFFFAOYSA-N 1 2 315.373 2.453 20 10 DECDLO Cn1cncc1C[NH2+]Cc1cc(Br)cc(F)c1O ZINC000715812465 792524673 /nfs/dbraw/zinc/52/46/73/792524673.db2.gz KOBAWQAXEZFJGC-UHFFFAOYSA-N 1 2 314.158 2.317 20 10 DECDLO O=C(N1CCCC1)C12CC(C1)C[N@H+]2Cc1c(O)cccc1F ZINC001137835347 796144244 /nfs/dbraw/zinc/14/42/44/796144244.db2.gz DYCFCFBRXKHQOU-UHFFFAOYSA-N 1 2 304.365 2.118 20 10 DECDLO O=C(N1CCCC1)C12CC(C1)C[N@@H+]2Cc1c(O)cccc1F ZINC001137835347 796144247 /nfs/dbraw/zinc/14/42/47/796144247.db2.gz DYCFCFBRXKHQOU-UHFFFAOYSA-N 1 2 304.365 2.118 20 10 DECDLO Oc1c(F)cccc1C[NH+]1CCN(c2ccc(Cl)nn2)CC1 ZINC001138129905 796166917 /nfs/dbraw/zinc/16/69/17/796166917.db2.gz YPDFDNWSAJOTHK-UHFFFAOYSA-N 1 2 322.771 2.297 20 10 DECDLO COc1cccc(N2CC[NH+](Cc3cccc(F)c3O)CC2)n1 ZINC001138129746 796168123 /nfs/dbraw/zinc/16/81/23/796168123.db2.gz UUNBLYNIFBYYNO-UHFFFAOYSA-N 1 2 317.364 2.257 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CC[C@](C)(O)[C@H](C)C1 ZINC001139126713 796327147 /nfs/dbraw/zinc/32/71/47/796327147.db2.gz NOILWTLGRKAKDA-XIKOKIGWSA-N 1 2 317.385 2.400 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CC[C@](C)(O)[C@H](C)C1 ZINC001139126713 796327152 /nfs/dbraw/zinc/32/71/52/796327152.db2.gz NOILWTLGRKAKDA-XIKOKIGWSA-N 1 2 317.385 2.400 20 10 DECDLO C[N@H+](Cc1ccc(N2CCC(O)CC2)cc1)Cc1ncccn1 ZINC001140283209 796501732 /nfs/dbraw/zinc/50/17/32/796501732.db2.gz OVOPRFQQHODPPS-UHFFFAOYSA-N 1 2 312.417 2.070 20 10 DECDLO C[N@@H+](Cc1ccc(N2CCC(O)CC2)cc1)Cc1ncccn1 ZINC001140283209 796501737 /nfs/dbraw/zinc/50/17/37/796501737.db2.gz OVOPRFQQHODPPS-UHFFFAOYSA-N 1 2 312.417 2.070 20 10 DECDLO Oc1cc(F)c(F)cc1C[NH+]1CCN(c2ccccn2)CC1 ZINC001142501826 796746554 /nfs/dbraw/zinc/74/65/54/796746554.db2.gz BKJQGZKBROSTQG-UHFFFAOYSA-N 1 2 305.328 2.388 20 10 DECDLO COC[C@H]1C[N@H+](Cc2cc(F)c(F)cc2O)Cc2cn(C)nc21 ZINC001142512996 796746722 /nfs/dbraw/zinc/74/67/22/796746722.db2.gz SDDUUBDZDIUGJU-GFCCVEGCSA-N 1 2 323.343 2.150 20 10 DECDLO COC[C@H]1C[N@@H+](Cc2cc(F)c(F)cc2O)Cc2cn(C)nc21 ZINC001142512996 796746726 /nfs/dbraw/zinc/74/67/26/796746726.db2.gz SDDUUBDZDIUGJU-GFCCVEGCSA-N 1 2 323.343 2.150 20 10 DECDLO CCOC(=O)Cc1cc[nH+]c(NCc2ccc(O)c(O)c2)c1 ZINC001159005851 798504537 /nfs/dbraw/zinc/50/45/37/798504537.db2.gz SMHNIJLGOPHRPA-UHFFFAOYSA-N 1 2 302.330 2.211 20 10 DECDLO Cc1cc(N(C)C)[nH+]cc1N(c1ccc(N)cc1)S(C)(=O)=O ZINC001206743248 800582560 /nfs/dbraw/zinc/58/25/60/800582560.db2.gz JXJGASAJEBDYBJ-UHFFFAOYSA-N 1 2 320.418 2.136 20 10 DECDLO O=C([O-])c1ccc(C[NH+]2CCC(n3cc[nH+]c3)CC2)c(O)c1 ZINC001231455942 801668448 /nfs/dbraw/zinc/66/84/48/801668448.db2.gz YMOCNECNMQHIHO-UHFFFAOYSA-N 1 2 301.346 2.124 20 10 DECDLO Oc1cc2c(cc1O)C[N@H+](Cc1cc(O)c(O)c(O)c1)CCC2 ZINC001233015139 802003752 /nfs/dbraw/zinc/00/37/52/802003752.db2.gz HLMCSNNFDCLITL-UHFFFAOYSA-N 1 2 317.341 2.163 20 10 DECDLO Oc1cc2c(cc1O)C[N@@H+](Cc1cc(O)c(O)c(O)c1)CCC2 ZINC001233015139 802003759 /nfs/dbraw/zinc/00/37/59/802003759.db2.gz HLMCSNNFDCLITL-UHFFFAOYSA-N 1 2 317.341 2.163 20 10 DECDLO Cc1nccnc1O[C@H]1CC[N@@H+](Cc2c(O)ccc(F)c2F)C1 ZINC001233336535 802080251 /nfs/dbraw/zinc/08/02/51/802080251.db2.gz OZSFKQUDVKEVCV-NSHDSACASA-N 1 2 321.327 2.422 20 10 DECDLO CCOC(=O)[C@@H]1C[N@H+](Cc2c(O)ccc(F)c2F)CCS1 ZINC001233335900 802080905 /nfs/dbraw/zinc/08/09/05/802080905.db2.gz QFVMERIIPWRYAU-LBPRGKRZSA-N 1 2 317.357 2.151 20 10 DECDLO CCOC(=O)[C@@H]1C[N@@H+](Cc2c(O)ccc(F)c2F)CCS1 ZINC001233335900 802080911 /nfs/dbraw/zinc/08/09/11/802080911.db2.gz QFVMERIIPWRYAU-LBPRGKRZSA-N 1 2 317.357 2.151 20 10 DECDLO COC(=O)[C@H](C)[N@H+](C)Cc1cccc(OC(F)(F)F)c1O ZINC001233761594 802200979 /nfs/dbraw/zinc/20/09/79/802200979.db2.gz VXFJMJWUBWPILL-QMMMGPOBSA-N 1 2 307.268 2.284 20 10 DECDLO COC(=O)[C@H](C)[N@@H+](C)Cc1cccc(OC(F)(F)F)c1O ZINC001233761594 802200988 /nfs/dbraw/zinc/20/09/88/802200988.db2.gz VXFJMJWUBWPILL-QMMMGPOBSA-N 1 2 307.268 2.284 20 10 DECDLO C[C@H](C[C@@H]1CCOC1)[NH2+][C@@H](C)c1cccc(-c2nn[nH]n2)c1O ZINC001603465041 1069974411 /nfs/dbraw/zinc/97/44/11/1069974411.db2.gz CWKYVHHFTORWGR-WOPDTQHZSA-N 1 2 317.393 2.038 20 10 DECDLO O=C(C[NH2+]Cc1ccc(F)c(F)c1O)N1CCc2ccccc21 ZINC001474690031 1060917540 /nfs/dbraw/zinc/91/75/40/1060917540.db2.gz KTVFFPCHTQHUTD-UHFFFAOYSA-N 1 2 318.323 2.349 20 10 DECDLO CC(C)(C)[C@H](Cn1cc[nH+]c1)NC(=O)Cc1ccc(O)c(O)c1 ZINC001625595076 1078248331 /nfs/dbraw/zinc/24/83/31/1078248331.db2.gz CPDNZHIJDUMMMI-HNNXBMFYSA-N 1 2 317.389 2.068 20 10 DECDLO CC(C)C[C@@H](C(=O)NCc1c(O)cccc1O)n1cc[nH+]c1 ZINC001558536067 1075097910 /nfs/dbraw/zinc/09/79/10/1075097910.db2.gz RVUPLXHOZPILRG-ZDUSSCGKSA-N 1 2 303.362 2.198 20 10 DECDLO CC[C@@H]([NH2+]C[C@@H]1CCC=CO1)c1cccc(-c2nn[nH]n2)c1O ZINC001590466721 1076634471 /nfs/dbraw/zinc/63/44/71/1076634471.db2.gz MDUCYDDXIMWTJC-SMDDNHRTSA-N 1 2 315.377 2.306 20 10 DECDLO Oc1cccc(F)c1C[NH2+]Cc1ccc(-c2nn[nH]n2)cc1F ZINC001593539726 1077019919 /nfs/dbraw/zinc/01/99/19/1077019919.db2.gz FKDFKHBBDFETHB-UHFFFAOYSA-N 1 2 317.299 2.140 20 10 DECDLO O=C(c1cccc(O)c1O)N1CC[NH2+][C@@H](c2ccc(F)cc2)C1 ZINC001594592174 1077054519 /nfs/dbraw/zinc/05/45/19/1077054519.db2.gz GDIBLKMIVYAOCQ-CQSZACIVSA-N 1 2 316.332 2.024 20 10 DECDLO CC[N@H+](Cc1cc(F)c(F)cc1O)[C@@H](C)CS(=O)(=O)CC ZINC001657473362 1080175944 /nfs/dbraw/zinc/17/59/44/1080175944.db2.gz DVYODGAKFMRUEF-JTQLQIEISA-N 1 2 321.389 2.316 20 10 DECDLO CC[N@@H+](Cc1cc(F)c(F)cc1O)[C@@H](C)CS(=O)(=O)CC ZINC001657473362 1080175947 /nfs/dbraw/zinc/17/59/47/1080175947.db2.gz DVYODGAKFMRUEF-JTQLQIEISA-N 1 2 321.389 2.316 20 10 DECDLO CS(=O)(=O)[C@H]1CCCC[N@H+](Cc2cc(F)c(F)cc2O)C1 ZINC001664491816 1080916045 /nfs/dbraw/zinc/91/60/45/1080916045.db2.gz DANRGLWCYNYAHJ-NSHDSACASA-N 1 2 319.373 2.070 20 10 DECDLO CS(=O)(=O)[C@H]1CCCC[N@@H+](Cc2cc(F)c(F)cc2O)C1 ZINC001664491816 1080916048 /nfs/dbraw/zinc/91/60/48/1080916048.db2.gz DANRGLWCYNYAHJ-NSHDSACASA-N 1 2 319.373 2.070 20 10 DECDLO C[N@H+]1C[C@H]2CN(Cc3cc(C(C)(C)C)ccc3O)C[C@@H](C1)O2 ZINC001276445108 1083438412 /nfs/dbraw/zinc/43/84/12/1083438412.db2.gz KTGFMPPJABPWAR-IYBDPMFKSA-N 1 2 304.434 2.205 20 10 DECDLO C[N@@H+]1C[C@H]2CN(Cc3cc(C(C)(C)C)ccc3O)C[C@@H](C1)O2 ZINC001276445108 1083438416 /nfs/dbraw/zinc/43/84/16/1083438416.db2.gz KTGFMPPJABPWAR-IYBDPMFKSA-N 1 2 304.434 2.205 20 10 DECDLO NC(=O)c1ccc2c(n1)CC[N@@H+](Cc1cc(Cl)ccc1O)C2 ZINC001277457952 1083981918 /nfs/dbraw/zinc/98/19/18/1083981918.db2.gz MYZSNJABMWTTDH-UHFFFAOYSA-N 1 2 317.776 2.098 20 10 DECDLO NC(=O)c1ccc2c(n1)CC[N@H+](Cc1cc(Cl)ccc1O)C2 ZINC001277457952 1083981922 /nfs/dbraw/zinc/98/19/22/1083981922.db2.gz MYZSNJABMWTTDH-UHFFFAOYSA-N 1 2 317.776 2.098 20 10 DECDLO COC(=O)C[C@H]1C[N@H+](Cc2ccc(C(C)(C)C)cc2O)CCO1 ZINC001235681502 1084496904 /nfs/dbraw/zinc/49/69/04/1084496904.db2.gz AJYXUGSVHJOXHR-HNNXBMFYSA-N 1 2 321.417 2.454 20 10 DECDLO COC(=O)C[C@H]1C[N@@H+](Cc2ccc(C(C)(C)C)cc2O)CCO1 ZINC001235681502 1084496906 /nfs/dbraw/zinc/49/69/06/1084496906.db2.gz AJYXUGSVHJOXHR-HNNXBMFYSA-N 1 2 321.417 2.454 20 10 DECDLO CN1CC[C@@]2(CC[N@H+](Cc3cc(F)cc(Cl)c3O)C2)C1=O ZINC001274441964 1091244533 /nfs/dbraw/zinc/24/45/33/1091244533.db2.gz KEKDIZHGQOHOET-HNNXBMFYSA-N 1 2 312.772 2.239 20 10 DECDLO CN1CC[C@@]2(CC[N@@H+](Cc3cc(F)cc(Cl)c3O)C2)C1=O ZINC001274441964 1091244541 /nfs/dbraw/zinc/24/45/41/1091244541.db2.gz KEKDIZHGQOHOET-HNNXBMFYSA-N 1 2 312.772 2.239 20 10 DECDLO Cc1cc(F)cc(C[NH+]2CC(N3CCC(F)(F)C3)C2)c1O ZINC001238066033 1138819766 /nfs/dbraw/zinc/81/97/66/1138819766.db2.gz DLDYHDFDTVGNLR-UHFFFAOYSA-N 1 2 300.324 2.365 20 10 DECDLO CN(C)c1ccc(CNC(=O)N(C)Cc2ccccc2O)c[nH+]1 ZINC000046286628 354279406 /nfs/dbraw/zinc/27/94/06/354279406.db2.gz BLRNTOBIRPAUGO-UHFFFAOYSA-N 1 2 314.389 2.195 20 10 DECDLO C[C@H]([NH2+]CC1(S(C)(=O)=O)CCC1)c1ccc(F)c(F)c1O ZINC000281212387 299284717 /nfs/dbraw/zinc/28/47/17/299284717.db2.gz SSBFDGYPRWQISD-VIFPVBQESA-N 1 2 319.373 2.288 20 10 DECDLO CCOC[C@@H]1C[N@H+](Cc2cc(Cl)cc(OC)c2O)CCO1 ZINC000529666020 284234956 /nfs/dbraw/zinc/23/49/56/284234956.db2.gz IVZFJXOKTWPFHB-ZDUSSCGKSA-N 1 2 315.797 2.292 20 10 DECDLO CCOC[C@@H]1C[N@@H+](Cc2cc(Cl)cc(OC)c2O)CCO1 ZINC000529666020 284234957 /nfs/dbraw/zinc/23/49/57/284234957.db2.gz IVZFJXOKTWPFHB-ZDUSSCGKSA-N 1 2 315.797 2.292 20 10 DECDLO C[C@H](CO[C@H]1CCOC1)[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1O ZINC000273612513 130145113 /nfs/dbraw/zinc/14/51/13/130145113.db2.gz WNOMRYQSVSTJCQ-MDZLAQPJSA-N 1 2 310.350 2.145 20 10 DECDLO COc1ccc(N2CC[NH+]([C@H](C)c3nnc(C)o3)CC2)cc1F ZINC000084866116 401910983 /nfs/dbraw/zinc/91/09/83/401910983.db2.gz CRXUVGJLOIMNKK-LLVKDONJSA-N 1 2 320.368 2.409 20 10 DECDLO C[C@@H]([NH2+]Cc1ncn(C)n1)c1cc(Br)ccc1O ZINC000186213855 402411430 /nfs/dbraw/zinc/41/14/30/402411430.db2.gz IXEXDVHTMTYNEH-MRVPVSSYSA-N 1 2 311.183 2.134 20 10 DECDLO CCS(=O)(=O)C1CC[NH+](Cc2cccc(Cl)c2O)CC1 ZINC000195163907 402834637 /nfs/dbraw/zinc/83/46/37/402834637.db2.gz RZGHQDLSPDTOGH-UHFFFAOYSA-N 1 2 317.838 2.445 20 10 DECDLO CCOC(=O)[C@@H]1CCCC[N@@H+]1Cc1cc(OC)c(OC)cc1O ZINC000271854242 402884891 /nfs/dbraw/zinc/88/48/91/402884891.db2.gz WYRNEUMVIIZNAG-ZDUSSCGKSA-N 1 2 323.389 2.327 20 10 DECDLO CCOC(=O)[C@@H]1CCCC[N@H+]1Cc1cc(OC)c(OC)cc1O ZINC000271854242 402884893 /nfs/dbraw/zinc/88/48/93/402884893.db2.gz WYRNEUMVIIZNAG-ZDUSSCGKSA-N 1 2 323.389 2.327 20 10 DECDLO COc1c(O)c(CN[C@@H]2CC[N@@H+]3CCCC[C@H]23)ccc1[N+](=O)[O-] ZINC000278947639 402889561 /nfs/dbraw/zinc/88/95/61/402889561.db2.gz YZLBMJUNQBVQPO-CHWSQXEVSA-N 1 2 321.377 2.025 20 10 DECDLO COc1c(O)c(CN[C@@H]2CC[N@H+]3CCCC[C@H]23)ccc1[N+](=O)[O-] ZINC000278947639 402889562 /nfs/dbraw/zinc/88/95/62/402889562.db2.gz YZLBMJUNQBVQPO-CHWSQXEVSA-N 1 2 321.377 2.025 20 10 DECDLO COc1c(O)c(C[NH2+][C@@H]2CCN3CCCC[C@H]23)ccc1[N+](=O)[O-] ZINC000278947639 402889563 /nfs/dbraw/zinc/88/95/63/402889563.db2.gz YZLBMJUNQBVQPO-CHWSQXEVSA-N 1 2 321.377 2.025 20 10 DECDLO CCN(CC)C(=O)N1CC[NH+](Cc2cc(F)ccc2O)CC1 ZINC000272340927 402926047 /nfs/dbraw/zinc/92/60/47/402926047.db2.gz YQYYTMNDLHETLP-UHFFFAOYSA-N 1 2 309.385 2.111 20 10 DECDLO CS(=O)(=O)[C@@H]1CCC[N@H+](Cc2cc(Cl)c(F)cc2O)C1 ZINC000293628655 403523036 /nfs/dbraw/zinc/52/30/36/403523036.db2.gz MZDYZRDQOLQYFH-SNVBAGLBSA-N 1 2 321.801 2.194 20 10 DECDLO CS(=O)(=O)[C@@H]1CCC[N@@H+](Cc2cc(Cl)c(F)cc2O)C1 ZINC000293628655 403523039 /nfs/dbraw/zinc/52/30/39/403523039.db2.gz MZDYZRDQOLQYFH-SNVBAGLBSA-N 1 2 321.801 2.194 20 10 DECDLO C[C@H]([C@H](C)[NH2+]Cc1cc(Cl)c(F)cc1O)N1CCOCC1 ZINC000293736525 403551426 /nfs/dbraw/zinc/55/14/26/403551426.db2.gz WVXMEWNPUGTGFS-WDEREUQCSA-N 1 2 316.804 2.384 20 10 DECDLO CCc1nocc1C[N@H+](C)Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000293538619 403498630 /nfs/dbraw/zinc/49/86/30/403498630.db2.gz COHFXFRTZWXDRI-UHFFFAOYSA-N 1 2 321.333 2.491 20 10 DECDLO CCc1nocc1C[N@@H+](C)Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000293538619 403498631 /nfs/dbraw/zinc/49/86/31/403498631.db2.gz COHFXFRTZWXDRI-UHFFFAOYSA-N 1 2 321.333 2.491 20 10 DECDLO Cn1ccnc1[C@H]1[N@H+](Cc2cc3c(cc2O)OCO3)CC1(C)C ZINC000294736321 403725731 /nfs/dbraw/zinc/72/57/31/403725731.db2.gz GSIYBLKHKULAOY-OAHLLOKOSA-N 1 2 315.373 2.438 20 10 DECDLO Cn1ccnc1[C@H]1[N@@H+](Cc2cc3c(cc2O)OCO3)CC1(C)C ZINC000294736321 403725734 /nfs/dbraw/zinc/72/57/34/403725734.db2.gz GSIYBLKHKULAOY-OAHLLOKOSA-N 1 2 315.373 2.438 20 10 DECDLO Cn1cc[nH+]c1[C@H]1N(Cc2cc3c(cc2O)OCO3)CC1(C)C ZINC000294736321 403725736 /nfs/dbraw/zinc/72/57/36/403725736.db2.gz GSIYBLKHKULAOY-OAHLLOKOSA-N 1 2 315.373 2.438 20 10 DECDLO CCS(=O)(=O)CC[N@H+](C)Cc1cc(Cl)c(F)cc1O ZINC000295308504 403847739 /nfs/dbraw/zinc/84/77/39/403847739.db2.gz KIIIRDXKWBXPAV-UHFFFAOYSA-N 1 2 309.790 2.051 20 10 DECDLO CCS(=O)(=O)CC[N@@H+](C)Cc1cc(Cl)c(F)cc1O ZINC000295308504 403847745 /nfs/dbraw/zinc/84/77/45/403847745.db2.gz KIIIRDXKWBXPAV-UHFFFAOYSA-N 1 2 309.790 2.051 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@H+]2CC[C@H](OC(=O)N(C)C)C2)c1O ZINC000296682203 404314309 /nfs/dbraw/zinc/31/43/09/404314309.db2.gz LMNTVMWCFOMIQT-ZDUSSCGKSA-N 1 2 324.352 2.006 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@@H+]2CC[C@H](OC(=O)N(C)C)C2)c1O ZINC000296682203 404314311 /nfs/dbraw/zinc/31/43/11/404314311.db2.gz LMNTVMWCFOMIQT-ZDUSSCGKSA-N 1 2 324.352 2.006 20 10 DECDLO CCS(=O)(=O)C[C@H](C)[NH2+][C@@H](C)c1ccc(F)c(F)c1O ZINC000187782083 286642094 /nfs/dbraw/zinc/64/20/94/286642094.db2.gz WLXVOIRDLUZSCT-IUCAKERBSA-N 1 2 307.362 2.144 20 10 DECDLO CCC(CC)[C@@H](C(=O)Nc1ccc(N)cc1)[NH+]1CCOCC1 ZINC000160406352 521601459 /nfs/dbraw/zinc/60/14/59/521601459.db2.gz BNCPSDPWBGRFLC-INIZCTEOSA-N 1 2 305.422 2.344 20 10 DECDLO C[C@H]([NH2+]CCNC(=O)c1ccco1)c1ccc(F)c(F)c1O ZINC000191191005 525355330 /nfs/dbraw/zinc/35/53/30/525355330.db2.gz HNMKWVHJJHZHAF-VIFPVBQESA-N 1 2 310.300 2.344 20 10 DECDLO Oc1ccccc1C[N@@H+](Cc1csnn1)C[C@@H]1CCCO1 ZINC000160198957 526372829 /nfs/dbraw/zinc/37/28/29/526372829.db2.gz CWNXGIAOZRURMW-AWEZNQCLSA-N 1 2 305.403 2.425 20 10 DECDLO Oc1ccccc1C[N@H+](Cc1csnn1)C[C@@H]1CCCO1 ZINC000160198957 526372834 /nfs/dbraw/zinc/37/28/34/526372834.db2.gz CWNXGIAOZRURMW-AWEZNQCLSA-N 1 2 305.403 2.425 20 10 DECDLO Cc1nc(NCc2ccc(N3CCC(O)CC3)c(F)c2)cc[nH+]1 ZINC000266095101 527350824 /nfs/dbraw/zinc/35/08/24/527350824.db2.gz FXINECVLYBTMJA-UHFFFAOYSA-N 1 2 316.380 2.497 20 10 DECDLO Cc1[nH+]cc2n1CC[C@H](C(=O)NCc1cccc(Cl)c1O)C2 ZINC000890759100 623197436 /nfs/dbraw/zinc/19/74/36/623197436.db2.gz CCQZGZWGDUUPOT-NSHDSACASA-N 1 2 319.792 2.429 20 10 DECDLO Nc1ccc(CC(=O)N2CC[NH+](Cc3ccsc3)CC2)cc1 ZINC000314172504 625761048 /nfs/dbraw/zinc/76/10/48/625761048.db2.gz VLCITAHUXBYRQY-UHFFFAOYSA-N 1 2 315.442 2.217 20 10 DECDLO COC(=O)c1c(C[NH2+]Cc2ncc[nH]2)c2cc(F)ccc2n1C ZINC000895419137 638013537 /nfs/dbraw/zinc/01/35/37/638013537.db2.gz RVZHXLRPKILKQX-UHFFFAOYSA-N 1 2 316.336 2.117 20 10 DECDLO COc1ccc(N2CC[NH+](Cc3ocnc3C)CC2)c(OC)c1 ZINC000895453667 638026975 /nfs/dbraw/zinc/02/69/75/638026975.db2.gz DQMXDNXZWPRSJX-UHFFFAOYSA-N 1 2 317.389 2.322 20 10 DECDLO Cc1cc(O)c(C[NH+]2CC(n3cc([C@@H](C)O)nn3)C2)c(Cl)c1 ZINC000840935854 650388899 /nfs/dbraw/zinc/38/88/99/650388899.db2.gz ASVYEYQRXMNJOO-SNVBAGLBSA-N 1 2 322.796 2.056 20 10 DECDLO COc1c(O)c(C[N@@H+]2CCO[C@@H](C3CCC3)C2)ccc1[N+](=O)[O-] ZINC000840955787 650394266 /nfs/dbraw/zinc/39/42/66/650394266.db2.gz ZINNBGPQZIHMFX-CQSZACIVSA-N 1 2 322.361 2.310 20 10 DECDLO COc1c(O)c(C[N@H+]2CCO[C@@H](C3CCC3)C2)ccc1[N+](=O)[O-] ZINC000840955787 650394268 /nfs/dbraw/zinc/39/42/68/650394268.db2.gz ZINNBGPQZIHMFX-CQSZACIVSA-N 1 2 322.361 2.310 20 10 DECDLO CC[C@H](CO)Nc1cc(NCc2c(O)cccc2F)[nH+]cn1 ZINC000895832908 638224139 /nfs/dbraw/zinc/22/41/39/638224139.db2.gz QCYHDDMBIULVRJ-SNVBAGLBSA-N 1 2 306.341 2.116 20 10 DECDLO CC[C@H](CO)Nc1cc(NCc2c(O)cccc2F)nc[nH+]1 ZINC000895832908 638224144 /nfs/dbraw/zinc/22/41/44/638224144.db2.gz QCYHDDMBIULVRJ-SNVBAGLBSA-N 1 2 306.341 2.116 20 10 DECDLO CN(CCO)c1ccc(NCc2c(O)cccc2Cl)[nH+]c1 ZINC000746475112 638346839 /nfs/dbraw/zinc/34/68/39/638346839.db2.gz JVMBIWMCJFRBCK-UHFFFAOYSA-N 1 2 307.781 2.481 20 10 DECDLO Oc1c(F)cc(Cl)cc1C[NH2+]CCOC1CCOCC1 ZINC000897197336 639235494 /nfs/dbraw/zinc/23/54/94/639235494.db2.gz YPJLBEVXJCLZSZ-UHFFFAOYSA-N 1 2 303.761 2.470 20 10 DECDLO CCn1cnc2c1CC[N@H+](Cc1cc(C)cc(OC)c1O)C2 ZINC000897333769 639496829 /nfs/dbraw/zinc/49/68/29/639496829.db2.gz NZESWSVYIGCOQQ-UHFFFAOYSA-N 1 2 301.390 2.484 20 10 DECDLO CCn1cnc2c1CC[N@@H+](Cc1cc(C)cc(OC)c1O)C2 ZINC000897333769 639496833 /nfs/dbraw/zinc/49/68/33/639496833.db2.gz NZESWSVYIGCOQQ-UHFFFAOYSA-N 1 2 301.390 2.484 20 10 DECDLO CCn1c[nH+]c2c1CCN(Cc1ccc(OC)c(OC)c1O)C2 ZINC000897333884 639497485 /nfs/dbraw/zinc/49/74/85/639497485.db2.gz VJUYYICYPMNRTR-UHFFFAOYSA-N 1 2 317.389 2.184 20 10 DECDLO C[C@H]([NH2+]Cc1nnnn1-c1ccccc1)c1ccc(F)cc1O ZINC000756492016 639665683 /nfs/dbraw/zinc/66/56/83/639665683.db2.gz YQYDZENVCOPXSQ-NSHDSACASA-N 1 2 313.336 2.358 20 10 DECDLO C[C@H]([NH2+]C[C@@H](O)C1CCOCC1)c1cc(F)cc(F)c1O ZINC000756739095 639690933 /nfs/dbraw/zinc/69/09/33/639690933.db2.gz RRBXMIIYNIQDFZ-LKFCYVNXSA-N 1 2 301.333 2.109 20 10 DECDLO C[C@@H]1C[N@H+](CCO)[C@@H](C)CN1Cc1c(O)ccc(Cl)c1F ZINC000841891207 650594575 /nfs/dbraw/zinc/59/45/75/650594575.db2.gz KIAJBGOJFSYESD-WDEREUQCSA-N 1 2 316.804 2.072 20 10 DECDLO C[C@@H]1C[N@@H+](CCO)[C@@H](C)CN1Cc1c(O)ccc(Cl)c1F ZINC000841891207 650594578 /nfs/dbraw/zinc/59/45/78/650594578.db2.gz KIAJBGOJFSYESD-WDEREUQCSA-N 1 2 316.804 2.072 20 10 DECDLO Cn1nccc1[C@@H]1C[N@H+](Cc2cc(Cl)ccc2O)CCO1 ZINC000897559501 640800207 /nfs/dbraw/zinc/80/02/07/640800207.db2.gz XRBKJJDUROVXGR-HNNXBMFYSA-N 1 2 307.781 2.353 20 10 DECDLO Cn1nccc1[C@@H]1C[N@@H+](Cc2cc(Cl)ccc2O)CCO1 ZINC000897559501 640800212 /nfs/dbraw/zinc/80/02/12/640800212.db2.gz XRBKJJDUROVXGR-HNNXBMFYSA-N 1 2 307.781 2.353 20 10 DECDLO O=C1C[N@H+](Cc2ccccc2O)CCN1c1cccc(F)c1 ZINC000765686985 640808387 /nfs/dbraw/zinc/80/83/87/640808387.db2.gz OOQWNTWLSUDHIV-UHFFFAOYSA-N 1 2 300.333 2.380 20 10 DECDLO O=C1C[N@@H+](Cc2ccccc2O)CCN1c1cccc(F)c1 ZINC000765686985 640808393 /nfs/dbraw/zinc/80/83/93/640808393.db2.gz OOQWNTWLSUDHIV-UHFFFAOYSA-N 1 2 300.333 2.380 20 10 DECDLO CN(C)C(=O)N1CCC([NH2+]Cc2cccc(Cl)c2O)CC1 ZINC000898218572 641051252 /nfs/dbraw/zinc/05/12/52/641051252.db2.gz KHUXPXKUYSBNNY-UHFFFAOYSA-N 1 2 311.813 2.281 20 10 DECDLO Cc1cc(N(C)C)ccc1CNc1nc(N(C)C)nc(C)[nH+]1 ZINC000768522228 641092704 /nfs/dbraw/zinc/09/27/04/641092704.db2.gz MMTPEWDBVDSNFZ-UHFFFAOYSA-N 1 2 300.410 2.233 20 10 DECDLO Cc1nnc(C[NH2+]C[C@@H](c2ccc(N(C)C)cc2)N(C)C)s1 ZINC000898448450 641660693 /nfs/dbraw/zinc/66/06/93/641660693.db2.gz SRAVPZAMVSHDQA-HNNXBMFYSA-N 1 2 319.478 2.305 20 10 DECDLO C=Cn1cc(CNC[C@@H](c2ccc(N(C)C)cc2)[NH+](C)C)cn1 ZINC000898451494 641663398 /nfs/dbraw/zinc/66/33/98/641663398.db2.gz ZBGSZNJBKSJEBC-SFHVURJKSA-N 1 2 313.449 2.442 20 10 DECDLO CC[C@H]1C(=O)NCCC[N@H+]1Cc1cc(Cl)c(F)cc1O ZINC000898558474 641704663 /nfs/dbraw/zinc/70/46/63/641704663.db2.gz QJGKSRBWLGJNCC-LBPRGKRZSA-N 1 2 300.761 2.285 20 10 DECDLO CC[C@H]1C(=O)NCCC[N@@H+]1Cc1cc(Cl)c(F)cc1O ZINC000898558474 641704665 /nfs/dbraw/zinc/70/46/65/641704665.db2.gz QJGKSRBWLGJNCC-LBPRGKRZSA-N 1 2 300.761 2.285 20 10 DECDLO CC[C@@]1(C)COCC[N@@H+]1Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000775075928 642004019 /nfs/dbraw/zinc/00/40/19/642004019.db2.gz RFAAEKSQQGZOCW-HNNXBMFYSA-N 1 2 310.350 2.310 20 10 DECDLO CC[C@@]1(C)COCC[N@H+]1Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000775075928 642004022 /nfs/dbraw/zinc/00/40/22/642004022.db2.gz RFAAEKSQQGZOCW-HNNXBMFYSA-N 1 2 310.350 2.310 20 10 DECDLO C[C@@H](NC(=O)[C@H]1CCn2c[nH+]cc2C1)c1ccc(N(C)C)cc1 ZINC000775402419 642039022 /nfs/dbraw/zinc/03/90/22/642039022.db2.gz ARMGPCAXBISNTD-HIFRSBDPSA-N 1 2 312.417 2.389 20 10 DECDLO CC(C)(CCS(C)(=O)=O)[NH2+]Cc1cc(Cl)cc(F)c1O ZINC000776224810 642146126 /nfs/dbraw/zinc/14/61/26/642146126.db2.gz WBIRXAJHZNYYAI-UHFFFAOYSA-N 1 2 323.817 2.488 20 10 DECDLO O=S1(=O)CCC(CC[NH2+]Cc2cccc(Cl)c2O)CC1 ZINC000776252156 642149244 /nfs/dbraw/zinc/14/92/44/642149244.db2.gz ONADBDHIKVNTJR-UHFFFAOYSA-N 1 2 317.838 2.350 20 10 DECDLO COc1ccc(O)c([C@H](C)NC(=O)[C@@H]2CCc3[nH+]ccn3C2)c1 ZINC000787131909 643457190 /nfs/dbraw/zinc/45/71/90/643457190.db2.gz UHFZVMKKLSTCHH-NWDGAFQWSA-N 1 2 315.373 2.037 20 10 DECDLO COCC[N@H+](Cc1c(O)ccc(Cl)c1F)[C@H]1CCOC1 ZINC000787333868 643484360 /nfs/dbraw/zinc/48/43/60/643484360.db2.gz DLWDTHQVNXYOJK-JTQLQIEISA-N 1 2 303.761 2.422 20 10 DECDLO COCC[N@@H+](Cc1c(O)ccc(Cl)c1F)[C@H]1CCOC1 ZINC000787333868 643484364 /nfs/dbraw/zinc/48/43/64/643484364.db2.gz DLWDTHQVNXYOJK-JTQLQIEISA-N 1 2 303.761 2.422 20 10 DECDLO Cc1cc(Br)cc(C[N@@H+]2CC[C@@](F)(CO)C2)c1O ZINC000802660097 645541427 /nfs/dbraw/zinc/54/14/27/645541427.db2.gz BECCJBYAPKBDJU-ZDUSSCGKSA-N 1 2 318.186 2.369 20 10 DECDLO Cc1cc(Br)cc(C[N@H+]2CC[C@@](F)(CO)C2)c1O ZINC000802660097 645541431 /nfs/dbraw/zinc/54/14/31/645541431.db2.gz BECCJBYAPKBDJU-ZDUSSCGKSA-N 1 2 318.186 2.369 20 10 DECDLO C[C@@H](CS(C)(=O)=O)[N@H+](C)Cc1cc(Cl)c(F)cc1O ZINC000816510723 647144503 /nfs/dbraw/zinc/14/45/03/647144503.db2.gz DWCKENQTHBWYGY-QMMMGPOBSA-N 1 2 309.790 2.050 20 10 DECDLO C[C@@H](CS(C)(=O)=O)[N@@H+](C)Cc1cc(Cl)c(F)cc1O ZINC000816510723 647144504 /nfs/dbraw/zinc/14/45/04/647144504.db2.gz DWCKENQTHBWYGY-QMMMGPOBSA-N 1 2 309.790 2.050 20 10 DECDLO C[C@H]([NH2+]Cc1cc(Cl)c(F)cc1O)c1nnnn1C1CC1 ZINC000816591550 647156512 /nfs/dbraw/zinc/15/65/12/647156512.db2.gz HXZRRTCVOBUDDA-ZETCQYMHSA-N 1 2 311.748 2.357 20 10 DECDLO COC(=O)c1ccc([O-])c([C@@H](C)[NH2+][C@@H](C[NH3+])C2CCCC2)c1 ZINC000817983097 647399872 /nfs/dbraw/zinc/39/98/72/647399872.db2.gz YAVCWYLYSYCOMX-ABAIWWIYSA-N 1 2 306.406 2.347 20 10 DECDLO Cn1c[nH+]cc1[C@@H]1C[C@H]1C(=O)NCc1ccc2c(c1)CCCN2C ZINC000824682294 648635430 /nfs/dbraw/zinc/63/54/30/648635430.db2.gz CQTPEEGHFQAGHQ-HZPDHXFCSA-N 1 2 324.428 2.222 20 10 DECDLO Cc1cc(C(=O)C[N@H+](C)CCO)c(C)n1-c1ccc(Cl)cn1 ZINC000827389709 649028274 /nfs/dbraw/zinc/02/82/74/649028274.db2.gz JPISQCFEFNZACG-UHFFFAOYSA-N 1 2 321.808 2.249 20 10 DECDLO Cc1cc(C(=O)C[N@@H+](C)CCO)c(C)n1-c1ccc(Cl)cn1 ZINC000827389709 649028278 /nfs/dbraw/zinc/02/82/78/649028278.db2.gz JPISQCFEFNZACG-UHFFFAOYSA-N 1 2 321.808 2.249 20 10 DECDLO O=C1CCCN1C[C@H]1CC[N@@H+](Cc2cccc(Cl)c2O)C1 ZINC000827633874 649060018 /nfs/dbraw/zinc/06/00/18/649060018.db2.gz DKAKYYKMXGKZPZ-LBPRGKRZSA-N 1 2 308.809 2.490 20 10 DECDLO O=C1CCCN1C[C@H]1CC[N@H+](Cc2cccc(Cl)c2O)C1 ZINC000827633874 649060020 /nfs/dbraw/zinc/06/00/20/649060020.db2.gz DKAKYYKMXGKZPZ-LBPRGKRZSA-N 1 2 308.809 2.490 20 10 DECDLO Cc1cc(C[N@@H+]2CCNC(=O)[C@H]2C)ccc1N1CCCCC1 ZINC000827654918 649062339 /nfs/dbraw/zinc/06/23/39/649062339.db2.gz FOQKFEUMQCBEFR-OAHLLOKOSA-N 1 2 301.434 2.306 20 10 DECDLO Cc1cc(C[N@H+]2CCNC(=O)[C@H]2C)ccc1N1CCCCC1 ZINC000827654918 649062347 /nfs/dbraw/zinc/06/23/47/649062347.db2.gz FOQKFEUMQCBEFR-OAHLLOKOSA-N 1 2 301.434 2.306 20 10 DECDLO COc1ccc(N(C)CC[N@H+](C)Cc2cn(C(C)C)nn2)cc1 ZINC000844401871 651123372 /nfs/dbraw/zinc/12/33/72/651123372.db2.gz ONMLQCJZVCJEBZ-UHFFFAOYSA-N 1 2 317.437 2.436 20 10 DECDLO COc1ccc(N(C)CC[N@@H+](C)Cc2cn(C(C)C)nn2)cc1 ZINC000844401871 651123373 /nfs/dbraw/zinc/12/33/73/651123373.db2.gz ONMLQCJZVCJEBZ-UHFFFAOYSA-N 1 2 317.437 2.436 20 10 DECDLO COc1ccc(O)c([C@@H](C)[NH2+]Cc2nc([C@H]3CCCO3)n[nH]2)c1 ZINC000848557356 651470607 /nfs/dbraw/zinc/47/06/07/651470607.db2.gz IMVWOMJRTMEZRN-QMTHXVAHSA-N 1 2 318.377 2.221 20 10 DECDLO CCOc1ccc(O)c(C[NH2+]Cc2nc([C@@H]3CCCO3)n[nH]2)c1 ZINC000848562102 651471115 /nfs/dbraw/zinc/47/11/15/651471115.db2.gz HHEUNDOLDCPHJV-AWEZNQCLSA-N 1 2 318.377 2.050 20 10 DECDLO [NH2+]=C(NCc1cc(Cl)cc(Cl)c1O)N1CCOCC1 ZINC000849028067 651588314 /nfs/dbraw/zinc/58/83/14/651588314.db2.gz ARYRNUSEYZAIOB-UHFFFAOYSA-N 1 2 304.177 2.056 20 10 DECDLO COCc1n[nH]c(C[NH2+][C@H](C)c2cc(Cl)cc(C)c2O)n1 ZINC000850513761 651942838 /nfs/dbraw/zinc/94/28/38/651942838.db2.gz JCNUDUQGPLIMHG-SECBINFHSA-N 1 2 310.785 2.469 20 10 DECDLO C[C@H]1OCC[N@H+](Cc2ccc(N3CCOCC3)c(F)c2)[C@@H]1C ZINC000093418169 684049150 /nfs/dbraw/zinc/04/91/50/684049150.db2.gz YGHBSJHDRHLZFT-ZIAGYGMSSA-N 1 2 308.397 2.272 20 10 DECDLO C[C@H]1OCC[N@@H+](Cc2ccc(N3CCOCC3)c(F)c2)[C@@H]1C ZINC000093418169 684049152 /nfs/dbraw/zinc/04/91/52/684049152.db2.gz YGHBSJHDRHLZFT-ZIAGYGMSSA-N 1 2 308.397 2.272 20 10 DECDLO C[C@@H](CC[S@](C)=O)[NH2+]Cc1cccc(Br)c1O ZINC000125428010 684145576 /nfs/dbraw/zinc/14/55/76/684145576.db2.gz PEONSSTWERNOFO-HUTHGQBESA-N 1 2 320.252 2.401 20 10 DECDLO O=C(NCc1ccc(O)c(O)c1)c1ccc(-n2cc[nH+]c2)cc1 ZINC000159117211 684310046 /nfs/dbraw/zinc/31/00/46/684310046.db2.gz ZHKNTKPJVLHMAO-UHFFFAOYSA-N 1 2 309.325 2.214 20 10 DECDLO CN(C)c1cc(F)c(C[N@H+](C)C[C@@H](O)C(F)(F)F)cc1F ZINC000862367550 686284277 /nfs/dbraw/zinc/28/42/77/686284277.db2.gz MWTCNMVUUJFCIT-GFCCVEGCSA-N 1 2 312.282 2.386 20 10 DECDLO CN(C)c1cc(F)c(C[N@@H+](C)C[C@@H](O)C(F)(F)F)cc1F ZINC000862367550 686284282 /nfs/dbraw/zinc/28/42/82/686284282.db2.gz MWTCNMVUUJFCIT-GFCCVEGCSA-N 1 2 312.282 2.386 20 10 DECDLO Cc1noc([C@@H]2OCC[C@@H]2[NH2+]Cc2cccc(Cl)c2O)n1 ZINC000862543652 686319052 /nfs/dbraw/zinc/31/90/52/686319052.db2.gz MXMSYVXWQYATHX-WCQYABFASA-N 1 2 309.753 2.357 20 10 DECDLO Cn1ccnc1C[N@H+](C)Cc1ccc(N2CCC(O)CC2)cc1 ZINC000877169088 690036334 /nfs/dbraw/zinc/03/63/34/690036334.db2.gz FVSLHKJDPUQDJA-UHFFFAOYSA-N 1 2 314.433 2.013 20 10 DECDLO Cn1ccnc1C[N@@H+](C)Cc1ccc(N2CCC(O)CC2)cc1 ZINC000877169088 690036338 /nfs/dbraw/zinc/03/63/38/690036338.db2.gz FVSLHKJDPUQDJA-UHFFFAOYSA-N 1 2 314.433 2.013 20 10 DECDLO Oc1cc(F)cc(F)c1CN1CC([NH+]2CCC(F)CC2)C1 ZINC001140583657 777374547 /nfs/dbraw/zinc/37/45/47/777374547.db2.gz PZPRBOGQKCNQOU-UHFFFAOYSA-N 1 2 300.324 2.289 20 10 DECDLO COc1ccc(N2CC[NH+](Cc3ccc(O)cn3)CC2)c(C)c1 ZINC001144264236 790833539 /nfs/dbraw/zinc/83/35/39/790833539.db2.gz NTBZLGUMFPHAMP-UHFFFAOYSA-N 1 2 313.401 2.426 20 10 DECDLO O=C(C1CC1)[C@@H]1C[N@H+](Cc2ccc(N3CCCC3)cc2)CCO1 ZINC001117641946 795092045 /nfs/dbraw/zinc/09/20/45/795092045.db2.gz PRTTZBZERRHTPT-SFHVURJKSA-N 1 2 314.429 2.467 20 10 DECDLO O=C(C1CC1)[C@@H]1C[N@@H+](Cc2ccc(N3CCCC3)cc2)CCO1 ZINC001117641946 795092049 /nfs/dbraw/zinc/09/20/49/795092049.db2.gz PRTTZBZERRHTPT-SFHVURJKSA-N 1 2 314.429 2.467 20 10 DECDLO OC[C@@H]1CCC[N@@H+]1Cc1cc(Br)cc(F)c1O ZINC001119444555 795301904 /nfs/dbraw/zinc/30/19/04/795301904.db2.gz BPYUDBHTWVSLJX-JTQLQIEISA-N 1 2 304.159 2.251 20 10 DECDLO OC[C@@H]1CCC[N@H+]1Cc1cc(Br)cc(F)c1O ZINC001119444555 795301910 /nfs/dbraw/zinc/30/19/10/795301910.db2.gz BPYUDBHTWVSLJX-JTQLQIEISA-N 1 2 304.159 2.251 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CC[C@H]2OCC[C@H]21 ZINC001139125629 796326159 /nfs/dbraw/zinc/32/61/59/796326159.db2.gz YEOYSDXCCWXLLG-UKRRQHHQSA-N 1 2 301.342 2.170 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CC[C@H]2OCC[C@H]21 ZINC001139125629 796326161 /nfs/dbraw/zinc/32/61/61/796326161.db2.gz YEOYSDXCCWXLLG-UKRRQHHQSA-N 1 2 301.342 2.170 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CCC[C@H](C)[C@@H]1CO ZINC001139126530 796327324 /nfs/dbraw/zinc/32/73/24/796327324.db2.gz IUSQDBOGCMMQSJ-NHYWBVRUSA-N 1 2 317.385 2.400 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CCC[C@H](C)[C@@H]1CO ZINC001139126530 796327329 /nfs/dbraw/zinc/32/73/29/796327329.db2.gz IUSQDBOGCMMQSJ-NHYWBVRUSA-N 1 2 317.385 2.400 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CC[C@H](C)[C@@H](O)CC1 ZINC001139126848 796327430 /nfs/dbraw/zinc/32/74/30/796327430.db2.gz RZUFBDWNTLCWMH-NHYWBVRUSA-N 1 2 317.385 2.400 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CC[C@H](C)[C@@H](O)CC1 ZINC001139126848 796327436 /nfs/dbraw/zinc/32/74/36/796327436.db2.gz RZUFBDWNTLCWMH-NHYWBVRUSA-N 1 2 317.385 2.400 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1C[C@@H](CO)CC[C@H]1C ZINC001139126688 796327934 /nfs/dbraw/zinc/32/79/34/796327934.db2.gz MSYZVXWFZHMVTH-OLZOCXBDSA-N 1 2 317.385 2.400 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1C[C@@H](CO)CC[C@H]1C ZINC001139126688 796327939 /nfs/dbraw/zinc/32/79/39/796327939.db2.gz MSYZVXWFZHMVTH-OLZOCXBDSA-N 1 2 317.385 2.400 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2CN1CC[NH+](C(C)C)CC1 ZINC001139126553 796328076 /nfs/dbraw/zinc/32/80/76/796328076.db2.gz KBPSYRUSTNZFEO-UHFFFAOYSA-N 1 2 316.401 2.333 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CCOCC1(C)C ZINC001139129053 796329028 /nfs/dbraw/zinc/32/90/28/796329028.db2.gz MLQHEQQSKRDZIO-UHFFFAOYSA-N 1 2 303.358 2.418 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CCOCC1(C)C ZINC001139129053 796329034 /nfs/dbraw/zinc/32/90/34/796329034.db2.gz MLQHEQQSKRDZIO-UHFFFAOYSA-N 1 2 303.358 2.418 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1C[C@H]2CC[C@@H](C1)C2=O ZINC001139129490 796329343 /nfs/dbraw/zinc/32/93/43/796329343.db2.gz AFAIGGHZWZNGBQ-TXEJJXNPSA-N 1 2 313.353 2.218 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1C[C@H]2CC[C@@H](C1)C2=O ZINC001139129490 796329346 /nfs/dbraw/zinc/32/93/46/796329346.db2.gz AFAIGGHZWZNGBQ-TXEJJXNPSA-N 1 2 313.353 2.218 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CCCO[C@@H](C)C1 ZINC001139127583 796329431 /nfs/dbraw/zinc/32/94/31/796329431.db2.gz YEUXHQHKWDSDKL-LBPRGKRZSA-N 1 2 303.358 2.418 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CCCO[C@@H](C)C1 ZINC001139127583 796329434 /nfs/dbraw/zinc/32/94/34/796329434.db2.gz YEUXHQHKWDSDKL-LBPRGKRZSA-N 1 2 303.358 2.418 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2CN1CCC[C@@H]([NH+](C)C)C1 ZINC001139127659 796329549 /nfs/dbraw/zinc/32/95/49/796329549.db2.gz MVUBKFVQQFLTTP-CYBMUJFWSA-N 1 2 316.401 2.333 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CCC[C@H](CCO)C1 ZINC001139129258 796329561 /nfs/dbraw/zinc/32/95/61/796329561.db2.gz SPNNXSFDOAFAMP-CYBMUJFWSA-N 1 2 317.385 2.401 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CCC[C@H](CCO)C1 ZINC001139129258 796329567 /nfs/dbraw/zinc/32/95/67/796329567.db2.gz SPNNXSFDOAFAMP-CYBMUJFWSA-N 1 2 317.385 2.401 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CCOC[C@H]1C1CC1 ZINC001139133609 796330475 /nfs/dbraw/zinc/33/04/75/796330475.db2.gz JBGBAWMUWDEWDM-HNNXBMFYSA-N 1 2 315.369 2.418 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CCOC[C@H]1C1CC1 ZINC001139133609 796330479 /nfs/dbraw/zinc/33/04/79/796330479.db2.gz JBGBAWMUWDEWDM-HNNXBMFYSA-N 1 2 315.369 2.418 20 10 DECDLO OC[C@@H]1C[C@@H](F)C[N@H+](Cc2c(O)cccc2Br)C1 ZINC001140098857 796476747 /nfs/dbraw/zinc/47/67/47/796476747.db2.gz PLUUDCYGIRJIJG-NXEZZACHSA-N 1 2 318.186 2.307 20 10 DECDLO OC[C@@H]1C[C@@H](F)C[N@@H+](Cc2c(O)cccc2Br)C1 ZINC001140098857 796476750 /nfs/dbraw/zinc/47/67/50/796476750.db2.gz PLUUDCYGIRJIJG-NXEZZACHSA-N 1 2 318.186 2.307 20 10 DECDLO OC[C@H]1CCn2nccc2C[N@@H+]1Cc1c(O)cccc1Cl ZINC001140342670 796510724 /nfs/dbraw/zinc/51/07/24/796510724.db2.gz UAJNWIYZNUPYDY-GFCCVEGCSA-N 1 2 307.781 2.009 20 10 DECDLO OC[C@H]1CCn2nccc2C[N@H+]1Cc1c(O)cccc1Cl ZINC001140342670 796510727 /nfs/dbraw/zinc/51/07/27/796510727.db2.gz UAJNWIYZNUPYDY-GFCCVEGCSA-N 1 2 307.781 2.009 20 10 DECDLO Cc1ccnc(O[C@H]2CC[N@H+](Cc3c(O)cc(F)cc3F)C2)n1 ZINC001140585457 796542022 /nfs/dbraw/zinc/54/20/22/796542022.db2.gz JCUSJVWMLGVCQY-LBPRGKRZSA-N 1 2 321.327 2.422 20 10 DECDLO Cc1ccnc(O[C@H]2CC[N@@H+](Cc3c(O)cc(F)cc3F)C2)n1 ZINC001140585457 796542026 /nfs/dbraw/zinc/54/20/26/796542026.db2.gz JCUSJVWMLGVCQY-LBPRGKRZSA-N 1 2 321.327 2.422 20 10 DECDLO CCOCc1ncn2c1C[N@H+](Cc1ccc(O)c(C)c1O)CC2 ZINC001140747765 796567141 /nfs/dbraw/zinc/56/71/41/796567141.db2.gz ADCWVYGDRVNGBJ-UHFFFAOYSA-N 1 2 317.389 2.155 20 10 DECDLO CCOCc1ncn2c1C[N@@H+](Cc1ccc(O)c(C)c1O)CC2 ZINC001140747765 796567146 /nfs/dbraw/zinc/56/71/46/796567146.db2.gz ADCWVYGDRVNGBJ-UHFFFAOYSA-N 1 2 317.389 2.155 20 10 DECDLO C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc2c[nH+]ccc2[nH]1 ZINC001154024322 797446377 /nfs/dbraw/zinc/44/63/77/797446377.db2.gz ARJNTWJDJDYVRO-JTQLQIEISA-N 1 2 311.341 2.335 20 10 DECDLO O=C(Nc1cc[nH+]c2c1CCC2)c1cc(O)c(O)c(Cl)c1 ZINC001193606206 797601931 /nfs/dbraw/zinc/60/19/31/797601931.db2.gz WHQARYSPNUOKAK-UHFFFAOYSA-N 1 2 304.733 2.309 20 10 DECDLO Cc1cc(NCCc2cc(O)c(O)cc2O)nc(C2CC2)[nH+]1 ZINC001157245310 798169268 /nfs/dbraw/zinc/16/92/68/798169268.db2.gz UYJKWHCHUDHUMS-UHFFFAOYSA-N 1 2 301.346 2.434 20 10 DECDLO CCOC(=O)Cc1ccc(NCc2ccc(O)c(O)c2)[nH+]c1 ZINC001158996193 798500747 /nfs/dbraw/zinc/50/07/47/798500747.db2.gz ZOTKAKDRYVQGDE-UHFFFAOYSA-N 1 2 302.330 2.211 20 10 DECDLO COc1ccc(N2CC[NH+](Cc3cc(C)nn3C)CC2)cc1 ZINC001205882858 798598544 /nfs/dbraw/zinc/59/85/44/798598544.db2.gz UJAZYFCYEJDNPS-UHFFFAOYSA-N 1 2 300.406 2.059 20 10 DECDLO CS(=O)(=O)N(c1ccc(N)cc1)c1ccn2cc[nH+]c2c1 ZINC001204983367 800281795 /nfs/dbraw/zinc/28/17/95/800281795.db2.gz UCIRHFOEKVDJKX-UHFFFAOYSA-N 1 2 302.359 2.014 20 10 DECDLO CCOc1ccc(N2CC[NH+](Cc3ccnn3C)CC2)cc1 ZINC001206365206 800518642 /nfs/dbraw/zinc/51/86/42/800518642.db2.gz LNZSMNOCFWBROX-UHFFFAOYSA-N 1 2 300.406 2.141 20 10 DECDLO Cn1nccc1[C@H]1C[N@H+](Cc2ccc(Cl)cc2O)CCO1 ZINC001207684853 800807392 /nfs/dbraw/zinc/80/73/92/800807392.db2.gz KACHYNPULZPRIH-OAHLLOKOSA-N 1 2 307.781 2.353 20 10 DECDLO Cn1nccc1[C@H]1C[N@@H+](Cc2ccc(Cl)cc2O)CCO1 ZINC001207684853 800807400 /nfs/dbraw/zinc/80/74/00/800807400.db2.gz KACHYNPULZPRIH-OAHLLOKOSA-N 1 2 307.781 2.353 20 10 DECDLO COC(=O)C1C[NH+](Cc2cc(C)cc(Br)c2O)C1 ZINC001207773518 800830383 /nfs/dbraw/zinc/83/03/83/800830383.db2.gz FMPJYCIHNBVSQH-UHFFFAOYSA-N 1 2 314.179 2.068 20 10 DECDLO O=C([O-])c1ccc(O)c(C[N@@H+]2CC[C@@H](Oc3cc[nH+]cc3)C2)c1 ZINC001231566063 801687872 /nfs/dbraw/zinc/68/78/72/801687872.db2.gz OVXMTTPIRSKFOB-OAHLLOKOSA-N 1 2 314.341 2.139 20 10 DECDLO O=C([O-])c1ccc(O)c(C[N@H+]2CC[C@@H](Oc3cc[nH+]cc3)C2)c1 ZINC001231566063 801687877 /nfs/dbraw/zinc/68/78/77/801687877.db2.gz OVXMTTPIRSKFOB-OAHLLOKOSA-N 1 2 314.341 2.139 20 10 DECDLO Cc1ccnc(N2CC[NH+](Cc3cccc(Cl)c3O)CC2)n1 ZINC001231913843 801750157 /nfs/dbraw/zinc/75/01/57/801750157.db2.gz SXYQYAKPNZKPQV-UHFFFAOYSA-N 1 2 318.808 2.466 20 10 DECDLO COc1cc(O)c(C[N@H+]2CCN(C(C)=O)[C@@H](C)C2)cc1Cl ZINC001232267404 801833086 /nfs/dbraw/zinc/83/30/86/801833086.db2.gz BIXAFEOGHCZRCX-JTQLQIEISA-N 1 2 312.797 2.107 20 10 DECDLO COc1cc(O)c(C[N@H+]2CC[C@](O)(CF)[C@@H](F)C2)cc1Cl ZINC001232266660 801834327 /nfs/dbraw/zinc/83/43/27/801834327.db2.gz QVEFXKJZNMBIGO-KBPBESRZSA-N 1 2 321.751 2.299 20 10 DECDLO C[C@]1(O)CC[N@H+](Cc2c(O)cc(Br)cc2F)C1 ZINC001233027556 802006524 /nfs/dbraw/zinc/00/65/24/802006524.db2.gz BUCHHTDOZWRJLK-LBPRGKRZSA-N 1 2 304.159 2.251 20 10 DECDLO C[C@]1(O)CC[N@@H+](Cc2c(O)cc(Br)cc2F)C1 ZINC001233027556 802006533 /nfs/dbraw/zinc/00/65/33/802006533.db2.gz BUCHHTDOZWRJLK-LBPRGKRZSA-N 1 2 304.159 2.251 20 10 DECDLO C[N@@H+]1CC[C@@H](Oc2c(O)ccc3c2C(=O)c2ccccc2C3=O)C1 ZINC001227580000 803255442 /nfs/dbraw/zinc/25/54/42/803255442.db2.gz DJMHXCBCHVDLDW-LLVKDONJSA-N 1 2 323.348 2.251 20 10 DECDLO C[N@H+]1CC[C@@H](Oc2c(O)ccc3c2C(=O)c2ccccc2C3=O)C1 ZINC001227580000 803255448 /nfs/dbraw/zinc/25/54/48/803255448.db2.gz DJMHXCBCHVDLDW-LLVKDONJSA-N 1 2 323.348 2.251 20 10 DECDLO CCC[C@@](C)(O)C[NH2+][C@H](CC)c1cccc(-c2nn[nH]n2)c1O ZINC001604127748 1070234455 /nfs/dbraw/zinc/23/44/55/1070234455.db2.gz FNSLFNREGQQICC-CZUORRHYSA-N 1 2 319.409 2.164 20 10 DECDLO C[C@H]([C@H](C)[NH2+]Cc1cc(Cl)cc(F)c1O)N1CCOCC1 ZINC001461178297 1058599941 /nfs/dbraw/zinc/59/99/41/1058599941.db2.gz UGSORSSSTUGAJU-WDEREUQCSA-N 1 2 316.804 2.384 20 10 DECDLO COc1c(O)c(C[NH2+][C@H]2C[C@@H](C)n3ccnc32)ccc1[N+](=O)[O-] ZINC001462241393 1058786387 /nfs/dbraw/zinc/78/63/87/1058786387.db2.gz WQFSYEOJWQRYRQ-KOLCDFICSA-N 1 2 318.333 2.301 20 10 DECDLO O=C(Cn1cc[nH+]c1)Nc1c(-c2ccccn2)nc2ccccn21 ZINC001629108274 1078310167 /nfs/dbraw/zinc/31/01/67/1078310167.db2.gz WVOLUXNRDXNXMS-UHFFFAOYSA-N 1 2 318.340 2.232 20 10 DECDLO CC[C@H]([NH2+]CCOC1CCC1)c1cccc(-c2nn[nH]n2)c1O ZINC001590466005 1076633103 /nfs/dbraw/zinc/63/31/03/1076633103.db2.gz JCHQFJHMQQYIDN-AWEZNQCLSA-N 1 2 317.393 2.182 20 10 DECDLO Oc1c(F)cc(Cl)cc1C[NH2+]C[C@H](O)COCC1CC1 ZINC001655491583 1080000179 /nfs/dbraw/zinc/00/01/79/1080000179.db2.gz DCIUIENNUVQMAL-LBPRGKRZSA-N 1 2 303.761 2.062 20 10 DECDLO NC(=O)[C@H]([NH2+]Cc1cc(F)cc(F)c1O)c1ccc(F)cc1 ZINC001656056927 1080033172 /nfs/dbraw/zinc/03/31/72/1080033172.db2.gz UMEFNAXRGLESKF-CYBMUJFWSA-N 1 2 310.275 2.126 20 10 DECDLO Oc1c(F)cc(Cl)cc1C[NH2+]CCOC[C@@H]1CCOC1 ZINC001657097710 1080155397 /nfs/dbraw/zinc/15/53/97/1080155397.db2.gz IIYBFXHKMNJUOD-SNVBAGLBSA-N 1 2 303.761 2.327 20 10 DECDLO O=C(C[NH2+]Cc1cc(Cl)cc(F)c1O)NC1CCCC1 ZINC001657123689 1080157820 /nfs/dbraw/zinc/15/78/20/1080157820.db2.gz SKLBINVDQZRVPN-UHFFFAOYSA-N 1 2 300.761 2.333 20 10 DECDLO C[N@H+](Cc1ccc(C(N)=O)cc1)Cc1ccc(F)c(F)c1O ZINC001658039405 1080194156 /nfs/dbraw/zinc/19/41/56/1080194156.db2.gz JIRWBNRTXCVEHG-UHFFFAOYSA-N 1 2 306.312 2.401 20 10 DECDLO C[N@@H+](Cc1ccc(C(N)=O)cc1)Cc1ccc(F)c(F)c1O ZINC001658039405 1080194157 /nfs/dbraw/zinc/19/41/57/1080194157.db2.gz JIRWBNRTXCVEHG-UHFFFAOYSA-N 1 2 306.312 2.401 20 10 DECDLO Oc1c(Br)cc(Cl)cc1CN1CC[NH2+][C@@H]2C[C@@H]21 ZINC001235287467 1084373917 /nfs/dbraw/zinc/37/39/17/1084373917.db2.gz CRYVROQFJVSBFS-MNOVXSKESA-N 1 2 317.614 2.354 20 10 DECDLO Oc1c(Br)cc(F)cc1C[NH+]1CC(C2COC2)C1 ZINC001235298250 1084377069 /nfs/dbraw/zinc/37/70/69/1084377069.db2.gz QOLSGUOPMCBJOR-UHFFFAOYSA-N 1 2 316.170 2.372 20 10 DECDLO Oc1cccc(F)c1CN1CC[NH+](CCc2ccncc2)CC1 ZINC001137837763 1086618145 /nfs/dbraw/zinc/61/81/45/1086618145.db2.gz UDEBGHHFUQCDEI-UHFFFAOYSA-N 1 2 315.392 2.287 20 10 DECDLO Oc1cccc(F)c1C[NH+]1CCN(CCc2ccncc2)CC1 ZINC001137837763 1086618150 /nfs/dbraw/zinc/61/81/50/1086618150.db2.gz UDEBGHHFUQCDEI-UHFFFAOYSA-N 1 2 315.392 2.287 20 10 DECDLO CN1CC[C@@]2(CCC[N@@H+]2Cc2cc(Cl)cc(F)c2O)C1=O ZINC001274365869 1091208406 /nfs/dbraw/zinc/20/84/06/1091208406.db2.gz LYWJENULKGUVAU-HNNXBMFYSA-N 1 2 312.772 2.381 20 10 DECDLO CN1CC[C@@]2(CCC[N@H+]2Cc2cc(Cl)cc(F)c2O)C1=O ZINC001274365869 1091208415 /nfs/dbraw/zinc/20/84/15/1091208415.db2.gz LYWJENULKGUVAU-HNNXBMFYSA-N 1 2 312.772 2.381 20 10 DECDLO COC(=O)[C@@H](C)[N@H+](C)Cc1ccc(OCC(F)(F)F)cc1O ZINC001237057685 1138492732 /nfs/dbraw/zinc/49/27/32/1138492732.db2.gz UXAIYRKKPCZSEN-SECBINFHSA-N 1 2 321.295 2.327 20 10 DECDLO COC(=O)[C@@H](C)[N@@H+](C)Cc1ccc(OCC(F)(F)F)cc1O ZINC001237057685 1138492736 /nfs/dbraw/zinc/49/27/36/1138492736.db2.gz UXAIYRKKPCZSEN-SECBINFHSA-N 1 2 321.295 2.327 20 10 DECDLO CC(C)(C)[N@@H+](Cc1cc(Cl)cc(F)c1O)C[C@@H](O)CO ZINC001237617503 1138716810 /nfs/dbraw/zinc/71/68/10/1138716810.db2.gz SAVNAGDKJGZXHF-LLVKDONJSA-N 1 2 305.777 2.138 20 10 DECDLO CC(C)(C)[N@H+](Cc1cc(Cl)cc(F)c1O)C[C@@H](O)CO ZINC001237617503 1138716822 /nfs/dbraw/zinc/71/68/22/1138716822.db2.gz SAVNAGDKJGZXHF-LLVKDONJSA-N 1 2 305.777 2.138 20 10 DECDLO COc1ccc2c(c1)c1c(n2C)CC[N@@H+](Cc2c[nH]ccc2=O)C1 ZINC001237838430 1138802486 /nfs/dbraw/zinc/80/24/86/1138802486.db2.gz UGSLEVOMAMUCGW-UHFFFAOYSA-N 1 2 323.396 2.434 20 10 DECDLO COc1ccc2c(c1)c1c(n2C)CC[N@H+](Cc2c[nH]ccc2=O)C1 ZINC001237838430 1138802489 /nfs/dbraw/zinc/80/24/89/1138802489.db2.gz UGSLEVOMAMUCGW-UHFFFAOYSA-N 1 2 323.396 2.434 20 10 DECDLO Cc1cc(F)cc(C[NH+]2CCN(C[C@H]3CCCO3)CC2)c1O ZINC001238060531 1138819278 /nfs/dbraw/zinc/81/92/78/1138819278.db2.gz BVSJTSSSYGQVBJ-MRXNPFEDSA-N 1 2 308.397 2.136 20 10 DECDLO Cc1cc(C[N@@H+]2CC[C@@](F)(CO)C2)c(O)cc1Br ZINC001250120484 1142084987 /nfs/dbraw/zinc/08/49/87/1142084987.db2.gz FTKLGSOHFDSNCE-ZDUSSCGKSA-N 1 2 318.186 2.369 20 10 DECDLO Cc1cc(C[N@H+]2CC[C@@](F)(CO)C2)c(O)cc1Br ZINC001250120484 1142084994 /nfs/dbraw/zinc/08/49/94/1142084994.db2.gz FTKLGSOHFDSNCE-ZDUSSCGKSA-N 1 2 318.186 2.369 20 10 DECDLO C[C@H]1C[C@H]1c1nnc(-c2ccc(O)c(C[NH+]3CCOCC3)c2)o1 ZINC001256774286 1143866830 /nfs/dbraw/zinc/86/68/30/1143866830.db2.gz RHWJIDOYHFMTTG-SMDDNHRTSA-N 1 2 315.373 2.398 20 10 DECDLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)NCc1ccc2cccnc2c1O ZINC001299726291 1144215188 /nfs/dbraw/zinc/21/51/88/1144215188.db2.gz RJARIEYBVRIUKJ-LLVKDONJSA-N 1 2 310.357 2.159 20 10 DECDLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)NCc1ccc2cccnc2c1O ZINC001299726291 1144215190 /nfs/dbraw/zinc/21/51/90/1144215190.db2.gz RJARIEYBVRIUKJ-LLVKDONJSA-N 1 2 310.357 2.159 20 10 DECDLO O=C(NCCCn1cc[nH+]c1)c1cc2cc(O)c(O)cc2s1 ZINC001290096869 1146832756 /nfs/dbraw/zinc/83/27/56/1146832756.db2.gz NTNKBPAUGLHRQP-UHFFFAOYSA-N 1 2 317.370 2.329 20 10 DECDLO C[C@@H]([NH2+][C@@H]1CCN(c2cnn(C)c2)C1)c1cc(F)cc(F)c1O ZINC001325339251 1147894312 /nfs/dbraw/zinc/89/43/12/1147894312.db2.gz HRMFDIHEHRJEEN-ZYHUDNBSSA-N 1 2 322.359 2.333 20 10 DECDLO CN(C)c1ccc(C[N@@H+]2CCC[C@@H]2c2nncn2C)cc1F ZINC000271163528 282289780 /nfs/dbraw/zinc/28/97/80/282289780.db2.gz ASMNJRVHUNTOIO-OAHLLOKOSA-N 1 2 303.385 2.357 20 10 DECDLO CN(C)c1ccc(C[N@H+]2CCC[C@@H]2c2nncn2C)cc1F ZINC000271163528 282289783 /nfs/dbraw/zinc/28/97/83/282289783.db2.gz ASMNJRVHUNTOIO-OAHLLOKOSA-N 1 2 303.385 2.357 20 10 DECDLO C[C@@H]1C[C@H]([NH2+][C@@H](C(N)=O)c2ccccn2)c2c1c(F)ccc2O ZINC000834828253 649852711 /nfs/dbraw/zinc/85/27/11/649852711.db2.gz QTHCJZATOVUUHI-RCAYSMOQSA-N 1 2 315.348 2.291 20 10 DECDLO O=[N+]([O-])c1ccc(O)c(C[NH2+][C@@]2(CO)CCc3ccccc32)c1 ZINC000135910688 401955294 /nfs/dbraw/zinc/95/52/94/401955294.db2.gz YDXBYJNFAPRMCJ-QGZVFWFLSA-N 1 2 314.341 2.224 20 10 DECDLO COCC[NH+]1CCN(Cc2cc(Cl)cc(Cl)c2O)CC1 ZINC000123006162 402105486 /nfs/dbraw/zinc/10/54/86/402105486.db2.gz HADYHAJQOAOBHW-UHFFFAOYSA-N 1 2 319.232 2.463 20 10 DECDLO CCS(=O)(=O)C[C@H](C)[NH2+][C@H](C)c1ccc(F)c(F)c1O ZINC000187782120 402511710 /nfs/dbraw/zinc/51/17/10/402511710.db2.gz WLXVOIRDLUZSCT-DTWKUNHWSA-N 1 2 307.362 2.144 20 10 DECDLO COc1cccc(CNc2nc(N(C)C)nc(C(C)C)[nH+]2)c1O ZINC000302012258 403705904 /nfs/dbraw/zinc/70/59/04/403705904.db2.gz WWCIKBHRCKVXTN-UHFFFAOYSA-N 1 2 317.393 2.387 20 10 DECDLO COc1cccc(CNc2nc(C(C)C)[nH+]c(N(C)C)n2)c1O ZINC000302012258 403705907 /nfs/dbraw/zinc/70/59/07/403705907.db2.gz WWCIKBHRCKVXTN-UHFFFAOYSA-N 1 2 317.393 2.387 20 10 DECDLO O=C(NC1CC1)[C@@H]1CCC[N@H+]1Cc1cc(Cl)c(F)cc1O ZINC000295266483 403820019 /nfs/dbraw/zinc/82/00/19/403820019.db2.gz HJJKSULFIASVJP-ZDUSSCGKSA-N 1 2 312.772 2.428 20 10 DECDLO O=C(NC1CC1)[C@@H]1CCC[N@@H+]1Cc1cc(Cl)c(F)cc1O ZINC000295266483 403820024 /nfs/dbraw/zinc/82/00/24/403820024.db2.gz HJJKSULFIASVJP-ZDUSSCGKSA-N 1 2 312.772 2.428 20 10 DECDLO C[C@@H]1C[C@@H](N2CCOCC2)C[N@@H+]1Cc1cccc(Cl)c1O ZINC000377633480 404841191 /nfs/dbraw/zinc/84/11/91/404841191.db2.gz UVVAQXSWAFHJDL-TZMCWYRMSA-N 1 2 310.825 2.341 20 10 DECDLO C[C@@H]1C[C@@H](N2CCOCC2)C[N@H+]1Cc1cccc(Cl)c1O ZINC000377633480 404841194 /nfs/dbraw/zinc/84/11/94/404841194.db2.gz UVVAQXSWAFHJDL-TZMCWYRMSA-N 1 2 310.825 2.341 20 10 DECDLO C[C@@H]([NH2+]C[C@@H]1CCCN1CCCO)c1cc(F)cc(F)c1O ZINC000834850827 649854290 /nfs/dbraw/zinc/85/42/90/649854290.db2.gz PZGWYBMFNJDXRW-YPMHNXCESA-N 1 2 314.376 2.168 20 10 DECDLO COC(=O)[C@@H]1CCC[N@@H+]1Cc1cc(Br)ccc1O ZINC000124733899 523695590 /nfs/dbraw/zinc/69/55/90/523695590.db2.gz XDKXFCFPQNXBSD-NSHDSACASA-N 1 2 314.179 2.292 20 10 DECDLO COC(=O)[C@@H]1CCC[N@H+]1Cc1cc(Br)ccc1O ZINC000124733899 523695598 /nfs/dbraw/zinc/69/55/98/523695598.db2.gz XDKXFCFPQNXBSD-NSHDSACASA-N 1 2 314.179 2.292 20 10 DECDLO Cn1nc2c(c1C[N@@H+]1Cc3cccc(O)c3C1)CSCC2 ZINC000895449838 638030195 /nfs/dbraw/zinc/03/01/95/638030195.db2.gz PDUYDQQTSPBNSJ-UHFFFAOYSA-N 1 2 301.415 2.431 20 10 DECDLO Cn1nc2c(c1C[N@H+]1Cc3cccc(O)c3C1)CSCC2 ZINC000895449838 638030196 /nfs/dbraw/zinc/03/01/96/638030196.db2.gz PDUYDQQTSPBNSJ-UHFFFAOYSA-N 1 2 301.415 2.431 20 10 DECDLO O=C1N[C@H](C2CC[NH+](Cc3cccc(Cl)c3O)CC2)CO1 ZINC000897022101 639134565 /nfs/dbraw/zinc/13/45/65/639134565.db2.gz DBGUXVNEOIZGBB-ZDUSSCGKSA-N 1 2 310.781 2.366 20 10 DECDLO C[C@H]([NH2+][C@@H](C)[C@H](C)N1CCOCC1)c1cc(F)cc(F)c1O ZINC000756542610 639671097 /nfs/dbraw/zinc/67/10/97/639671097.db2.gz KPIAESAFFIVCFX-SRVKXCTJSA-N 1 2 314.376 2.430 20 10 DECDLO CCS(=O)(=O)C[C@H](C)[NH2+][C@@H](C)c1cc(F)cc(F)c1O ZINC000756707122 639686021 /nfs/dbraw/zinc/68/60/21/639686021.db2.gz URNFOWJUCQQVNB-IUCAKERBSA-N 1 2 307.362 2.144 20 10 DECDLO C[C@@H]([NH2+]C[C@H](O)C1CCOCC1)c1cc(F)cc(F)c1O ZINC000756739096 639690861 /nfs/dbraw/zinc/69/08/61/639690861.db2.gz RRBXMIIYNIQDFZ-OTYXRUKQSA-N 1 2 301.333 2.109 20 10 DECDLO C[C@@H]([NH2+]Cc1nnc2n1CCCC2)c1cc(F)cc(F)c1O ZINC000760869963 640237597 /nfs/dbraw/zinc/23/75/97/640237597.db2.gz NTKRMSVRHPDJTH-SECBINFHSA-N 1 2 308.332 2.449 20 10 DECDLO Oc1c(Br)cccc1C[NH2+]CC[C@H](O)C1CC1 ZINC000898206244 641046860 /nfs/dbraw/zinc/04/68/60/641046860.db2.gz MUZQCZMCTXWQMW-LBPRGKRZSA-N 1 2 300.196 2.405 20 10 DECDLO Fc1c[nH+]ccc1NCc1ccc(N2CCOCC2)c(F)c1 ZINC000775483985 642051039 /nfs/dbraw/zinc/05/10/39/642051039.db2.gz GGHXDQPKWFWXOR-UHFFFAOYSA-N 1 2 305.328 2.230 20 10 DECDLO NC(=O)COc1ccc(C[NH2+]Cc2cccc(Cl)c2O)cc1 ZINC000776079676 642128893 /nfs/dbraw/zinc/12/88/93/642128893.db2.gz DMPNAESYHHFBAO-UHFFFAOYSA-N 1 2 320.776 2.200 20 10 DECDLO C[C@H]([NH2+][C@H]1CCn2cc[nH+]c2C1)c1cc([N+](=O)[O-])ccc1[O-] ZINC000779062340 642460141 /nfs/dbraw/zinc/46/01/41/642460141.db2.gz SMJZDXMHWBQXHR-QWRGUYRKSA-N 1 2 302.334 2.163 20 10 DECDLO O=C(/C=C/c1ccc(O)c(O)c1)N1CCC[C@@H](n2cc[nH+]c2)C1 ZINC000779513846 642507215 /nfs/dbraw/zinc/50/72/15/642507215.db2.gz YJMSOVCSKCHDRT-YVARQFDVSA-N 1 2 313.357 2.171 20 10 DECDLO CC[C@H]([NH2+]Cc1nnnn1CC1CC1)c1ccc(F)cc1O ZINC000796944967 644816631 /nfs/dbraw/zinc/81/66/31/644816631.db2.gz HVJBNFQPLATBAD-ZDUSSCGKSA-N 1 2 305.357 2.169 20 10 DECDLO COc1c(O)c(C[N@@H+]2C[C@H](C)OC3(CCC3)C2)ccc1[N+](=O)[O-] ZINC000843431939 650973910 /nfs/dbraw/zinc/97/39/10/650973910.db2.gz FEUJMXRVWVFVKK-NSHDSACASA-N 1 2 322.361 2.452 20 10 DECDLO COc1c(O)c(C[N@H+]2C[C@H](C)OC3(CCC3)C2)ccc1[N+](=O)[O-] ZINC000843431939 650973912 /nfs/dbraw/zinc/97/39/12/650973912.db2.gz FEUJMXRVWVFVKK-NSHDSACASA-N 1 2 322.361 2.452 20 10 DECDLO C[C@@H](C[S@](C)=O)[NH2+]Cc1cccc(Br)c1O ZINC000164282049 646433298 /nfs/dbraw/zinc/43/32/98/646433298.db2.gz ZBAHMCYOKNRSJR-ZKANADHPSA-N 1 2 306.225 2.011 20 10 DECDLO NC(=O)[C@@H]1[C@@H]2CCC[C@H]2C[N@@H+]1Cc1cc(Cl)c(F)cc1O ZINC000816588979 647156402 /nfs/dbraw/zinc/15/64/02/647156402.db2.gz HRLGFOYBSCXSPM-HNXYLICVSA-N 1 2 312.772 2.271 20 10 DECDLO NC(=O)[C@@H]1[C@@H]2CCC[C@H]2C[N@H+]1Cc1cc(Cl)c(F)cc1O ZINC000816588979 647156403 /nfs/dbraw/zinc/15/64/03/647156403.db2.gz HRLGFOYBSCXSPM-HNXYLICVSA-N 1 2 312.772 2.271 20 10 DECDLO COc1cc(Cl)cc(C[N@@H+]2C[C@H](CO)OC(C)(C)C2)c1O ZINC000817412358 647289389 /nfs/dbraw/zinc/28/93/89/647289389.db2.gz JIKSKQCDQFVLBE-GFCCVEGCSA-N 1 2 315.797 2.026 20 10 DECDLO COc1cc(Cl)cc(C[N@H+]2C[C@H](CO)OC(C)(C)C2)c1O ZINC000817412358 647289398 /nfs/dbraw/zinc/28/93/98/647289398.db2.gz JIKSKQCDQFVLBE-GFCCVEGCSA-N 1 2 315.797 2.026 20 10 DECDLO CC[C@H]([NH2+][C@@H]1CCC(=O)N(C)C1=O)c1cccc(Cl)c1O ZINC000818362303 647458159 /nfs/dbraw/zinc/45/81/59/647458159.db2.gz UUGYTOVRYNCMTD-NWDGAFQWSA-N 1 2 310.781 2.234 20 10 DECDLO CS(=O)(=O)C[C@H]1CCCC[N@@H+]1Cc1c(O)cccc1Cl ZINC000824913533 648671694 /nfs/dbraw/zinc/67/16/94/648671694.db2.gz AJJDIBSVPRBKEO-LLVKDONJSA-N 1 2 317.838 2.445 20 10 DECDLO CS(=O)(=O)C[C@H]1CCCC[N@H+]1Cc1c(O)cccc1Cl ZINC000824913533 648671697 /nfs/dbraw/zinc/67/16/97/648671697.db2.gz AJJDIBSVPRBKEO-LLVKDONJSA-N 1 2 317.838 2.445 20 10 DECDLO COC(=O)c1n[nH]c2c1C[N@H+](Cc1cc(C)c(C)cc1O)CC2 ZINC000825017887 648686558 /nfs/dbraw/zinc/68/65/58/648686558.db2.gz ZJRUJKVPTSHYAP-UHFFFAOYSA-N 1 2 315.373 2.077 20 10 DECDLO COC(=O)c1n[nH]c2c1C[N@@H+](Cc1cc(C)c(C)cc1O)CC2 ZINC000825017887 648686560 /nfs/dbraw/zinc/68/65/60/648686560.db2.gz ZJRUJKVPTSHYAP-UHFFFAOYSA-N 1 2 315.373 2.077 20 10 DECDLO Cc1cc(O)c(CN2CC[NH+]([C@@H]3CCOC3)CC2)c(Cl)c1 ZINC000827125551 648976143 /nfs/dbraw/zinc/97/61/43/648976143.db2.gz MBNZYBQKHVDVOF-CYBMUJFWSA-N 1 2 310.825 2.261 20 10 DECDLO Cc1cc(O)c(C[NH+]2CCN([C@@H]3CCOC3)CC2)c(Cl)c1 ZINC000827125551 648976147 /nfs/dbraw/zinc/97/61/47/648976147.db2.gz MBNZYBQKHVDVOF-CYBMUJFWSA-N 1 2 310.825 2.261 20 10 DECDLO COC[C@@]1(C(=O)OC)CCC[N@@H+]1Cc1ccc(N(C)C)c(F)c1 ZINC000827489936 649041755 /nfs/dbraw/zinc/04/17/55/649041755.db2.gz YQSYFKQSGCOZII-QGZVFWFLSA-N 1 2 324.396 2.046 20 10 DECDLO COC[C@@]1(C(=O)OC)CCC[N@H+]1Cc1ccc(N(C)C)c(F)c1 ZINC000827489936 649041757 /nfs/dbraw/zinc/04/17/57/649041757.db2.gz YQSYFKQSGCOZII-QGZVFWFLSA-N 1 2 324.396 2.046 20 10 DECDLO COc1ccc(N(C)CC[N@H+](C)CN2CC(C)(C)OC2=O)cc1 ZINC000844725265 651161144 /nfs/dbraw/zinc/16/11/44/651161144.db2.gz JUNBAJNPALIIFK-UHFFFAOYSA-N 1 2 321.421 2.252 20 10 DECDLO COc1ccc(N(C)CC[N@@H+](C)CN2CC(C)(C)OC2=O)cc1 ZINC000844725265 651161147 /nfs/dbraw/zinc/16/11/47/651161147.db2.gz JUNBAJNPALIIFK-UHFFFAOYSA-N 1 2 321.421 2.252 20 10 DECDLO CN(C)c1ccc(CNC(=O)Cc2cn3c([nH+]2)CCCC3)cc1 ZINC000845100554 651203550 /nfs/dbraw/zinc/20/35/50/651203550.db2.gz AVCHWXWFWXFYSM-UHFFFAOYSA-N 1 2 312.417 2.144 20 10 DECDLO CN(CC[NH2+]Cc1cccc(Br)c1O)CC(F)F ZINC000858336396 652310595 /nfs/dbraw/zinc/31/05/95/652310595.db2.gz GICJEEVXNCVLQA-UHFFFAOYSA-N 1 2 323.181 2.441 20 10 DECDLO CC[C@H](C(=O)NCc1c(O)cccc1F)[N@@H+]1CCO[C@@H](CC)C1 ZINC000928709020 693831445 /nfs/dbraw/zinc/83/14/45/693831445.db2.gz VTJWUJNJQFZWBD-SWLSCSKDSA-N 1 2 324.396 2.037 20 10 DECDLO CC[C@H](C(=O)NCc1c(O)cccc1F)[N@H+]1CCO[C@@H](CC)C1 ZINC000928709020 693831450 /nfs/dbraw/zinc/83/14/50/693831450.db2.gz VTJWUJNJQFZWBD-SWLSCSKDSA-N 1 2 324.396 2.037 20 10 DECDLO Cn1c[nH+]cc1CCC(=O)NCc1ccc(N2CCCC2)cc1 ZINC000193373880 685038873 /nfs/dbraw/zinc/03/88/73/685038873.db2.gz WTZPNZDNXYFDOX-UHFFFAOYSA-N 1 2 312.417 2.269 20 10 DECDLO CN1C[C@H]([N@H+](C)Cc2cc(Cl)cc(F)c2O)CCC1=O ZINC000862428180 686300905 /nfs/dbraw/zinc/30/09/05/686300905.db2.gz MTSUOJYTGFWBQB-LLVKDONJSA-N 1 2 300.761 2.237 20 10 DECDLO CN1C[C@H]([N@@H+](C)Cc2cc(Cl)cc(F)c2O)CCC1=O ZINC000862428180 686300913 /nfs/dbraw/zinc/30/09/13/686300913.db2.gz MTSUOJYTGFWBQB-LLVKDONJSA-N 1 2 300.761 2.237 20 10 DECDLO Oc1c(F)c(F)ccc1C[NH2+]C[C@H](n1cncn1)C(F)(F)F ZINC000877673473 690186031 /nfs/dbraw/zinc/18/60/31/690186031.db2.gz GECTUDRNBVKALQ-VIFPVBQESA-N 1 2 322.237 2.155 20 10 DECDLO O=C(NCC1C[NH+](Cc2c(O)cccc2Cl)C1)C(F)(F)F ZINC000877777229 690224401 /nfs/dbraw/zinc/22/44/01/690224401.db2.gz RHFFTTIFHFKNNL-UHFFFAOYSA-N 1 2 322.714 2.156 20 10 DECDLO Cc1nc([C@H]2CCCC[N@@H+]2Cc2c(O)cc(O)cc2O)no1 ZINC001144509325 790941284 /nfs/dbraw/zinc/94/12/84/790941284.db2.gz SQQONDMWUYNDQC-GFCCVEGCSA-N 1 2 305.334 2.222 20 10 DECDLO Cc1nc([C@H]2CCCC[N@H+]2Cc2c(O)cc(O)cc2O)no1 ZINC001144509325 790941288 /nfs/dbraw/zinc/94/12/88/790941288.db2.gz SQQONDMWUYNDQC-GFCCVEGCSA-N 1 2 305.334 2.222 20 10 DECDLO Cc1nc(N2CC=C(CCNC(=O)C3CC3)CC2)c(C)c(C)[nH+]1 ZINC001089803914 783459822 /nfs/dbraw/zinc/45/98/22/783459822.db2.gz YPJPWAYSUMMFAT-UHFFFAOYSA-N 1 2 314.433 2.455 20 10 DECDLO OC[C@H]1C[C@@H]([NH2+]Cc2cc(Br)cc(F)c2O)C1 ZINC000715761832 792511197 /nfs/dbraw/zinc/51/11/97/792511197.db2.gz UXQVAYUOJKJJSI-WKFQBHICSA-N 1 2 304.159 2.154 20 10 DECDLO Cn1ccc(C[NH2+]Cc2cc(Br)cc(F)c2O)n1 ZINC000715804266 792524069 /nfs/dbraw/zinc/52/40/69/792524069.db2.gz OUDFTAVTHYYRGH-UHFFFAOYSA-N 1 2 314.158 2.317 20 10 DECDLO COc1ccc(C[N@@H+]2CC[C@@H]([NH3+])[C@@H](F)CC2)c([O-])c1Cl ZINC001206201589 793734225 /nfs/dbraw/zinc/73/42/25/793734225.db2.gz XXOHHHZBHMNSPE-WDEREUQCSA-N 1 2 302.777 2.315 20 10 DECDLO COc1ccc(C[N@H+]2CC[C@@H]([NH3+])[C@@H](F)CC2)c([O-])c1Cl ZINC001206201589 793734232 /nfs/dbraw/zinc/73/42/32/793734232.db2.gz XXOHHHZBHMNSPE-WDEREUQCSA-N 1 2 302.777 2.315 20 10 DECDLO O=S1CC2(C[NH+](Cc3ccc(N4CCCCC4)cc3)C2)C1 ZINC001138215692 796183997 /nfs/dbraw/zinc/18/39/97/796183997.db2.gz PQHCFPZFSGXADL-UHFFFAOYSA-N 1 2 304.459 2.241 20 10 DECDLO Cc1ccc(C[N@@H+]2CCN(C(=O)OC(C)(C)C)C(=O)C2)c(O)c1 ZINC001140950753 796606327 /nfs/dbraw/zinc/60/63/27/796606327.db2.gz GUTZSFDILQTXEV-UHFFFAOYSA-N 1 2 320.389 2.280 20 10 DECDLO Cc1ccc(C[N@H+]2CCN(C(=O)OC(C)(C)C)C(=O)C2)c(O)c1 ZINC001140950753 796606329 /nfs/dbraw/zinc/60/63/29/796606329.db2.gz GUTZSFDILQTXEV-UHFFFAOYSA-N 1 2 320.389 2.280 20 10 DECDLO Oc1ccc(O)c(CN2CC[C@H]([NH+]3CCCC3)C(F)(F)C2)c1 ZINC001141162774 796643342 /nfs/dbraw/zinc/64/33/42/796643342.db2.gz CYHPKFMCGQHTSS-HNNXBMFYSA-N 1 2 312.360 2.403 20 10 DECDLO CCOC[C@@H]1C[N@H+](Cc2ccccc2O)Cc2nnn(CC)c21 ZINC001203551538 800076480 /nfs/dbraw/zinc/07/64/80/800076480.db2.gz HKRZSJKXQHDANI-AWEZNQCLSA-N 1 2 316.405 2.140 20 10 DECDLO CCOC[C@@H]1C[N@@H+](Cc2ccccc2O)Cc2nnn(CC)c21 ZINC001203551538 800076488 /nfs/dbraw/zinc/07/64/88/800076488.db2.gz HKRZSJKXQHDANI-AWEZNQCLSA-N 1 2 316.405 2.140 20 10 DECDLO COc1cccc(C[N@@H+]2CC[C@@](O)(C(F)(F)F)[C@H](F)C2)c1O ZINC001203584909 800083803 /nfs/dbraw/zinc/08/38/03/800083803.db2.gz JSSWZODEERVHBT-YPMHNXCESA-N 1 2 323.286 2.238 20 10 DECDLO COc1cccc(C[N@H+]2CC[C@@](O)(C(F)(F)F)[C@H](F)C2)c1O ZINC001203584909 800083806 /nfs/dbraw/zinc/08/38/06/800083806.db2.gz JSSWZODEERVHBT-YPMHNXCESA-N 1 2 323.286 2.238 20 10 DECDLO COc1ccc(O)c(C[N@@H+]2CCc3nc(Cl)ncc3C2)c1 ZINC001203678355 800105468 /nfs/dbraw/zinc/10/54/68/800105468.db2.gz LZVPNZDYBHOVAJ-UHFFFAOYSA-N 1 2 305.765 2.403 20 10 DECDLO COc1ccc(O)c(C[N@H+]2CCc3nc(Cl)ncc3C2)c1 ZINC001203678355 800105471 /nfs/dbraw/zinc/10/54/71/800105471.db2.gz LZVPNZDYBHOVAJ-UHFFFAOYSA-N 1 2 305.765 2.403 20 10 DECDLO COC(=O)[C@H](C(C)C)[N@H+](C)Cc1ccc(N(C)C)cc1OC ZINC001231855600 801738884 /nfs/dbraw/zinc/73/88/84/801738884.db2.gz WVJYQNIBXSGNTE-INIZCTEOSA-N 1 2 308.422 2.391 20 10 DECDLO COC(=O)[C@H](C(C)C)[N@@H+](C)Cc1ccc(N(C)C)cc1OC ZINC001231855600 801738887 /nfs/dbraw/zinc/73/88/87/801738887.db2.gz WVJYQNIBXSGNTE-INIZCTEOSA-N 1 2 308.422 2.391 20 10 DECDLO Cc1cc(O)c(C[N@@H+]2Cc3ccnn3CC[C@H]2CO)cc1Cl ZINC001231871204 801742221 /nfs/dbraw/zinc/74/22/21/801742221.db2.gz FLAGUAPFZISAFM-AWEZNQCLSA-N 1 2 321.808 2.317 20 10 DECDLO Cc1cc(O)c(C[N@H+]2Cc3ccnn3CC[C@H]2CO)cc1Cl ZINC001231871204 801742225 /nfs/dbraw/zinc/74/22/25/801742225.db2.gz FLAGUAPFZISAFM-AWEZNQCLSA-N 1 2 321.808 2.317 20 10 DECDLO CN1C(=O)CC[C@@H]2C[N@@H+](Cc3cccc(Cl)c3O)CC[C@@H]21 ZINC001231913911 801749730 /nfs/dbraw/zinc/74/97/30/801749730.db2.gz UERFYRQVMVNXHV-RISCZKNCSA-N 1 2 308.809 2.488 20 10 DECDLO CN1C(=O)CC[C@@H]2C[N@H+](Cc3cccc(Cl)c3O)CC[C@@H]21 ZINC001231913911 801749733 /nfs/dbraw/zinc/74/97/33/801749733.db2.gz UERFYRQVMVNXHV-RISCZKNCSA-N 1 2 308.809 2.488 20 10 DECDLO COc1ccnc(C[N@@H+]2CCCc3cc(O)c(O)cc3C2)c1 ZINC001231969660 801760579 /nfs/dbraw/zinc/76/05/79/801760579.db2.gz PKBIXUITJFEQHW-UHFFFAOYSA-N 1 2 300.358 2.450 20 10 DECDLO COc1ccnc(C[N@H+]2CCCc3cc(O)c(O)cc3C2)c1 ZINC001231969660 801760580 /nfs/dbraw/zinc/76/05/80/801760580.db2.gz PKBIXUITJFEQHW-UHFFFAOYSA-N 1 2 300.358 2.450 20 10 DECDLO CN(Cc1c(O)cc(Br)cc1F)[C@@H]1CC[N@H+](C)C1 ZINC001233031650 802008128 /nfs/dbraw/zinc/00/81/28/802008128.db2.gz JZSGIOFDFGCYFK-SNVBAGLBSA-N 1 2 317.202 2.430 20 10 DECDLO CN(Cc1c(O)cc(Br)cc1F)[C@@H]1CC[N@@H+](C)C1 ZINC001233031650 802008135 /nfs/dbraw/zinc/00/81/35/802008135.db2.gz JZSGIOFDFGCYFK-SNVBAGLBSA-N 1 2 317.202 2.430 20 10 DECDLO COc1cc(Cl)cc(C[N@@H+]2C[C@@H](F)C[C@H](CO)C2)c1O ZINC001233287944 802064413 /nfs/dbraw/zinc/06/44/13/802064413.db2.gz OJOBIYOQFKXEQY-CABZTGNLSA-N 1 2 303.761 2.207 20 10 DECDLO COc1cc(Cl)cc(C[N@H+]2C[C@@H](F)C[C@H](CO)C2)c1O ZINC001233287944 802064417 /nfs/dbraw/zinc/06/44/17/802064417.db2.gz OJOBIYOQFKXEQY-CABZTGNLSA-N 1 2 303.761 2.207 20 10 DECDLO O=C(N1CCCC1)C12CC(C1)C[N@H+]2Cc1c(O)ccc(F)c1F ZINC001233333745 802078859 /nfs/dbraw/zinc/07/88/59/802078859.db2.gz GLRRTNIPELBCQD-UHFFFAOYSA-N 1 2 322.355 2.257 20 10 DECDLO O=C(N1CCCC1)C12CC(C1)C[N@@H+]2Cc1c(O)ccc(F)c1F ZINC001233333745 802078868 /nfs/dbraw/zinc/07/88/68/802078868.db2.gz GLRRTNIPELBCQD-UHFFFAOYSA-N 1 2 322.355 2.257 20 10 DECDLO CC(C)CC[C@@H](CO)[NH2+][C@@H](C)c1cccc(-c2nn[nH]n2)c1O ZINC001603278653 1069929050 /nfs/dbraw/zinc/92/90/50/1069929050.db2.gz RZEGMLNYZKUPGD-RYUDHWBXSA-N 1 2 319.409 2.020 20 10 DECDLO CCC(CC)(CO)C[NH2+][C@@H](C)c1cccc(-c2nn[nH]n2)c1O ZINC001604020307 1070178230 /nfs/dbraw/zinc/17/82/30/1070178230.db2.gz WAEQSOYCDKMWBM-NSHDSACASA-N 1 2 319.409 2.022 20 10 DECDLO Oc1c(F)cccc1C[NH2+]Cc1ccc(-c2nn[nH]n2)s1 ZINC001607111103 1071305673 /nfs/dbraw/zinc/30/56/73/1071305673.db2.gz NMIIUDLPVDVDCF-UHFFFAOYSA-N 1 2 305.338 2.063 20 10 DECDLO C[N@H+](CC(=O)NCc1ccco1)Cc1cc(F)c(F)cc1O ZINC001461898872 1058735267 /nfs/dbraw/zinc/73/52/67/1058735267.db2.gz LSPUEMLMOJUARF-UHFFFAOYSA-N 1 2 310.300 2.012 20 10 DECDLO C[N@@H+](CC(=O)NCc1ccco1)Cc1cc(F)c(F)cc1O ZINC001461898872 1058735288 /nfs/dbraw/zinc/73/52/88/1058735288.db2.gz LSPUEMLMOJUARF-UHFFFAOYSA-N 1 2 310.300 2.012 20 10 DECDLO Cn1cc(CN2CC[NH+](Cc3ccc(Cl)cc3O)CC2)cn1 ZINC001560661187 1075144902 /nfs/dbraw/zinc/14/49/02/1075144902.db2.gz OPEUECGVZQJJLL-UHFFFAOYSA-N 1 2 320.824 2.097 20 10 DECDLO CC(C)(C)[C@@H](Cn1cc[nH+]c1)NC(=O)c1cccc(O)c1O ZINC001583317941 1076254741 /nfs/dbraw/zinc/25/47/41/1076254741.db2.gz ZGCLOCXANOKZNY-CYBMUJFWSA-N 1 2 303.362 2.139 20 10 DECDLO CC[C@H]([NH2+]CCCOC(C)C)c1cccc(-c2nn[nH]n2)c1O ZINC001590467604 1076634263 /nfs/dbraw/zinc/63/42/63/1076634263.db2.gz RDGQGBQJNRLXEF-AWEZNQCLSA-N 1 2 319.409 2.428 20 10 DECDLO CC[C@H]([NH2+][C@H]1C[C@@H](COC)C1)c1cccc(-c2nn[nH]n2)c1O ZINC001590471564 1076635780 /nfs/dbraw/zinc/63/57/80/1076635780.db2.gz IZLXNZFJGKQASK-WDMOLILDSA-N 1 2 317.393 2.038 20 10 DECDLO COCCCCC[NH2+][C@H](C)c1cccc(-c2nn[nH]n2)c1O ZINC001591410655 1076742138 /nfs/dbraw/zinc/74/21/38/1076742138.db2.gz FXNCJDGXGBECIQ-LLVKDONJSA-N 1 2 305.382 2.040 20 10 DECDLO CNC(=O)[C@H](Cc1ccccc1)[NH2+]Cc1cccc(Cl)c1O ZINC001659447369 1080241476 /nfs/dbraw/zinc/24/14/76/1080241476.db2.gz WOXSODYXROVAHQ-HNNXBMFYSA-N 1 2 318.804 2.493 20 10 DECDLO C[C@]1(CO)C[N@@H+](Cc2c(O)ccc(Cl)c2Cl)CC[C@H]1O ZINC001237077307 1080441415 /nfs/dbraw/zinc/44/14/15/1080441415.db2.gz FJDRKJULCWHFGR-TZMCWYRMSA-N 1 2 320.216 2.264 20 10 DECDLO CC(=O)N(C)[C@H]1CC[N@H+](Cc2cc(F)c(Cl)cc2O)C1 ZINC001237940871 1080501432 /nfs/dbraw/zinc/50/14/32/1080501432.db2.gz OQVOSWAOUXWMSP-NSHDSACASA-N 1 2 300.761 2.237 20 10 DECDLO CC(=O)N(C)[C@H]1CC[N@@H+](Cc2cc(F)c(Cl)cc2O)C1 ZINC001237940871 1080501440 /nfs/dbraw/zinc/50/14/40/1080501440.db2.gz OQVOSWAOUXWMSP-NSHDSACASA-N 1 2 300.761 2.237 20 10 DECDLO NC(=O)c1cc2c([nH]1)C[N@H+](Cc1cc(Cl)ccc1O)CC2 ZINC001277458849 1083981476 /nfs/dbraw/zinc/98/14/76/1083981476.db2.gz XJFWGWYDSWOWKV-UHFFFAOYSA-N 1 2 305.765 2.031 20 10 DECDLO NC(=O)c1cc2c([nH]1)C[N@@H+](Cc1cc(Cl)ccc1O)CC2 ZINC001277458849 1083981492 /nfs/dbraw/zinc/98/14/92/1083981492.db2.gz XJFWGWYDSWOWKV-UHFFFAOYSA-N 1 2 305.765 2.031 20 10 DECDLO Cc1cc(F)cc(C[NH+]2CC3(CCN3C(=O)NC(C)C)C2)c1O ZINC001277519539 1084013159 /nfs/dbraw/zinc/01/31/59/1084013159.db2.gz AJSRHCMIZMGUPD-UHFFFAOYSA-N 1 2 321.396 2.218 20 10 DECDLO CCN(CC)c1ccc(C[NH2+][C@@H](Cc2c[nH+]c[nH]2)C(=O)[O-])cc1 ZINC001332485940 1126177155 /nfs/dbraw/zinc/17/71/55/1126177155.db2.gz MKEWOQFVAQWPPR-INIZCTEOSA-N 1 2 316.405 2.041 20 10 DECDLO CCCOc1ccc(C[NH2+][C@@H](Cc2c[nH+]c[nH]2)C(=O)[O-])cc1C ZINC001334845086 1126179694 /nfs/dbraw/zinc/17/96/94/1126179694.db2.gz RREANUGNAOMENG-HNNXBMFYSA-N 1 2 317.389 2.292 20 10 DECDLO CC(C)(C)OC(=O)NCC[NH2+]Cc1cc(F)cc(F)c1O ZINC000708501696 1086679964 /nfs/dbraw/zinc/67/99/64/1086679964.db2.gz HIKWGBMSDDTBII-UHFFFAOYSA-N 1 2 302.321 2.285 20 10 DECDLO COc1ccc(C[N@@H+]2CCC[C@@]3(CCNC3=O)C2)c(O)c1Cl ZINC001236802938 1138432573 /nfs/dbraw/zinc/43/25/73/1138432573.db2.gz WTGCMDLKWPCWOM-MRXNPFEDSA-N 1 2 324.808 2.156 20 10 DECDLO COc1ccc(C[N@H+]2CCC[C@@]3(CCNC3=O)C2)c(O)c1Cl ZINC001236802938 1138432583 /nfs/dbraw/zinc/43/25/83/1138432583.db2.gz WTGCMDLKWPCWOM-MRXNPFEDSA-N 1 2 324.808 2.156 20 10 DECDLO COc1cc(O)c(C[NH+]2CCN(CC(F)F)CC2)c(Cl)c1 ZINC001236807408 1138434862 /nfs/dbraw/zinc/43/48/62/1138434862.db2.gz GCRAKELWWWOMFS-UHFFFAOYSA-N 1 2 320.767 2.437 20 10 DECDLO COc1cc(O)c(C[N@@H+]2CCN(C(C)=O)[C@@H](C)C2)c(Cl)c1 ZINC001236809668 1138436013 /nfs/dbraw/zinc/43/60/13/1138436013.db2.gz XFNKKDDBHRPYEJ-JTQLQIEISA-N 1 2 312.797 2.107 20 10 DECDLO COc1cc(O)c(C[N@H+]2CCN(C(C)=O)[C@@H](C)C2)c(Cl)c1 ZINC001236809668 1138436023 /nfs/dbraw/zinc/43/60/23/1138436023.db2.gz XFNKKDDBHRPYEJ-JTQLQIEISA-N 1 2 312.797 2.107 20 10 DECDLO OC[C@@H]1C[C@@H](F)C[N@H+](Cc2c(O)cccc2OC(F)(F)F)C1 ZINC001237120580 1138508210 /nfs/dbraw/zinc/50/82/10/1138508210.db2.gz QPDXQRNAHXMRTN-NXEZZACHSA-N 1 2 323.286 2.443 20 10 DECDLO OC[C@@H]1C[C@@H](F)C[N@@H+](Cc2c(O)cccc2OC(F)(F)F)C1 ZINC001237120580 1138508214 /nfs/dbraw/zinc/50/82/14/1138508214.db2.gz QPDXQRNAHXMRTN-NXEZZACHSA-N 1 2 323.286 2.443 20 10 DECDLO CCOC(=O)[C@H](F)C1C[NH+](Cc2cc(F)c(F)cc2O)C1 ZINC001308786006 1147486563 /nfs/dbraw/zinc/48/65/63/1147486563.db2.gz VEGALWBPXBDYGY-CYBMUJFWSA-N 1 2 303.280 2.003 20 10 DECDLO CCN(CC)c1ccc(C[N@@H+]2CCO[C@H](CC(=O)OC)C2)cc1 ZINC000093458739 193255481 /nfs/dbraw/zinc/25/54/81/193255481.db2.gz NMHABOFSZQECBK-QGZVFWFLSA-N 1 2 320.433 2.297 20 10 DECDLO CCN(CC)c1ccc(C[N@H+]2CCO[C@H](CC(=O)OC)C2)cc1 ZINC000093458739 193255482 /nfs/dbraw/zinc/25/54/82/193255482.db2.gz NMHABOFSZQECBK-QGZVFWFLSA-N 1 2 320.433 2.297 20 10 DECDLO C[C@@H]([C@H](C)S(C)(=O)=O)[N@H+](C)Cc1cc(Cl)c(F)cc1O ZINC000295455603 296220627 /nfs/dbraw/zinc/22/06/27/296220627.db2.gz VLXHKJGPZCVLRK-IUCAKERBSA-N 1 2 323.817 2.438 20 10 DECDLO C[C@@H]([C@H](C)S(C)(=O)=O)[N@@H+](C)Cc1cc(Cl)c(F)cc1O ZINC000295455603 296220630 /nfs/dbraw/zinc/22/06/30/296220630.db2.gz VLXHKJGPZCVLRK-IUCAKERBSA-N 1 2 323.817 2.438 20 10 DECDLO C[C@@H]1CN(C(=O)C=Cc2c[nH]c[nH+]2)c2ccccc2N(C)C1=O ZINC000492900957 249168386 /nfs/dbraw/zinc/16/83/86/249168386.db2.gz OFZONXSTWCBQCZ-ABZNLYFFSA-N 1 2 310.357 2.069 20 10 DECDLO CN1CC[C@H]([N@H+](C)Cc2cc(Cl)cc(Cl)c2O)C1=O ZINC000271204243 403278229 /nfs/dbraw/zinc/27/82/29/403278229.db2.gz QVWGZWNMRGGBJK-NSHDSACASA-N 1 2 303.189 2.362 20 10 DECDLO CN1CC[C@H]([N@@H+](C)Cc2cc(Cl)cc(Cl)c2O)C1=O ZINC000271204243 403278230 /nfs/dbraw/zinc/27/82/30/403278230.db2.gz QVWGZWNMRGGBJK-NSHDSACASA-N 1 2 303.189 2.362 20 10 DECDLO C[C@@H](O)CNc1cc(NCc2ccc(N(C)C)c(F)c2)nc[nH+]1 ZINC000298206851 403331618 /nfs/dbraw/zinc/33/16/18/403331618.db2.gz IPSNPMJVPFRHAF-LLVKDONJSA-N 1 2 319.384 2.087 20 10 DECDLO C[C@@H](O)CNc1cc(NCc2ccc(N(C)C)c(F)c2)[nH+]cn1 ZINC000298206851 403331621 /nfs/dbraw/zinc/33/16/21/403331621.db2.gz IPSNPMJVPFRHAF-LLVKDONJSA-N 1 2 319.384 2.087 20 10 DECDLO C[C@H]([NH2+][C@H]1CCCN(CCCO)C1)c1cc(F)cc(F)c1O ZINC000834849554 649854321 /nfs/dbraw/zinc/85/43/21/649854321.db2.gz BYTQORKBYHGXCC-AAEUAGOBSA-N 1 2 314.376 2.168 20 10 DECDLO C[C@H]1C[N@@H+](Cc2cc(F)cc(F)c2O)C[C@]2(CCCOC2)O1 ZINC001350320541 1151344124 /nfs/dbraw/zinc/34/41/24/1151344124.db2.gz ZXVBVXNEGDCUMR-ZBEGNZNMSA-N 1 2 313.344 2.440 20 10 DECDLO CN(C)c1ccc(C[NH+]2CCN(C(=O)c3ccccn3)CC2)cc1 ZINC000179516303 522182737 /nfs/dbraw/zinc/18/27/37/522182737.db2.gz BVZSWNXBVHYLIX-UHFFFAOYSA-N 1 2 324.428 2.106 20 10 DECDLO Cc1cc(CN2CC[NH+](Cc3cc(F)ccc3O)CC2)on1 ZINC000179894297 524697225 /nfs/dbraw/zinc/69/72/25/524697225.db2.gz NJJVREFPKJYBJB-UHFFFAOYSA-N 1 2 305.353 2.146 20 10 DECDLO CC(=O)c1cc(Cl)cc(C[N@@H+]2CC[C@H](n3cncn3)C2)c1O ZINC000368888797 527207250 /nfs/dbraw/zinc/20/72/50/527207250.db2.gz NFYDHNGISVJNQC-ZDUSSCGKSA-N 1 2 320.780 2.287 20 10 DECDLO CC(=O)c1cc(Cl)cc(C[N@H+]2CC[C@H](n3cncn3)C2)c1O ZINC000368888797 527207254 /nfs/dbraw/zinc/20/72/54/527207254.db2.gz NFYDHNGISVJNQC-ZDUSSCGKSA-N 1 2 320.780 2.287 20 10 DECDLO C[C@H](C(=O)NCc1cccc(Cl)c1O)[NH+]1CCSCC1 ZINC000890759596 623197701 /nfs/dbraw/zinc/19/77/01/623197701.db2.gz DJEPVMFEWPKFOX-SNVBAGLBSA-N 1 2 314.838 2.099 20 10 DECDLO COc1ccc(O)c([C@H](C)NC(=O)[C@H]2CCn3cc[nH+]c3C2)c1 ZINC000161404291 625040206 /nfs/dbraw/zinc/04/02/06/625040206.db2.gz NSPFDJNSGJVSIL-RYUDHWBXSA-N 1 2 315.373 2.037 20 10 DECDLO c1cc2c(cc1C[NH2+]Cc1noc3c1COCC3)CCCO2 ZINC000923017558 636916815 /nfs/dbraw/zinc/91/68/15/636916815.db2.gz GSHFCAUINGWTTP-UHFFFAOYSA-N 1 2 300.358 2.362 20 10 DECDLO C[C@@H]1[C@H](O)CC[N@@H+]1Cc1cc(Br)cc(F)c1O ZINC000894917184 637329229 /nfs/dbraw/zinc/32/92/29/637329229.db2.gz KYTCYGRFVNKLNS-RDDDGLTNSA-N 1 2 304.159 2.249 20 10 DECDLO C[C@@H]1[C@H](O)CC[N@H+]1Cc1cc(Br)cc(F)c1O ZINC000894917184 637329235 /nfs/dbraw/zinc/32/92/35/637329235.db2.gz KYTCYGRFVNKLNS-RDDDGLTNSA-N 1 2 304.159 2.249 20 10 DECDLO Cc1cc(O)c(C[NH+]2CCN(C(=O)C3CC3)CC2)c(Cl)c1 ZINC000840910643 650377926 /nfs/dbraw/zinc/37/79/26/650377926.db2.gz UXZHGYISFCPLBV-UHFFFAOYSA-N 1 2 308.809 2.408 20 10 DECDLO COc1ccc(O)c(CNC(=O)Nc2cc(C)[nH+]cc2C)c1 ZINC000767947732 641034977 /nfs/dbraw/zinc/03/49/77/641034977.db2.gz PQPRFIUXMKLVRY-UHFFFAOYSA-N 1 2 301.346 2.156 20 10 DECDLO COc1cccc(O)c1C[N@H+](C)CC(=O)Nc1cc(C)ccn1 ZINC000769230135 641200076 /nfs/dbraw/zinc/20/00/76/641200076.db2.gz ZNNUWMZHLBISTI-UHFFFAOYSA-N 1 2 315.373 2.175 20 10 DECDLO COc1cccc(O)c1C[N@@H+](C)CC(=O)Nc1cc(C)ccn1 ZINC000769230135 641200080 /nfs/dbraw/zinc/20/00/80/641200080.db2.gz ZNNUWMZHLBISTI-UHFFFAOYSA-N 1 2 315.373 2.175 20 10 DECDLO COc1cccc(O)c1C[N@H+](C)CC(=O)NCc1cccs1 ZINC000769427101 641238175 /nfs/dbraw/zinc/23/81/75/641238175.db2.gz GLEXMSWVCNHIMA-UHFFFAOYSA-N 1 2 320.414 2.211 20 10 DECDLO COc1cccc(O)c1C[N@@H+](C)CC(=O)NCc1cccs1 ZINC000769427101 641238194 /nfs/dbraw/zinc/23/81/94/641238194.db2.gz GLEXMSWVCNHIMA-UHFFFAOYSA-N 1 2 320.414 2.211 20 10 DECDLO CCOC(=O)[C@H]1C[N@H+](Cc2ccc(N(CC)CC)cc2)CCO1 ZINC000769467704 641245188 /nfs/dbraw/zinc/24/51/88/641245188.db2.gz QPJANIPHCJWHGB-QGZVFWFLSA-N 1 2 320.433 2.297 20 10 DECDLO CCOC(=O)[C@H]1C[N@@H+](Cc2ccc(N(CC)CC)cc2)CCO1 ZINC000769467704 641245195 /nfs/dbraw/zinc/24/51/95/641245195.db2.gz QPJANIPHCJWHGB-QGZVFWFLSA-N 1 2 320.433 2.297 20 10 DECDLO CCc1cc(C[NH2+]Cc2ccc([N+](=O)[O-])c(OC)c2O)on1 ZINC000774940949 641983907 /nfs/dbraw/zinc/98/39/07/641983907.db2.gz FSMHOOAXCULRTM-UHFFFAOYSA-N 1 2 307.306 2.149 20 10 DECDLO C[C@@H](NC(=O)[C@H]1CCn2cc[nH+]c2C1)c1ccc(N(C)C)cc1 ZINC000775405814 642040404 /nfs/dbraw/zinc/04/04/04/642040404.db2.gz VKERCJRXKGAKFT-HIFRSBDPSA-N 1 2 312.417 2.389 20 10 DECDLO Cc1ccc(NC(=O)c2ccc(C)c(O)c2O)c(N(C)C)[nH+]1 ZINC000780994730 642700615 /nfs/dbraw/zinc/70/06/15/642700615.db2.gz ZKHNWAKMWYDMJU-UHFFFAOYSA-N 1 2 301.346 2.428 20 10 DECDLO C[N@H+](Cc1ncnn1CC(F)F)Cc1cc2c(cc1O)CCC2 ZINC000782991008 642951293 /nfs/dbraw/zinc/95/12/93/642951293.db2.gz MFJGFJFQTRQSQR-UHFFFAOYSA-N 1 2 322.359 2.370 20 10 DECDLO C[N@@H+](Cc1ncnn1CC(F)F)Cc1cc2c(cc1O)CCC2 ZINC000782991008 642951295 /nfs/dbraw/zinc/95/12/95/642951295.db2.gz MFJGFJFQTRQSQR-UHFFFAOYSA-N 1 2 322.359 2.370 20 10 DECDLO COCC[N@H+](Cc1ccnn1C)Cc1ccc(N(C)C)c(F)c1 ZINC000787330611 643482374 /nfs/dbraw/zinc/48/23/74/643482374.db2.gz CRDJASDNUPYESF-UHFFFAOYSA-N 1 2 320.412 2.274 20 10 DECDLO COCC[N@@H+](Cc1ccnn1C)Cc1ccc(N(C)C)c(F)c1 ZINC000787330611 643482380 /nfs/dbraw/zinc/48/23/80/643482380.db2.gz CRDJASDNUPYESF-UHFFFAOYSA-N 1 2 320.412 2.274 20 10 DECDLO COC(=O)C[N@H+](CCC[C@@H](C)O)Cc1cc(Cl)ccc1O ZINC000789347494 643720179 /nfs/dbraw/zinc/72/01/79/643720179.db2.gz FURVPBIBJGYHPK-LLVKDONJSA-N 1 2 315.797 2.182 20 10 DECDLO COC(=O)C[N@@H+](CCC[C@@H](C)O)Cc1cc(Cl)ccc1O ZINC000789347494 643720186 /nfs/dbraw/zinc/72/01/86/643720186.db2.gz FURVPBIBJGYHPK-LLVKDONJSA-N 1 2 315.797 2.182 20 10 DECDLO CCn1nccc1C[N@H+](CCO)Cc1cccc(Cl)c1O ZINC000793304042 644231338 /nfs/dbraw/zinc/23/13/38/644231338.db2.gz JBZSIGVLAQUQFL-UHFFFAOYSA-N 1 2 309.797 2.257 20 10 DECDLO CCn1nccc1C[N@@H+](CCO)Cc1cccc(Cl)c1O ZINC000793304042 644231340 /nfs/dbraw/zinc/23/13/40/644231340.db2.gz JBZSIGVLAQUQFL-UHFFFAOYSA-N 1 2 309.797 2.257 20 10 DECDLO COc1cccc(CNC(=O)Nc2ccn3cc[nH+]c3c2)c1O ZINC000798197653 644982524 /nfs/dbraw/zinc/98/25/24/644982524.db2.gz GLXIWZYCZHGJQS-UHFFFAOYSA-N 1 2 312.329 2.370 20 10 DECDLO CS(=O)(=O)[C@H]1CCC[N@H+](Cc2cccc(Cl)c2O)CC1 ZINC000800535054 645285363 /nfs/dbraw/zinc/28/53/63/645285363.db2.gz YLZHYRQKHJHQAT-LBPRGKRZSA-N 1 2 317.838 2.445 20 10 DECDLO CS(=O)(=O)[C@H]1CCC[N@@H+](Cc2cccc(Cl)c2O)CC1 ZINC000800535054 645285364 /nfs/dbraw/zinc/28/53/64/645285364.db2.gz YLZHYRQKHJHQAT-LBPRGKRZSA-N 1 2 317.838 2.445 20 10 DECDLO C[C@H]([NH2+]Cc1cc(Cl)cc(F)c1O)C1(S(C)(=O)=O)CC1 ZINC000809703151 646266197 /nfs/dbraw/zinc/26/61/97/646266197.db2.gz GCBJYORBIUMMBE-QMMMGPOBSA-N 1 2 321.801 2.240 20 10 DECDLO CC1(C)C[NH+](CC(=O)NCc2c(O)ccc3c2CCCC3)C1 ZINC000816939035 647201328 /nfs/dbraw/zinc/20/13/28/647201328.db2.gz RANCTVXHCAWYHV-UHFFFAOYSA-N 1 2 302.418 2.229 20 10 DECDLO C[C@@H]1C[N@@H+](C[C@@H]2CCCN2C(=O)C2=CC(=O)CS2)C[C@H](C)O1 ZINC000731871443 647516205 /nfs/dbraw/zinc/51/62/05/647516205.db2.gz LBRXOGFEZZABEU-XQQFMLRXSA-N 1 2 324.446 2.168 20 10 DECDLO C[C@@H]1C[N@H+](C[C@@H]2CCCN2C(=O)C2=CC(=O)CS2)C[C@H](C)O1 ZINC000731871443 647516208 /nfs/dbraw/zinc/51/62/08/647516208.db2.gz LBRXOGFEZZABEU-XQQFMLRXSA-N 1 2 324.446 2.168 20 10 DECDLO CCOC(=O)CN(Cc1c[nH+]cn1CC)Cc1ccccc1O ZINC000822516708 648223604 /nfs/dbraw/zinc/22/36/04/648223604.db2.gz OOKQNIYYPOEYEI-UHFFFAOYSA-N 1 2 317.389 2.174 20 10 DECDLO CCOC(=O)C[N@H+](C)Cc1ccc(Br)cc1O ZINC000824556436 648609182 /nfs/dbraw/zinc/60/91/82/648609182.db2.gz TZKPWFAQJNTRIY-UHFFFAOYSA-N 1 2 302.168 2.150 20 10 DECDLO CCOC(=O)C[N@@H+](C)Cc1ccc(Br)cc1O ZINC000824556436 648609184 /nfs/dbraw/zinc/60/91/84/648609184.db2.gz TZKPWFAQJNTRIY-UHFFFAOYSA-N 1 2 302.168 2.150 20 10 DECDLO Oc1c(Cl)cccc1C[N@@H+]1C[C@H](O)C[C@@H]1[C@H]1CCCOC1 ZINC000824655713 648630889 /nfs/dbraw/zinc/63/08/89/648630889.db2.gz ZKZBQCXUUKINHU-GZBFAFLISA-N 1 2 311.809 2.407 20 10 DECDLO Oc1c(Cl)cccc1C[N@H+]1C[C@H](O)C[C@@H]1[C@H]1CCCOC1 ZINC000824655713 648630891 /nfs/dbraw/zinc/63/08/91/648630891.db2.gz ZKZBQCXUUKINHU-GZBFAFLISA-N 1 2 311.809 2.407 20 10 DECDLO OC[C@@]1(F)CC[N@H+](Cc2ccc(Br)cc2O)C1 ZINC000825811426 648813988 /nfs/dbraw/zinc/81/39/88/648813988.db2.gz HGDWAUSBIGLSIV-GFCCVEGCSA-N 1 2 304.159 2.061 20 10 DECDLO OC[C@@]1(F)CC[N@@H+](Cc2ccc(Br)cc2O)C1 ZINC000825811426 648813989 /nfs/dbraw/zinc/81/39/89/648813989.db2.gz HGDWAUSBIGLSIV-GFCCVEGCSA-N 1 2 304.159 2.061 20 10 DECDLO O=C1OCCN1[C@@H]1CC[N@@H+](Cc2cc(Cl)c(F)cc2O)C1 ZINC000827000750 648959461 /nfs/dbraw/zinc/95/94/61/648959461.db2.gz NPJPUMYPDZYPNG-SNVBAGLBSA-N 1 2 314.744 2.211 20 10 DECDLO O=C1OCCN1[C@@H]1CC[N@H+](Cc2cc(Cl)c(F)cc2O)C1 ZINC000827000750 648959463 /nfs/dbraw/zinc/95/94/63/648959463.db2.gz NPJPUMYPDZYPNG-SNVBAGLBSA-N 1 2 314.744 2.211 20 10 DECDLO Cc1cc(O)c(C[NH+]2CCN(c3nccn3C)CC2)cc1Cl ZINC000827885323 649099136 /nfs/dbraw/zinc/09/91/36/649099136.db2.gz WZRFSOUZBLFDAN-UHFFFAOYSA-N 1 2 320.824 2.410 20 10 DECDLO COc1ccc(N(C)CC[N@H+](C)CN2CCSC2=O)cc1 ZINC000844725033 651160897 /nfs/dbraw/zinc/16/08/97/651160897.db2.gz HMNQIYDFGAZYDD-UHFFFAOYSA-N 1 2 309.435 2.190 20 10 DECDLO COc1ccc(N(C)CC[N@@H+](C)CN2CCSC2=O)cc1 ZINC000844725033 651160899 /nfs/dbraw/zinc/16/08/99/651160899.db2.gz HMNQIYDFGAZYDD-UHFFFAOYSA-N 1 2 309.435 2.190 20 10 DECDLO CN1CC[N@H+](Cc2c3c(ccc2O)oc2c3CCCC2)CC1=O ZINC000844731850 651162365 /nfs/dbraw/zinc/16/23/65/651162365.db2.gz UYMJGSBLGAQCIU-UHFFFAOYSA-N 1 2 314.385 2.291 20 10 DECDLO CN1CC[N@@H+](Cc2c3c(ccc2O)oc2c3CCCC2)CC1=O ZINC000844731850 651162367 /nfs/dbraw/zinc/16/23/67/651162367.db2.gz UYMJGSBLGAQCIU-UHFFFAOYSA-N 1 2 314.385 2.291 20 10 DECDLO C[C@H]([NH2+]CC[C@]1(O)CCCOC1)c1cc(F)cc(F)c1O ZINC000846210649 651315476 /nfs/dbraw/zinc/31/54/76/651315476.db2.gz AOLIYYMSMRYYPH-ZUZCIYMTSA-N 1 2 301.333 2.253 20 10 DECDLO C[C@@H]([NH2+][C@H]1CCc2c(nnn2C)C1)c1cc(F)cc(F)c1O ZINC000848564005 651471512 /nfs/dbraw/zinc/47/15/12/651471512.db2.gz GRPMTEDDPRZREP-SCZZXKLOSA-N 1 2 308.332 2.007 20 10 DECDLO CCc1cccc(C[N@H+](C)[C@@H](COC(C)C)C(=O)OC)c1O ZINC000848890868 651547822 /nfs/dbraw/zinc/54/78/22/651547822.db2.gz VCCFAQSFZZGOPW-HNNXBMFYSA-N 1 2 309.406 2.353 20 10 DECDLO CCc1cccc(C[N@@H+](C)[C@@H](COC(C)C)C(=O)OC)c1O ZINC000848890868 651547825 /nfs/dbraw/zinc/54/78/25/651547825.db2.gz VCCFAQSFZZGOPW-HNNXBMFYSA-N 1 2 309.406 2.353 20 10 DECDLO CN(C)c1cc(F)c(C[N@@H+]2C[C@@H]3CCC[C@@H]3[C@@H]2C(N)=O)cc1F ZINC000862338800 686278922 /nfs/dbraw/zinc/27/89/22/686278922.db2.gz UXEXAZYZNFXCND-KNHMANMVSA-N 1 2 323.387 2.117 20 10 DECDLO CN(C)c1cc(F)c(C[N@H+]2C[C@@H]3CCC[C@@H]3[C@@H]2C(N)=O)cc1F ZINC000862338800 686278924 /nfs/dbraw/zinc/27/89/24/686278924.db2.gz UXEXAZYZNFXCND-KNHMANMVSA-N 1 2 323.387 2.117 20 10 DECDLO COc1cccc([C@H]2CN(C(=O)C3=CC(=O)CS3)CC[NH2+]2)c1 ZINC000870151691 688499375 /nfs/dbraw/zinc/49/93/75/688499375.db2.gz BKTAHJJNCPLUOB-CQSZACIVSA-N 1 2 318.398 2.249 20 10 DECDLO O=C(C1=CC(=O)CS1)N1CC[NH2+][C@H](c2ccc(F)cc2)C1 ZINC000874888110 689529625 /nfs/dbraw/zinc/52/96/25/689529625.db2.gz BAVKKDZLWURISM-ZDUSSCGKSA-N 1 2 306.362 2.380 20 10 DECDLO Oc1c(F)c(F)ccc1C[NH+]1CCC(Cn2cncn2)CC1 ZINC000877431057 690110913 /nfs/dbraw/zinc/11/09/13/690110913.db2.gz XOELVFSRCATEGI-UHFFFAOYSA-N 1 2 308.332 2.174 20 10 DECDLO COC1CCN(c2ccc(C[N@@H+]3CCO[C@H](OC)C3)cc2)CC1 ZINC000878970342 690539782 /nfs/dbraw/zinc/53/97/82/690539782.db2.gz OETPOGPXDYEKGO-SFHVURJKSA-N 1 2 320.433 2.107 20 10 DECDLO COC1CCN(c2ccc(C[N@H+]3CCO[C@H](OC)C3)cc2)CC1 ZINC000878970342 690539785 /nfs/dbraw/zinc/53/97/85/690539785.db2.gz OETPOGPXDYEKGO-SFHVURJKSA-N 1 2 320.433 2.107 20 10 DECDLO C[NH+](C)Cc1csc(CNC(=O)Nc2ccc(N)cc2)n1 ZINC000926145897 693404289 /nfs/dbraw/zinc/40/42/89/693404289.db2.gz XODKRRICVDOYER-UHFFFAOYSA-N 1 2 305.407 2.109 20 10 DECDLO COc1ccc(C[NH2+]Cc2csnn2)cc1Cn1cccn1 ZINC001332314253 1149848191 /nfs/dbraw/zinc/84/81/91/1149848191.db2.gz SDPZSQGONCNUFJ-UHFFFAOYSA-N 1 2 315.402 2.081 20 10 DECDLO Oc1cc(F)c(F)cc1C[NH+]1CCN(c2nccs2)CC1 ZINC001142508798 780785150 /nfs/dbraw/zinc/78/51/50/780785150.db2.gz LUTIFLDZBPVHAR-UHFFFAOYSA-N 1 2 311.357 2.449 20 10 DECDLO CCC(=O)NCCC1=CCN(c2nc(C)[nH+]c(C)c2C)CC1 ZINC001089794393 783450159 /nfs/dbraw/zinc/45/01/59/783450159.db2.gz IATCQJVVBKLBMG-UHFFFAOYSA-N 1 2 302.422 2.455 20 10 DECDLO CC1(c2cc[nH+]c(NCc3ccc(O)c(O)c3)c2)OCCO1 ZINC001169990643 785783799 /nfs/dbraw/zinc/78/37/99/785783799.db2.gz KRFXJJONJHSCPY-UHFFFAOYSA-N 1 2 302.330 2.324 20 10 DECDLO CS(=O)(=O)CC1(CC[NH2+]Cc2cccc(Cl)c2O)CC1 ZINC000692827577 794487968 /nfs/dbraw/zinc/48/79/68/794487968.db2.gz NWNQCZMROYTTEK-UHFFFAOYSA-N 1 2 317.838 2.350 20 10 DECDLO CCN(CC[NH+](C)C)Cc1c(O)ccc2c(C)cc(=O)oc21 ZINC001139126863 796328050 /nfs/dbraw/zinc/32/80/50/796328050.db2.gz SLWGYWYJYSTJCZ-UHFFFAOYSA-N 1 2 304.390 2.191 20 10 DECDLO CC(=O)[C@@H]1CC[N@H+](Cc2c(O)ccc3c(C)cc(=O)oc32)C1 ZINC001139132932 796331159 /nfs/dbraw/zinc/33/11/59/796331159.db2.gz CRSODJANESRDCJ-GFCCVEGCSA-N 1 2 301.342 2.218 20 10 DECDLO CC(=O)[C@@H]1CC[N@@H+](Cc2c(O)ccc3c(C)cc(=O)oc32)C1 ZINC001139132932 796331161 /nfs/dbraw/zinc/33/11/61/796331161.db2.gz CRSODJANESRDCJ-GFCCVEGCSA-N 1 2 301.342 2.218 20 10 DECDLO Cc1cncnc1O[C@H]1CC[N@H+](Cc2c(O)cc(F)cc2F)C1 ZINC001140585541 796541695 /nfs/dbraw/zinc/54/16/95/796541695.db2.gz MZWMQZRRIZHKFL-LBPRGKRZSA-N 1 2 321.327 2.422 20 10 DECDLO Cc1cncnc1O[C@H]1CC[N@@H+](Cc2c(O)cc(F)cc2F)C1 ZINC001140585541 796541696 /nfs/dbraw/zinc/54/16/96/796541696.db2.gz MZWMQZRRIZHKFL-LBPRGKRZSA-N 1 2 321.327 2.422 20 10 DECDLO C[N@H+](Cc1ccno1)Cc1ccc(N2CCOCC2)cc1F ZINC001140664522 796553707 /nfs/dbraw/zinc/55/37/07/796553707.db2.gz KBMCDFRDVGOXSG-UHFFFAOYSA-N 1 2 305.353 2.282 20 10 DECDLO C[N@@H+](Cc1ccno1)Cc1ccc(N2CCOCC2)cc1F ZINC001140664522 796553709 /nfs/dbraw/zinc/55/37/09/796553709.db2.gz KBMCDFRDVGOXSG-UHFFFAOYSA-N 1 2 305.353 2.282 20 10 DECDLO CCN1CC[N@H+](Cc2cc3c4c(c2)CCCN4CCC3)CC1=O ZINC001141078016 796633065 /nfs/dbraw/zinc/63/30/65/796633065.db2.gz IWPRNBQUFUWJSX-UHFFFAOYSA-N 1 2 313.445 2.050 20 10 DECDLO CCN1CC[N@@H+](Cc2cc3c4c(c2)CCCN4CCC3)CC1=O ZINC001141078016 796633066 /nfs/dbraw/zinc/63/30/66/796633066.db2.gz IWPRNBQUFUWJSX-UHFFFAOYSA-N 1 2 313.445 2.050 20 10 DECDLO O=C(c1ccccc1)N1CC[NH+](Cc2cc(O)ccc2O)CC1 ZINC001141155593 796641230 /nfs/dbraw/zinc/64/12/30/796641230.db2.gz AFUQKNWVVQFZJX-UHFFFAOYSA-N 1 2 312.369 2.056 20 10 DECDLO OC[C@@]1(C(F)(F)F)CC[N@H+](Cc2cc(F)c(F)cc2O)C1 ZINC001142508491 796746276 /nfs/dbraw/zinc/74/62/76/796746276.db2.gz APFWOEAPCJCRLB-GFCCVEGCSA-N 1 2 311.250 2.417 20 10 DECDLO OC[C@@]1(C(F)(F)F)CC[N@@H+](Cc2cc(F)c(F)cc2O)C1 ZINC001142508491 796746280 /nfs/dbraw/zinc/74/62/80/796746280.db2.gz APFWOEAPCJCRLB-GFCCVEGCSA-N 1 2 311.250 2.417 20 10 DECDLO CCOc1cccc(C[N@@H+]2CCN(C3CCCC3)C(=O)C2)c1O ZINC001203609581 800088781 /nfs/dbraw/zinc/08/87/81/800088781.db2.gz YQQOQONURLLLOI-UHFFFAOYSA-N 1 2 318.417 2.378 20 10 DECDLO CCOc1cccc(C[N@H+]2CCN(C3CCCC3)C(=O)C2)c1O ZINC001203609581 800088788 /nfs/dbraw/zinc/08/87/88/800088788.db2.gz YQQOQONURLLLOI-UHFFFAOYSA-N 1 2 318.417 2.378 20 10 DECDLO CC(C)(C)OC(=O)N1C[C@@H]2C[C@H]1C[N@@H+]2Cc1ccc(O)c(O)c1 ZINC001203877392 800138321 /nfs/dbraw/zinc/13/83/21/800138321.db2.gz FSWIEFIFZYHQFX-STQMWFEESA-N 1 2 320.389 2.291 20 10 DECDLO CC(C)(C)OC(=O)N1C[C@@H]2C[C@H]1C[N@H+]2Cc1ccc(O)c(O)c1 ZINC001203877392 800138327 /nfs/dbraw/zinc/13/83/27/800138327.db2.gz FSWIEFIFZYHQFX-STQMWFEESA-N 1 2 320.389 2.291 20 10 DECDLO O=C(C1CC[NH+](Cc2ccc(O)c(O)c2)CC1)C(F)(F)F ZINC001203882498 800139512 /nfs/dbraw/zinc/13/95/12/800139512.db2.gz JJKNLGXMDKURIS-UHFFFAOYSA-N 1 2 303.280 2.441 20 10 DECDLO COCCOc1ccc(N2CC[NH+](Cc3cnoc3)CC2)cc1 ZINC001205724236 800408477 /nfs/dbraw/zinc/40/84/77/800408477.db2.gz KSFUWZGPLFISFV-UHFFFAOYSA-N 1 2 317.389 2.022 20 10 DECDLO Oc1cc(O)c(C[NH+]2CCN(c3ccccn3)CC2)cc1Cl ZINC001232258478 801830646 /nfs/dbraw/zinc/83/06/46/801830646.db2.gz IPAKFCCHLRHBCE-UHFFFAOYSA-N 1 2 319.792 2.468 20 10 DECDLO COc1cc(Cl)cc(C[NH+]2CC(N3CC[C@H](F)C3)C2)c1O ZINC001233290187 802064710 /nfs/dbraw/zinc/06/47/10/802064710.db2.gz NPSWLAIDOITRBP-LBPRGKRZSA-N 1 2 314.788 2.282 20 10 DECDLO COc1cc(Cl)cc(CN2CC([N@@H+]3CC[C@H](F)C3)C2)c1O ZINC001233290187 802064714 /nfs/dbraw/zinc/06/47/14/802064714.db2.gz NPSWLAIDOITRBP-LBPRGKRZSA-N 1 2 314.788 2.282 20 10 DECDLO COc1cc(Cl)cc(CN2CC([N@H+]3CC[C@H](F)C3)C2)c1O ZINC001233290187 802064717 /nfs/dbraw/zinc/06/47/17/802064717.db2.gz NPSWLAIDOITRBP-LBPRGKRZSA-N 1 2 314.788 2.282 20 10 DECDLO Oc1c(C[N@@H+]2CCO[C@@]3(CCOC3)C2)cccc1C(F)(F)F ZINC001233416408 802111957 /nfs/dbraw/zinc/11/19/57/802111957.db2.gz HABLOVALGOVSDP-AWEZNQCLSA-N 1 2 317.307 2.402 20 10 DECDLO Oc1c(C[N@H+]2CCO[C@@]3(CCOC3)C2)cccc1C(F)(F)F ZINC001233416408 802111963 /nfs/dbraw/zinc/11/19/63/802111963.db2.gz HABLOVALGOVSDP-AWEZNQCLSA-N 1 2 317.307 2.402 20 10 DECDLO C[C@H]([NH2+][C@@H](C)c1cccc(-c2nn[nH]n2)c1O)c1cncs1 ZINC001589952114 1076533138 /nfs/dbraw/zinc/53/31/38/1076533138.db2.gz LIEIOYPEWAWEMY-IUCAKERBSA-N 1 2 316.390 2.441 20 10 DECDLO C[C@H]([NH2+]CCOC(C)(C)C)c1cccc(-c2nn[nH]n2)c1O ZINC001589964994 1076538390 /nfs/dbraw/zinc/53/83/90/1076538390.db2.gz XKONCWZKLYKVEC-JTQLQIEISA-N 1 2 305.382 2.038 20 10 DECDLO CC[C@H]([NH2+][C@H](C)CSC)c1cccc(-c2nn[nH]n2)c1O ZINC001590461347 1076630418 /nfs/dbraw/zinc/63/04/18/1076630418.db2.gz BEYCZQQLOOLVFX-SKDRFNHKSA-N 1 2 307.423 2.365 20 10 DECDLO CC[C@@H]([NH2+]CC1(CC)COC1)c1cccc(-c2nn[nH]n2)c1O ZINC001590462826 1076631391 /nfs/dbraw/zinc/63/13/91/1076631391.db2.gz FXBMUSMTSWWOMT-CYBMUJFWSA-N 1 2 317.393 2.040 20 10 DECDLO CC[C@H]([NH2+]C[C@H](C)C[C@@H](C)O)c1cccc(-c2nn[nH]n2)c1O ZINC001590464895 1076632691 /nfs/dbraw/zinc/63/26/91/1076632691.db2.gz RCXLMTUNNOAHGC-GYSYKLTISA-N 1 2 319.409 2.020 20 10 DECDLO CCC(O)(CC)CC[NH2+][C@H](C)c1cccc(-c2nn[nH]n2)c1O ZINC001590473839 1076636309 /nfs/dbraw/zinc/63/63/09/1076636309.db2.gz WDLSJINHBPAXFX-LLVKDONJSA-N 1 2 319.409 2.164 20 10 DECDLO CCSCCC[NH2+][C@H](C)c1cccc(-c2nn[nH]n2)c1O ZINC001590853646 1076685729 /nfs/dbraw/zinc/68/57/29/1076685729.db2.gz UZCIIGIXXKBBJU-SNVBAGLBSA-N 1 2 307.423 2.366 20 10 DECDLO Cc1ccc(C[NH2+][C@H](C)c2cccc(-c3nn[nH]n3)c2O)cn1 ZINC001592165021 1076864141 /nfs/dbraw/zinc/86/41/41/1076864141.db2.gz DKQUYNQRXQADKU-LLVKDONJSA-N 1 2 310.361 2.127 20 10 DECDLO Cc1cncc(C[NH2+][C@@H](C)c2cccc(-c3nn[nH]n3)c2O)c1 ZINC001592300192 1076893131 /nfs/dbraw/zinc/89/31/31/1076893131.db2.gz PKEUNPURIARBJO-NSHDSACASA-N 1 2 310.361 2.127 20 10 DECDLO Oc1c(F)cc(F)cc1C[NH2+]Cc1ccc(-c2nn[nH]n2)s1 ZINC001593538983 1077019387 /nfs/dbraw/zinc/01/93/87/1077019387.db2.gz MJIHFHNCYUJXLJ-UHFFFAOYSA-N 1 2 323.328 2.202 20 10 DECDLO COC[C@]1(C(=O)OC)CCC[N@@H+]1Cc1ccc(Cl)cc1O ZINC001658644576 1080213200 /nfs/dbraw/zinc/21/32/00/1080213200.db2.gz AIVNRYMAENYVOO-HNNXBMFYSA-N 1 2 313.781 2.200 20 10 DECDLO CCS(=O)(=O)C1CC[NH+](Cc2ccc(Cl)cc2O)CC1 ZINC001664470565 1080913402 /nfs/dbraw/zinc/91/34/02/1080913402.db2.gz HPXPQLVRQDOKSW-UHFFFAOYSA-N 1 2 317.838 2.445 20 10 DECDLO C[C@@H]1CC[N@H+](Cc2cc(Br)cc(F)c2O)C[C@@H]1O ZINC001235058185 1084293395 /nfs/dbraw/zinc/29/33/95/1084293395.db2.gz YQXRKKWWIUOLKW-PELKAZGASA-N 1 2 318.186 2.497 20 10 DECDLO C[C@@H]1CC[N@@H+](Cc2cc(Br)cc(F)c2O)C[C@@H]1O ZINC001235058185 1084293408 /nfs/dbraw/zinc/29/34/08/1084293408.db2.gz YQXRKKWWIUOLKW-PELKAZGASA-N 1 2 318.186 2.497 20 10 DECDLO CC[NH+]1CCN(Cc2cc(F)cc(Br)c2O)CC1 ZINC001235296545 1084377314 /nfs/dbraw/zinc/37/73/14/1084377314.db2.gz KDGXVDPGIAVDSJ-UHFFFAOYSA-N 1 2 317.202 2.431 20 10 DECDLO C[C@]1(O)CC[N@H+](Cc2cc(F)cc(Br)c2O)C1 ZINC001235298381 1084377400 /nfs/dbraw/zinc/37/74/00/1084377400.db2.gz RXMKRXGFKATOLB-LBPRGKRZSA-N 1 2 304.159 2.251 20 10 DECDLO C[C@]1(O)CC[N@@H+](Cc2cc(F)cc(Br)c2O)C1 ZINC001235298381 1084377409 /nfs/dbraw/zinc/37/74/09/1084377409.db2.gz RXMKRXGFKATOLB-LBPRGKRZSA-N 1 2 304.159 2.251 20 10 DECDLO COC(=O)CC[N@H+](C)Cc1cc(F)cc(Br)c1O ZINC001235305025 1084381238 /nfs/dbraw/zinc/38/12/38/1084381238.db2.gz IVQVJARLZFVLDX-UHFFFAOYSA-N 1 2 320.158 2.289 20 10 DECDLO COC(=O)CC[N@@H+](C)Cc1cc(F)cc(Br)c1O ZINC001235305025 1084381248 /nfs/dbraw/zinc/38/12/48/1084381248.db2.gz IVQVJARLZFVLDX-UHFFFAOYSA-N 1 2 320.158 2.289 20 10 DECDLO Oc1cc(Cl)ccc1C[NH+]1CC2(CCN2Cc2cn[nH]c2)C1 ZINC001275270652 1091646022 /nfs/dbraw/zinc/64/60/22/1091646022.db2.gz FLZYPRKERFJNCM-UHFFFAOYSA-N 1 2 318.808 2.229 20 10 DECDLO CN(C)C(=O)C1C[NH+](Cc2cc(Cl)c(Cl)cc2O)C1 ZINC001236795480 1138430560 /nfs/dbraw/zinc/43/05/60/1138430560.db2.gz FFGYGKWUKBPZJX-UHFFFAOYSA-N 1 2 303.189 2.219 20 10 DECDLO COc1cc(C)c(C[N@@H+]2CCN(C(C)(C)C)C(=O)C2)c(O)c1 ZINC001236810196 1138435320 /nfs/dbraw/zinc/43/53/20/1138435320.db2.gz CYIZBYNSELRGNK-UHFFFAOYSA-N 1 2 306.406 2.152 20 10 DECDLO COc1cc(C)c(C[N@H+]2CCN(C(C)(C)C)C(=O)C2)c(O)c1 ZINC001236810196 1138435329 /nfs/dbraw/zinc/43/53/29/1138435329.db2.gz CYIZBYNSELRGNK-UHFFFAOYSA-N 1 2 306.406 2.152 20 10 DECDLO CC(=O)N(C)[C@H]1CC[N@H+](Cc2cc(Cl)cc(F)c2O)C1 ZINC001237622856 1138719212 /nfs/dbraw/zinc/71/92/12/1138719212.db2.gz DKWYRZXOSIKUHL-LBPRGKRZSA-N 1 2 300.761 2.237 20 10 DECDLO CC(=O)N(C)[C@H]1CC[N@@H+](Cc2cc(Cl)cc(F)c2O)C1 ZINC001237622856 1138719217 /nfs/dbraw/zinc/71/92/17/1138719217.db2.gz DKWYRZXOSIKUHL-LBPRGKRZSA-N 1 2 300.761 2.237 20 10 DECDLO C[C@@H]1C(=O)N(C)CC[N@H+]1Cc1ccc2c(c1O)C=CC(C)(C)O2 ZINC001249252201 1141865173 /nfs/dbraw/zinc/86/51/73/1141865173.db2.gz ISJRJRWZCZLZBZ-GFCCVEGCSA-N 1 2 316.401 2.239 20 10 DECDLO C[C@@H]1C(=O)N(C)CC[N@@H+]1Cc1ccc2c(c1O)C=CC(C)(C)O2 ZINC001249252201 1141865174 /nfs/dbraw/zinc/86/51/74/1141865174.db2.gz ISJRJRWZCZLZBZ-GFCCVEGCSA-N 1 2 316.401 2.239 20 10 DECDLO CCOc1ccc(N2CC[NH+](CC(=O)N[C@@H](C)CC)CC2)cc1 ZINC001253832249 1142973809 /nfs/dbraw/zinc/97/38/09/1142973809.db2.gz WIWFEPSUNYGCAA-HNNXBMFYSA-N 1 2 319.449 2.122 20 10 DECDLO CN(C)c1ccc(C[N@@H+]2CCNC(=O)[C@H]2c2cccs2)cc1 ZINC000373167317 529780441 /nfs/dbraw/zinc/78/04/41/529780441.db2.gz QGOBUAXYZHPWGK-MRXNPFEDSA-N 1 2 315.442 2.487 20 10 DECDLO CN(C)c1ccc(C[N@H+]2CCNC(=O)[C@H]2c2cccs2)cc1 ZINC000373167317 529780442 /nfs/dbraw/zinc/78/04/42/529780442.db2.gz QGOBUAXYZHPWGK-MRXNPFEDSA-N 1 2 315.442 2.487 20 10 DECDLO CN(C)c1ccc(C[N@@H+]2CCOC[C@@H]2[C@@H]2CCCO2)cc1F ZINC000377701408 529780569 /nfs/dbraw/zinc/78/05/69/529780569.db2.gz PAVKBOIRVYFCTB-SJORKVTESA-N 1 2 308.397 2.272 20 10 DECDLO CN(C)c1ccc(C[N@H+]2CCOC[C@@H]2[C@@H]2CCCO2)cc1F ZINC000377701408 529780571 /nfs/dbraw/zinc/78/05/71/529780571.db2.gz PAVKBOIRVYFCTB-SJORKVTESA-N 1 2 308.397 2.272 20 10 DECDLO C[N@H+](CCS(C)(=O)=O)Cc1ccc(N2CCCCC2)cc1 ZINC000052917291 354417087 /nfs/dbraw/zinc/41/70/87/354417087.db2.gz XFHUBPYXGMORPU-UHFFFAOYSA-N 1 2 310.463 2.153 20 10 DECDLO C[N@@H+](CCS(C)(=O)=O)Cc1ccc(N2CCCCC2)cc1 ZINC000052917291 354417089 /nfs/dbraw/zinc/41/70/89/354417089.db2.gz XFHUBPYXGMORPU-UHFFFAOYSA-N 1 2 310.463 2.153 20 10 DECDLO COC(=O)C[N@H+](Cc1cc(Cl)ccc1O)C[C@H](C)OC ZINC000182335064 291080836 /nfs/dbraw/zinc/08/08/36/291080836.db2.gz PQSDDQCYRBCJLB-JTQLQIEISA-N 1 2 301.770 2.056 20 10 DECDLO COC(=O)C[N@@H+](Cc1cc(Cl)ccc1O)C[C@H](C)OC ZINC000182335064 291080840 /nfs/dbraw/zinc/08/08/40/291080840.db2.gz PQSDDQCYRBCJLB-JTQLQIEISA-N 1 2 301.770 2.056 20 10 DECDLO C[C@@H]([NH2+]CC1(N(C)C)CCOCC1)c1ccc(F)c(F)c1O ZINC000187719464 296118412 /nfs/dbraw/zinc/11/84/12/296118412.db2.gz QEGRSYGICYZQPQ-LLVKDONJSA-N 1 2 314.376 2.432 20 10 DECDLO Cc1cnc(C[N@@H+](C)Cc2ccc(N3CCOCC3)cc2)o1 ZINC000075611493 401764187 /nfs/dbraw/zinc/76/41/87/401764187.db2.gz LUGUKLMGPNDYGG-UHFFFAOYSA-N 1 2 301.390 2.452 20 10 DECDLO Cc1cnc(C[N@H+](C)Cc2ccc(N3CCOCC3)cc2)o1 ZINC000075611493 401764190 /nfs/dbraw/zinc/76/41/90/401764190.db2.gz LUGUKLMGPNDYGG-UHFFFAOYSA-N 1 2 301.390 2.452 20 10 DECDLO CN(C)c1ccc(CNC(=O)C[NH+]2Cc3ccccc3C2)cc1 ZINC000155536782 402259946 /nfs/dbraw/zinc/25/99/46/402259946.db2.gz LXINYQJRZKVIMB-UHFFFAOYSA-N 1 2 309.413 2.385 20 10 DECDLO C[N@H+](CC(=O)OC(C)(C)C)Cc1ccc(N2CCOCC2)cc1 ZINC000071124147 402269803 /nfs/dbraw/zinc/26/98/03/402269803.db2.gz YNUWCBQESJEJAP-UHFFFAOYSA-N 1 2 320.433 2.297 20 10 DECDLO C[N@@H+](CC(=O)OC(C)(C)C)Cc1ccc(N2CCOCC2)cc1 ZINC000071124147 402269806 /nfs/dbraw/zinc/26/98/06/402269806.db2.gz YNUWCBQESJEJAP-UHFFFAOYSA-N 1 2 320.433 2.297 20 10 DECDLO C[C@@H]([NH2+]CC1(CO)COC1)c1ccc(Cl)c(Cl)c1O ZINC000186146555 402405283 /nfs/dbraw/zinc/40/52/83/402405283.db2.gz GKOXIRHHWCHTRY-MRVPVSSYSA-N 1 2 306.189 2.359 20 10 DECDLO C[C@H]([NH2+]Cc1ncn(C)n1)c1cc(Br)ccc1O ZINC000186213837 402411241 /nfs/dbraw/zinc/41/12/41/402411241.db2.gz IXEXDVHTMTYNEH-QMMMGPOBSA-N 1 2 311.183 2.134 20 10 DECDLO CCN(CC)c1ccc(CNC(=O)c2cccc(O)c2O)c[nH+]1 ZINC000186947821 402473129 /nfs/dbraw/zinc/47/31/29/402473129.db2.gz LAHGKEIYMMGNSJ-UHFFFAOYSA-N 1 2 315.373 2.269 20 10 DECDLO C[C@H]([C@@H](C)S(C)(=O)=O)[N@H+](C)Cc1cccc(Cl)c1O ZINC000180260087 402611627 /nfs/dbraw/zinc/61/16/27/402611627.db2.gz JRIPAZJWOJWVAY-NXEZZACHSA-N 1 2 305.827 2.299 20 10 DECDLO C[C@H]([C@@H](C)S(C)(=O)=O)[N@@H+](C)Cc1cccc(Cl)c1O ZINC000180260087 402611629 /nfs/dbraw/zinc/61/16/29/402611629.db2.gz JRIPAZJWOJWVAY-NXEZZACHSA-N 1 2 305.827 2.299 20 10 DECDLO C[C@H]([NH2+]CC1(N2CCOCC2)CC1)c1ccc(F)c(F)c1O ZINC000278527715 402867396 /nfs/dbraw/zinc/86/73/96/402867396.db2.gz TWGFTDNIPNORHL-NSHDSACASA-N 1 2 312.360 2.186 20 10 DECDLO CCOC(=O)[C@H]1CCCC[N@@H+]1Cc1cc(OC)c(OC)cc1O ZINC000271854240 402884742 /nfs/dbraw/zinc/88/47/42/402884742.db2.gz WYRNEUMVIIZNAG-CYBMUJFWSA-N 1 2 323.389 2.327 20 10 DECDLO CCOC(=O)[C@H]1CCCC[N@H+]1Cc1cc(OC)c(OC)cc1O ZINC000271854240 402884744 /nfs/dbraw/zinc/88/47/44/402884744.db2.gz WYRNEUMVIIZNAG-CYBMUJFWSA-N 1 2 323.389 2.327 20 10 DECDLO COc1cc(Cl)cc(C[N@@H+]2CC[S@](=O)C[C@@H](C)C2)c1O ZINC000277627120 403238750 /nfs/dbraw/zinc/23/87/50/403238750.db2.gz XMGUGGIMJOCXNO-FVINQWEUSA-N 1 2 317.838 2.255 20 10 DECDLO COc1cc(Cl)cc(C[N@H+]2CC[S@](=O)C[C@@H](C)C2)c1O ZINC000277627120 403238751 /nfs/dbraw/zinc/23/87/51/403238751.db2.gz XMGUGGIMJOCXNO-FVINQWEUSA-N 1 2 317.838 2.255 20 10 DECDLO O=C(CCC[NH2+]Cc1cc(Cl)c(F)cc1O)NC1CC1 ZINC000294297031 403695887 /nfs/dbraw/zinc/69/58/87/403695887.db2.gz PSRPOIVDQNOZCE-UHFFFAOYSA-N 1 2 300.761 2.333 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@@H+]2CCO[C@@]3(CCO[C@@H]3C)C2)c1O ZINC000365562494 404691591 /nfs/dbraw/zinc/69/15/91/404691591.db2.gz YJJVVLVIRSAJLC-PXAZEXFGSA-N 1 2 323.364 2.114 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@H+]2CCO[C@@]3(CCO[C@@H]3C)C2)c1O ZINC000365562494 404691594 /nfs/dbraw/zinc/69/15/94/404691594.db2.gz YJJVVLVIRSAJLC-PXAZEXFGSA-N 1 2 323.364 2.114 20 10 DECDLO COc1cc(O)c(C[N@@H+]2CCC[C@H]2c2ncon2)cc1OC ZINC000360777672 404837274 /nfs/dbraw/zinc/83/72/74/404837274.db2.gz NRVOWJIQNWFPBG-NSHDSACASA-N 1 2 305.334 2.130 20 10 DECDLO COc1cc(O)c(C[N@H+]2CCC[C@H]2c2ncon2)cc1OC ZINC000360777672 404837277 /nfs/dbraw/zinc/83/72/77/404837277.db2.gz NRVOWJIQNWFPBG-NSHDSACASA-N 1 2 305.334 2.130 20 10 DECDLO Oc1ccc(Br)cc1CN1CCn2c[nH+]cc2C1 ZINC000367943190 405199123 /nfs/dbraw/zinc/19/91/23/405199123.db2.gz NSXCTFNRZFRETN-UHFFFAOYSA-N 1 2 308.179 2.367 20 10 DECDLO CCC(CC)[C@H](C(=O)Nc1ccc(N)cc1)[NH+]1CCOCC1 ZINC000160406499 521614723 /nfs/dbraw/zinc/61/47/23/521614723.db2.gz BNCPSDPWBGRFLC-MRXNPFEDSA-N 1 2 305.422 2.344 20 10 DECDLO Oc1c(Cl)cccc1C[N@@H+]1CC[C@H](CN2CCOCC2)C1 ZINC000180453838 526326883 /nfs/dbraw/zinc/32/68/83/526326883.db2.gz RRXCLIWRCPURKS-CYBMUJFWSA-N 1 2 310.825 2.200 20 10 DECDLO Oc1c(Cl)cccc1C[N@H+]1CC[C@H](CN2CCOCC2)C1 ZINC000180453838 526326889 /nfs/dbraw/zinc/32/68/89/526326889.db2.gz RRXCLIWRCPURKS-CYBMUJFWSA-N 1 2 310.825 2.200 20 10 DECDLO COc1c(O)c(C[NH2+]C(C)(C)c2nc(C)no2)ccc1[N+](=O)[O-] ZINC000285350752 536861408 /nfs/dbraw/zinc/86/14/08/536861408.db2.gz YMCQKJFYZHUKDY-UHFFFAOYSA-N 1 2 322.321 2.025 20 10 DECDLO COc1ccc(N2CCCN(c3nccn4c[nH+]cc34)CC2)cc1 ZINC000891935247 624670400 /nfs/dbraw/zinc/67/04/00/624670400.db2.gz ZAIKNBODUZDVBP-UHFFFAOYSA-N 1 2 323.400 2.455 20 10 DECDLO O=C1C[C@@H]([C@@H]2CCCC[N@H+]2Cc2cc(F)cc(F)c2O)CN1 ZINC000894095822 636111393 /nfs/dbraw/zinc/11/13/93/636111393.db2.gz SNWYWWLEGZNEKK-YGRLFVJLSA-N 1 2 310.344 2.161 20 10 DECDLO O=C1C[C@@H]([C@@H]2CCCC[N@@H+]2Cc2cc(F)cc(F)c2O)CN1 ZINC000894095822 636111395 /nfs/dbraw/zinc/11/13/95/636111395.db2.gz SNWYWWLEGZNEKK-YGRLFVJLSA-N 1 2 310.344 2.161 20 10 DECDLO O=C(NCc1c[nH+]c2n1CCCC2)NCc1c(O)cccc1F ZINC000922397247 636157813 /nfs/dbraw/zinc/15/78/13/636157813.db2.gz IUOKEOUJGUZVJW-UHFFFAOYSA-N 1 2 318.352 2.064 20 10 DECDLO CCOC(=O)c1noc(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)n1 ZINC000838937979 637723783 /nfs/dbraw/zinc/72/37/83/637723783.db2.gz YWXBBFTZTXHRFN-NSHDSACASA-N 1 2 318.377 2.163 20 10 DECDLO C[C@@H](O)C1([NH2+]Cc2cc(Br)cc(F)c2O)CC1 ZINC000895336228 637939629 /nfs/dbraw/zinc/93/96/29/637939629.db2.gz QTVPJVQPVLAJPH-SSDOTTSWSA-N 1 2 304.159 2.297 20 10 DECDLO OC[C@@H]([NH2+]Cc1cc(Cl)cc(F)c1O)[C@@H]1CCCOC1 ZINC000840961483 650395463 /nfs/dbraw/zinc/39/54/63/650395463.db2.gz BKBNFFVDEQTIFO-NOZJJQNGSA-N 1 2 303.761 2.062 20 10 DECDLO Oc1cccc(F)c1C[NH2+]Cc1ncc(C2OCCO2)s1 ZINC000896638866 638621468 /nfs/dbraw/zinc/62/14/68/638621468.db2.gz XUGZTAHJKNERGV-UHFFFAOYSA-N 1 2 310.350 2.323 20 10 DECDLO COc1ccc(O)c([C@H](C)Nc2ccc(N(C)CCO)c[nH+]2)c1 ZINC000756843240 639701388 /nfs/dbraw/zinc/70/13/88/639701388.db2.gz AHRCKFOTJJDAHI-LBPRGKRZSA-N 1 2 317.389 2.397 20 10 DECDLO COc1nn(C)cc1C[NH2+]Cc1cc(F)c(N(C)C)cc1F ZINC000898025113 641003077 /nfs/dbraw/zinc/00/30/77/641003077.db2.gz GIURMVLHJYFMKN-UHFFFAOYSA-N 1 2 310.348 2.063 20 10 DECDLO CCc1nc(C[N@H+](C)Cc2cc3c(cc2O)OC[C@@H]3O)cs1 ZINC000768443210 641082284 /nfs/dbraw/zinc/08/22/84/641082284.db2.gz RIXSXXUYHCILGO-AWEZNQCLSA-N 1 2 320.414 2.469 20 10 DECDLO CCc1nc(C[N@@H+](C)Cc2cc3c(cc2O)OC[C@@H]3O)cs1 ZINC000768443210 641082289 /nfs/dbraw/zinc/08/22/89/641082289.db2.gz RIXSXXUYHCILGO-AWEZNQCLSA-N 1 2 320.414 2.469 20 10 DECDLO Cc1nc(N(C)C)nc(NCc2c(O)ccc3c2CCCC3)[nH+]1 ZINC000768537997 641094829 /nfs/dbraw/zinc/09/48/29/641094829.db2.gz PVCMZOFTYXKVNI-UHFFFAOYSA-N 1 2 313.405 2.443 20 10 DECDLO C[N@H+](Cc1cc[nH]n1)Cc1ccc(N2CCOCC2)c(F)c1 ZINC000769385037 641231527 /nfs/dbraw/zinc/23/15/27/641231527.db2.gz SCSQZQYGURQQFD-UHFFFAOYSA-N 1 2 304.369 2.017 20 10 DECDLO C[N@@H+](Cc1cc[nH]n1)Cc1ccc(N2CCOCC2)c(F)c1 ZINC000769385037 641231531 /nfs/dbraw/zinc/23/15/31/641231531.db2.gz SCSQZQYGURQQFD-UHFFFAOYSA-N 1 2 304.369 2.017 20 10 DECDLO CCOC1CC(O)(C[NH2+]Cc2cc(Cl)cc(F)c2O)C1 ZINC000775182424 642013963 /nfs/dbraw/zinc/01/39/63/642013963.db2.gz DXCHNMJNGQSIOJ-UHFFFAOYSA-N 1 2 303.761 2.204 20 10 DECDLO Oc1c(Cl)cccc1CN1CC[NH+](C[C@@H]2CCCO2)CC1 ZINC000775645697 642071820 /nfs/dbraw/zinc/07/18/20/642071820.db2.gz FQTNIWBDZGZCAJ-AWEZNQCLSA-N 1 2 310.825 2.342 20 10 DECDLO CCN(Cc1ccc(N(C)C)cc1)C(=O)Cc1c[nH+]cn1C ZINC000776636555 642193871 /nfs/dbraw/zinc/19/38/71/642193871.db2.gz CFOKJQQRNMBZLI-UHFFFAOYSA-N 1 2 300.406 2.077 20 10 DECDLO COc1ccc(O)c([C@@H](C)NC(=O)CNc2cccc[nH+]2)c1 ZINC000901127861 642571139 /nfs/dbraw/zinc/57/11/39/642571139.db2.gz NQLGKQIXBOGURC-LLVKDONJSA-N 1 2 301.346 2.085 20 10 DECDLO COC[C@H]([NH2+]Cc1cc(Cl)cc(F)c1O)[C@H]1CCCO1 ZINC000789777591 643775116 /nfs/dbraw/zinc/77/51/16/643775116.db2.gz YULLWYMMKPSLNZ-QWHCGFSZSA-N 1 2 303.761 2.468 20 10 DECDLO CC[C@H](C)[C@@H]([NH2+][C@H]1CCN(c2ccc(OC)cc2)C1)C(=O)OC ZINC000905781441 644032637 /nfs/dbraw/zinc/03/26/37/644032637.db2.gz XORIFCALNFLFSE-GRDNDAEWSA-N 1 2 320.433 2.451 20 10 DECDLO CS(=O)(=O)C1(C[NH2+]Cc2cccc(Cl)c2O)CCC1 ZINC000793281349 644224779 /nfs/dbraw/zinc/22/47/79/644224779.db2.gz PITSAYBZHHUDIN-UHFFFAOYSA-N 1 2 303.811 2.103 20 10 DECDLO Oc1cc2c(cc1C[N@@H+]1Cc3cccc(F)c3C1)[C@H](O)CO2 ZINC000840162205 646200303 /nfs/dbraw/zinc/20/03/03/646200303.db2.gz PPDBUPDXTCDSKA-MRXNPFEDSA-N 1 2 301.317 2.473 20 10 DECDLO Oc1cc2c(cc1C[N@H+]1Cc3cccc(F)c3C1)[C@H](O)CO2 ZINC000840162205 646200310 /nfs/dbraw/zinc/20/03/10/646200310.db2.gz PPDBUPDXTCDSKA-MRXNPFEDSA-N 1 2 301.317 2.473 20 10 DECDLO CN(CC[N@H+](C)Cc1ccc(N2CCOCC2)c(F)c1)C1CC1 ZINC000809754185 646277626 /nfs/dbraw/zinc/27/76/26/646277626.db2.gz FGSQNHJDFLCIQP-UHFFFAOYSA-N 1 2 321.440 2.188 20 10 DECDLO CN(CC[N@@H+](C)Cc1ccc(N2CCOCC2)c(F)c1)C1CC1 ZINC000809754185 646277635 /nfs/dbraw/zinc/27/76/35/646277635.db2.gz FGSQNHJDFLCIQP-UHFFFAOYSA-N 1 2 321.440 2.188 20 10 DECDLO O=S1(=O)CCC[C@H](C[NH2+]Cc2cc(Cl)cc(F)c2O)C1 ZINC000809770058 646280890 /nfs/dbraw/zinc/28/08/90/646280890.db2.gz QFGVZBHHBUNQFM-SECBINFHSA-N 1 2 321.801 2.099 20 10 DECDLO COc1ccc(O)c([C@@H](C)NC(=O)NCCCn2cc[nH+]c2)c1 ZINC000171409067 646700331 /nfs/dbraw/zinc/70/03/31/646700331.db2.gz LANLGKUZHFEONZ-GFCCVEGCSA-N 1 2 318.377 2.048 20 10 DECDLO OC[C@]1([C@H]([NH2+]Cc2cccc(Cl)c2O)C2CC2)CCCO1 ZINC000816667246 647165131 /nfs/dbraw/zinc/16/51/31/647165131.db2.gz HNRSUSLQNVPAMG-CVEARBPZSA-N 1 2 311.809 2.455 20 10 DECDLO COc1cccc(CNC(=O)NCc2cc(C)[nH+]c(C)c2)c1O ZINC000817785934 647360615 /nfs/dbraw/zinc/36/06/15/647360615.db2.gz PNMXHHVFXGPKJH-UHFFFAOYSA-N 1 2 315.373 2.412 20 10 DECDLO CCOC(=O)C[N@H+](CCc1cscn1)Cc1ccccc1O ZINC000823575949 648445282 /nfs/dbraw/zinc/44/52/82/648445282.db2.gz FGRVIARZQQQPGI-UHFFFAOYSA-N 1 2 320.414 2.457 20 10 DECDLO CCOC(=O)C[N@@H+](CCc1cscn1)Cc1ccccc1O ZINC000823575949 648445288 /nfs/dbraw/zinc/44/52/88/648445288.db2.gz FGRVIARZQQQPGI-UHFFFAOYSA-N 1 2 320.414 2.457 20 10 DECDLO CCOC(=O)C[N@@H+](Cc1ccccc1O)C[C@@H]1CC[C@H](C)O1 ZINC000823576809 648445614 /nfs/dbraw/zinc/44/56/14/648445614.db2.gz ZZFAINLDFDADNA-ZFWWWQNUSA-N 1 2 307.390 2.325 20 10 DECDLO CCOC(=O)C[N@H+](Cc1ccccc1O)C[C@@H]1CC[C@H](C)O1 ZINC000823576809 648445615 /nfs/dbraw/zinc/44/56/15/648445615.db2.gz ZZFAINLDFDADNA-ZFWWWQNUSA-N 1 2 307.390 2.325 20 10 DECDLO CC[N@H+](CC(=O)OC)Cc1ccc(Br)cc1O ZINC000824708298 648640476 /nfs/dbraw/zinc/64/04/76/648640476.db2.gz AGVPJZHEONOUCA-UHFFFAOYSA-N 1 2 302.168 2.150 20 10 DECDLO CC[N@@H+](CC(=O)OC)Cc1ccc(Br)cc1O ZINC000824708298 648640478 /nfs/dbraw/zinc/64/04/78/648640478.db2.gz AGVPJZHEONOUCA-UHFFFAOYSA-N 1 2 302.168 2.150 20 10 DECDLO O=C1OCCN1[C@H]1CC[N@@H+](Cc2cc(Cl)c(F)cc2O)C1 ZINC000827000748 648958954 /nfs/dbraw/zinc/95/89/54/648958954.db2.gz NPJPUMYPDZYPNG-JTQLQIEISA-N 1 2 314.744 2.211 20 10 DECDLO O=C1OCCN1[C@H]1CC[N@H+](Cc2cc(Cl)c(F)cc2O)C1 ZINC000827000748 648958957 /nfs/dbraw/zinc/95/89/57/648958957.db2.gz NPJPUMYPDZYPNG-JTQLQIEISA-N 1 2 314.744 2.211 20 10 DECDLO C[C@@H]1CC[C@H]([NH2+]Cc2cccc(Cl)c2O)CS1(=O)=O ZINC000827173748 648986564 /nfs/dbraw/zinc/98/65/64/648986564.db2.gz ZZXSZDNDMSZEHS-KOLCDFICSA-N 1 2 303.811 2.101 20 10 DECDLO CC[C@@H](C(=O)N[C@@H](C)c1ccccc1O)[N@@H+]1CCO[C@H](CC)C1 ZINC000827964527 649112921 /nfs/dbraw/zinc/11/29/21/649112921.db2.gz OLOCEEWFLPSXDB-LZWOXQAQSA-N 1 2 320.433 2.459 20 10 DECDLO CC[C@@H](C(=O)N[C@@H](C)c1ccccc1O)[N@H+]1CCO[C@H](CC)C1 ZINC000827964527 649112923 /nfs/dbraw/zinc/11/29/23/649112923.db2.gz OLOCEEWFLPSXDB-LZWOXQAQSA-N 1 2 320.433 2.459 20 10 DECDLO CCc1noc(C[N@H+](C)CCN(C)c2ccc(OC)cc2)n1 ZINC000844399616 651122846 /nfs/dbraw/zinc/12/28/46/651122846.db2.gz LSDCUUMRURKKKU-UHFFFAOYSA-N 1 2 304.394 2.209 20 10 DECDLO CCc1noc(C[N@@H+](C)CCN(C)c2ccc(OC)cc2)n1 ZINC000844399616 651122847 /nfs/dbraw/zinc/12/28/47/651122847.db2.gz LSDCUUMRURKKKU-UHFFFAOYSA-N 1 2 304.394 2.209 20 10 DECDLO COc1cccc([C@H](C)Nc2ccc(N(C)CCO)c[nH+]2)c1O ZINC000846160878 651312117 /nfs/dbraw/zinc/31/21/17/651312117.db2.gz ULUJSNDFNOSODR-LBPRGKRZSA-N 1 2 317.389 2.397 20 10 DECDLO COc1ccc(N2CCN(c3cc[nH+]c(C)n3)CC2)c(OC)c1 ZINC000846750298 651348899 /nfs/dbraw/zinc/34/88/99/651348899.db2.gz AMBWJGYVLQTZJT-UHFFFAOYSA-N 1 2 314.389 2.129 20 10 DECDLO C[NH+](C)C1(C(=O)NCc2cc(Cl)cc(Cl)c2O)CC1 ZINC000854474039 651486329 /nfs/dbraw/zinc/48/63/29/651486329.db2.gz JCHUHYHYLMOSTR-UHFFFAOYSA-N 1 2 303.189 2.409 20 10 DECDLO CCOC(=O)[C@H]1CSCC[N@@H+]1Cc1cccc(CC)c1O ZINC000848881338 651542528 /nfs/dbraw/zinc/54/25/28/651542528.db2.gz OHDCKVBSYLWHDQ-CQSZACIVSA-N 1 2 309.431 2.435 20 10 DECDLO CCOC(=O)[C@H]1CSCC[N@H+]1Cc1cccc(CC)c1O ZINC000848881338 651542531 /nfs/dbraw/zinc/54/25/31/651542531.db2.gz OHDCKVBSYLWHDQ-CQSZACIVSA-N 1 2 309.431 2.435 20 10 DECDLO COCc1n[nH]c(C[NH2+][C@@H](C)c2cc3c(cc2O)CCCC3)n1 ZINC000850513983 651942883 /nfs/dbraw/zinc/94/28/83/651942883.db2.gz KBWTTXODJVLXGW-NSHDSACASA-N 1 2 316.405 2.386 20 10 DECDLO CN(C)c1noc(C[NH2+]Cc2ccc(N3CCCCC3)cc2)n1 ZINC000191897918 684438136 /nfs/dbraw/zinc/43/81/36/684438136.db2.gz SBMZSGPMUOXPOS-UHFFFAOYSA-N 1 2 315.421 2.416 20 10 DECDLO CC[C@H](C(=O)N1Cc2cccc(O)c2C1)[N@@H+]1CCO[C@@H](CC)C1 ZINC000871205509 688749319 /nfs/dbraw/zinc/74/93/19/688749319.db2.gz USADANOAZUGIQH-GOEBONIOSA-N 1 2 318.417 2.124 20 10 DECDLO CC[C@H](C(=O)N1Cc2cccc(O)c2C1)[N@H+]1CCO[C@@H](CC)C1 ZINC000871205509 688749321 /nfs/dbraw/zinc/74/93/21/688749321.db2.gz USADANOAZUGIQH-GOEBONIOSA-N 1 2 318.417 2.124 20 10 DECDLO Cn1cnnc1C1CC[NH+](Cc2ccc(F)c(F)c2O)CC1 ZINC000876611377 689876457 /nfs/dbraw/zinc/87/64/57/689876457.db2.gz YOCCAYVWAMXZFN-UHFFFAOYSA-N 1 2 308.332 2.179 20 10 DECDLO O=C(NCC1C[NH+](Cc2cc(Cl)ccc2O)C1)C(F)(F)F ZINC000877776948 690224540 /nfs/dbraw/zinc/22/45/40/690224540.db2.gz HYQKPBHHSGAACJ-UHFFFAOYSA-N 1 2 322.714 2.156 20 10 DECDLO OC[C@H](CCF)[NH2+]Cc1cc(Br)cc(F)c1O ZINC000883158992 691443828 /nfs/dbraw/zinc/44/38/28/691443828.db2.gz XDILHSOYTWVSPX-VIFPVBQESA-N 1 2 310.138 2.104 20 10 DECDLO OCC1CC[NH+](Cc2cc(Br)c(F)cc2O)CC1 ZINC001144293634 790844018 /nfs/dbraw/zinc/84/40/18/790844018.db2.gz QYCVUMVJJIWLMD-UHFFFAOYSA-N 1 2 318.186 2.498 20 10 DECDLO C[C@H]([NH2+]Cc1ccc(N2CCOCC2)c(F)c1)c1csnn1 ZINC001202859712 796264861 /nfs/dbraw/zinc/26/48/61/796264861.db2.gz JXMKDKZVKTVISB-NSHDSACASA-N 1 2 322.409 2.365 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+](C)CC1(C)COC1 ZINC001139127075 796327307 /nfs/dbraw/zinc/32/73/07/796327307.db2.gz DUROBNPKQWNTFT-UHFFFAOYSA-N 1 2 303.358 2.275 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+](C)CC1(C)COC1 ZINC001139127075 796327309 /nfs/dbraw/zinc/32/73/09/796327309.db2.gz DUROBNPKQWNTFT-UHFFFAOYSA-N 1 2 303.358 2.275 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CC[C@@](C)(O)[C@@H](C)C1 ZINC001139126710 796328162 /nfs/dbraw/zinc/32/81/62/796328162.db2.gz NOILWTLGRKAKDA-KPZWWZAWSA-N 1 2 317.385 2.400 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CC[C@@](C)(O)[C@@H](C)C1 ZINC001139126710 796328166 /nfs/dbraw/zinc/32/81/66/796328166.db2.gz NOILWTLGRKAKDA-KPZWWZAWSA-N 1 2 317.385 2.400 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CC[C@@H]2OCC[C@H]2C1 ZINC001139130746 796330757 /nfs/dbraw/zinc/33/07/57/796330757.db2.gz IZCOBNWLPYPMCL-LRDDRELGSA-N 1 2 315.369 2.418 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CC[C@@H]2OCC[C@H]2C1 ZINC001139130746 796330760 /nfs/dbraw/zinc/33/07/60/796330760.db2.gz IZCOBNWLPYPMCL-LRDDRELGSA-N 1 2 315.369 2.418 20 10 DECDLO CCOC(=O)[C@H]1CSCC[N@@H+]1Cc1c(C)ccc(C)c1O ZINC001140184392 796487251 /nfs/dbraw/zinc/48/72/51/796487251.db2.gz RNYCOGYGVOPZHJ-CQSZACIVSA-N 1 2 309.431 2.490 20 10 DECDLO CCOC(=O)[C@H]1CSCC[N@H+]1Cc1c(C)ccc(C)c1O ZINC001140184392 796487255 /nfs/dbraw/zinc/48/72/55/796487255.db2.gz RNYCOGYGVOPZHJ-CQSZACIVSA-N 1 2 309.431 2.490 20 10 DECDLO C[C@@H]1CN(C2C[NH+](Cc3c(O)cccc3Cl)C2)C[C@@H](C)O1 ZINC001140342604 796510761 /nfs/dbraw/zinc/51/07/61/796510761.db2.gz QOAUWLNZXBUUGD-VXGBXAGGSA-N 1 2 310.825 2.339 20 10 DECDLO CS(=O)(=O)C1CC[NH+](Cc2ccc(Cl)cc2O)CC1 ZINC001140467470 796526538 /nfs/dbraw/zinc/52/65/38/796526538.db2.gz VSGLOEOUJRNTML-UHFFFAOYSA-N 1 2 303.811 2.055 20 10 DECDLO CNc1nc(Cl)ncc1C[N@@H+]1CCc2cccc(O)c2C1 ZINC001142495182 796745619 /nfs/dbraw/zinc/74/56/19/796745619.db2.gz YMAUFTGXQYVIIB-UHFFFAOYSA-N 1 2 304.781 2.436 20 10 DECDLO CNc1nc(Cl)ncc1C[N@H+]1CCc2cccc(O)c2C1 ZINC001142495182 796745621 /nfs/dbraw/zinc/74/56/21/796745621.db2.gz YMAUFTGXQYVIIB-UHFFFAOYSA-N 1 2 304.781 2.436 20 10 DECDLO CCn1ncc2c1[C@@H](COC)C[N@H+](Cc1ccc(O)c(O)c1)C2 ZINC001203878537 800138741 /nfs/dbraw/zinc/13/87/41/800138741.db2.gz VHMNGGHHDXZLQJ-CQSZACIVSA-N 1 2 317.389 2.060 20 10 DECDLO CCn1ncc2c1[C@@H](COC)C[N@@H+](Cc1ccc(O)c(O)c1)C2 ZINC001203878537 800138742 /nfs/dbraw/zinc/13/87/42/800138742.db2.gz VHMNGGHHDXZLQJ-CQSZACIVSA-N 1 2 317.389 2.060 20 10 DECDLO [NH3+][C@H]1CN(Cc2cc(Cl)cc(Br)c2O)C[C@H]1F ZINC001204829927 800263244 /nfs/dbraw/zinc/26/32/44/800263244.db2.gz GGXAADVOINLCMU-ZJUUUORDSA-N 1 2 323.593 2.289 20 10 DECDLO COc1ncccc1C[N@@H+]1CCCc2cc(O)c(O)cc2C1 ZINC001206596267 800561816 /nfs/dbraw/zinc/56/18/16/800561816.db2.gz XMUAYEBWKOIFRW-UHFFFAOYSA-N 1 2 300.358 2.450 20 10 DECDLO COc1ncccc1C[N@H+]1CCCc2cc(O)c(O)cc2C1 ZINC001206596267 800561819 /nfs/dbraw/zinc/56/18/19/800561819.db2.gz XMUAYEBWKOIFRW-UHFFFAOYSA-N 1 2 300.358 2.450 20 10 DECDLO C[N@@H+]1CC[C@H](Oc2ccc3c(c2)C(=O)c2ccc(O)cc2C3=O)C1 ZINC001229192644 801240563 /nfs/dbraw/zinc/24/05/63/801240563.db2.gz RFPBLXFDALVEQY-ZDUSSCGKSA-N 1 2 323.348 2.251 20 10 DECDLO C[N@H+]1CC[C@H](Oc2ccc3c(c2)C(=O)c2ccc(O)cc2C3=O)C1 ZINC001229192644 801240571 /nfs/dbraw/zinc/24/05/71/801240571.db2.gz RFPBLXFDALVEQY-ZDUSSCGKSA-N 1 2 323.348 2.251 20 10 DECDLO O=C([O-])c1ccc(O)c(C[NH+]2CCC(n3cc[nH+]c3)CC2)c1 ZINC001231566215 801687979 /nfs/dbraw/zinc/68/79/79/801687979.db2.gz VBDDNIFMRJAZQW-UHFFFAOYSA-N 1 2 301.346 2.124 20 10 DECDLO CN(C)c1ccc(C[N@@H+]2CCO[C@H](C(F)(F)F)C2)c(O)c1 ZINC001232840295 801969211 /nfs/dbraw/zinc/96/92/11/801969211.db2.gz RTUXSONVOLMXQZ-ZDUSSCGKSA-N 1 2 304.312 2.221 20 10 DECDLO CN(C)c1ccc(C[N@H+]2CCO[C@H](C(F)(F)F)C2)c(O)c1 ZINC001232840295 801969214 /nfs/dbraw/zinc/96/92/14/801969214.db2.gz RTUXSONVOLMXQZ-ZDUSSCGKSA-N 1 2 304.312 2.221 20 10 DECDLO O=C(N[C@@H]1CCC[N@@H+](Cc2ccc(F)c(F)c2O)C1)C1CC1 ZINC001233080484 802023499 /nfs/dbraw/zinc/02/34/99/802023499.db2.gz VKQMKVWEEIEQQO-GFCCVEGCSA-N 1 2 310.344 2.161 20 10 DECDLO O=C(N[C@@H]1CCC[N@H+](Cc2ccc(F)c(F)c2O)C1)C1CC1 ZINC001233080484 802023505 /nfs/dbraw/zinc/02/35/05/802023505.db2.gz VKQMKVWEEIEQQO-GFCCVEGCSA-N 1 2 310.344 2.161 20 10 DECDLO O=C1OCCN1C1CC[NH+](Cc2c(O)ccc(F)c2F)CC1 ZINC001233335477 802080475 /nfs/dbraw/zinc/08/04/75/802080475.db2.gz WWJCSXXWDIOIEX-UHFFFAOYSA-N 1 2 312.316 2.087 20 10 DECDLO COC[C@@H]1C[N@H+](Cc2cccc(C(F)(F)F)c2O)CCO1 ZINC001233419328 802113550 /nfs/dbraw/zinc/11/35/50/802113550.db2.gz UCFMZHNYLZRCFU-NSHDSACASA-N 1 2 305.296 2.258 20 10 DECDLO COC[C@@H]1C[N@@H+](Cc2cccc(C(F)(F)F)c2O)CCO1 ZINC001233419328 802113555 /nfs/dbraw/zinc/11/35/55/802113555.db2.gz UCFMZHNYLZRCFU-NSHDSACASA-N 1 2 305.296 2.258 20 10 DECDLO COCCOC1C[NH+](Cc2ccc(C(F)(F)F)cc2O)C1 ZINC001233456069 802123563 /nfs/dbraw/zinc/12/35/63/802123563.db2.gz KHZHPJBRDYBIAP-UHFFFAOYSA-N 1 2 305.296 2.258 20 10 DECDLO CC[C@@H]([NH2+]CCCCCOC)c1cccc(-c2nn[nH]n2)c1O ZINC001604057212 1070190900 /nfs/dbraw/zinc/19/09/00/1070190900.db2.gz YMFPGHOOMMPVQS-CQSZACIVSA-N 1 2 319.409 2.430 20 10 DECDLO COC(C)(C)[C@H](C)[NH2+][C@@H](C)c1cccc(-c2nn[nH]n2)c1O ZINC001604995478 1070560015 /nfs/dbraw/zinc/56/00/15/1070560015.db2.gz IXYAHMKSIKZDPQ-UWVGGRQHSA-N 1 2 305.382 2.036 20 10 DECDLO O=C(Cc1ccc(-n2cc[nH+]c2)cc1)NCc1ccc(O)c(O)c1 ZINC001622663941 1078192908 /nfs/dbraw/zinc/19/29/08/1078192908.db2.gz AGNNGEMIEMYWFE-UHFFFAOYSA-N 1 2 323.352 2.142 20 10 DECDLO O=C(N[C@H](Cn1cc[nH+]c1)c1ccccc1)c1cccc(O)c1O ZINC001636676920 1078486950 /nfs/dbraw/zinc/48/69/50/1078486950.db2.gz LQHHCXVXPKUEOA-OAHLLOKOSA-N 1 2 323.352 2.466 20 10 DECDLO CC[C@H](C)[C@@H](C[NH2+][C@@H](C)c1cccc(-c2nn[nH]n2)c1O)OC ZINC001590401738 1076620117 /nfs/dbraw/zinc/62/01/17/1076620117.db2.gz XAAGWLUGFVXTKC-COPLHBTASA-N 1 2 319.409 2.284 20 10 DECDLO CC[C@H]([NH2+]CC(C)(C)COC)c1cccc(-c2nn[nH]n2)c1O ZINC001590466601 1076633340 /nfs/dbraw/zinc/63/33/40/1076633340.db2.gz ZHRUIJUOXPMNQC-ZDUSSCGKSA-N 1 2 319.409 2.286 20 10 DECDLO CC[C@H]([NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1)C1(C(=O)[O-])CCC1 ZINC001609938280 1077953937 /nfs/dbraw/zinc/95/39/37/1077953937.db2.gz WUCXMOVSQCCXMJ-CVEARBPZSA-N 1 2 319.449 2.376 20 10 DECDLO Oc1cc(F)c(F)cc1C[N@@H+]1CCCN(CC(F)F)CC1 ZINC001664611556 1080932639 /nfs/dbraw/zinc/93/26/39/1080932639.db2.gz KXJFXZGSAYSNHC-UHFFFAOYSA-N 1 2 306.303 2.443 20 10 DECDLO Oc1cc(F)c(F)cc1C[N@H+]1CCCN(CC(F)F)CC1 ZINC001664611556 1080932646 /nfs/dbraw/zinc/93/26/46/1080932646.db2.gz KXJFXZGSAYSNHC-UHFFFAOYSA-N 1 2 306.303 2.443 20 10 DECDLO CCOCc1cc(C[NH2+]Cc2nncn2CC)ccc1OC ZINC001648814199 1082093040 /nfs/dbraw/zinc/09/30/40/1082093040.db2.gz IIWLBHGFMOWKHD-UHFFFAOYSA-N 1 2 304.394 2.133 20 10 DECDLO CCOC[C@@H]1Cn2nccc2C[N@H+](Cc2c(O)cccc2F)C1 ZINC001137836258 1086587610 /nfs/dbraw/zinc/58/76/10/1086587610.db2.gz XJGSHVHWAZZJBS-ZDUSSCGKSA-N 1 2 319.380 2.396 20 10 DECDLO Oc1cc(OCC(F)(F)F)ccc1C[N@@H+]1CCO[C@@H]2C[C@@H]21 ZINC001237062945 1138493557 /nfs/dbraw/zinc/49/35/57/1138493557.db2.gz QLNASABKDLSFDP-WCQYABFASA-N 1 2 303.280 2.306 20 10 DECDLO Oc1cc(OCC(F)(F)F)ccc1C[N@H+]1CCO[C@@H]2C[C@@H]21 ZINC001237062945 1138493567 /nfs/dbraw/zinc/49/35/67/1138493567.db2.gz QLNASABKDLSFDP-WCQYABFASA-N 1 2 303.280 2.306 20 10 DECDLO C[C@@]1(CO)C[N@H+](Cc2c(O)ccc(Cl)c2Cl)CC[C@@H]1O ZINC001237077303 1138499955 /nfs/dbraw/zinc/49/99/55/1138499955.db2.gz FJDRKJULCWHFGR-JSGCOSHPSA-N 1 2 320.216 2.264 20 10 DECDLO C[C@@]1(CO)C[N@@H+](Cc2c(O)ccc(Cl)c2Cl)CC[C@@H]1O ZINC001237077303 1138499961 /nfs/dbraw/zinc/49/99/61/1138499961.db2.gz FJDRKJULCWHFGR-JSGCOSHPSA-N 1 2 320.216 2.264 20 10 DECDLO C[N@H+](CCN1CCOCC1)Cc1c(O)ccc(Cl)c1Cl ZINC001237077636 1138500725 /nfs/dbraw/zinc/50/07/25/1138500725.db2.gz JELVAHGMMRYLFX-UHFFFAOYSA-N 1 2 319.232 2.463 20 10 DECDLO C[N@@H+](CCN1CCOCC1)Cc1c(O)ccc(Cl)c1Cl ZINC001237077636 1138500736 /nfs/dbraw/zinc/50/07/36/1138500736.db2.gz JELVAHGMMRYLFX-UHFFFAOYSA-N 1 2 319.232 2.463 20 10 DECDLO CC(=O)N1CCC2(C[NH+](Cc3cc(F)c(Cl)cc3O)C2)C1 ZINC001237938175 1138811641 /nfs/dbraw/zinc/81/16/41/1138811641.db2.gz VOPDQUBRKDPAHE-UHFFFAOYSA-N 1 2 312.772 2.239 20 10 DECDLO COC[C@H]1C[N@H+](Cc2cc(F)cc(C)c2O)Cc2ncn(C)c21 ZINC001238060798 1138819444 /nfs/dbraw/zinc/81/94/44/1138819444.db2.gz JFJMCNBJKXFCHY-CYBMUJFWSA-N 1 2 319.380 2.319 20 10 DECDLO COC[C@H]1C[N@@H+](Cc2cc(F)cc(C)c2O)Cc2ncn(C)c21 ZINC001238060798 1138819445 /nfs/dbraw/zinc/81/94/45/1138819445.db2.gz JFJMCNBJKXFCHY-CYBMUJFWSA-N 1 2 319.380 2.319 20 10 DECDLO Cn1ccc2c1nccc2-c1cncc(C[NH+]2CCOCC2)c1 ZINC001245250685 1140569614 /nfs/dbraw/zinc/56/96/14/1140569614.db2.gz MJVOGZSHIHMERX-UHFFFAOYSA-N 1 2 308.385 2.468 20 10 DECDLO C[C@H]1CCN(C(=O)NCc2ccc(N)cc2)C[C@@H]1n1cc[nH+]c1 ZINC001262603726 1144322614 /nfs/dbraw/zinc/32/26/14/1144322614.db2.gz SVYQJVRIVDYYAW-BBRMVZONSA-N 1 2 313.405 2.258 20 10 DECDLO CCOC1CC(C[N@H+](C)c2ccc(OCC(=O)OC)cc2)C1 ZINC000285611138 131185991 /nfs/dbraw/zinc/18/59/91/131185991.db2.gz MBEANOCUMZTERE-UHFFFAOYSA-N 1 2 307.390 2.490 20 10 DECDLO CCOC1CC(C[N@@H+](C)c2ccc(OCC(=O)OC)cc2)C1 ZINC000285611138 131185993 /nfs/dbraw/zinc/18/59/93/131185993.db2.gz MBEANOCUMZTERE-UHFFFAOYSA-N 1 2 307.390 2.490 20 10 DECDLO Cc1nnc(C[N@@H+](Cc2ccccc2O)C[C@@H]2CCCO2)n1C ZINC000111232905 401701980 /nfs/dbraw/zinc/70/19/80/401701980.db2.gz RBOJDQKRYWWDAW-HNNXBMFYSA-N 1 2 316.405 2.010 20 10 DECDLO Cc1nnc(C[N@H+](Cc2ccccc2O)C[C@@H]2CCCO2)n1C ZINC000111232905 401701981 /nfs/dbraw/zinc/70/19/81/401701981.db2.gz RBOJDQKRYWWDAW-HNNXBMFYSA-N 1 2 316.405 2.010 20 10 DECDLO C[N@@H+]1CCN(C(=O)c2cccc(O)c2O)[C@@H](c2ccccc2)C1 ZINC000184770376 402298943 /nfs/dbraw/zinc/29/89/43/402298943.db2.gz RRGOQSJPLNCLPK-OAHLLOKOSA-N 1 2 312.369 2.227 20 10 DECDLO C[N@H+]1CCN(C(=O)c2cccc(O)c2O)[C@@H](c2ccccc2)C1 ZINC000184770376 402298945 /nfs/dbraw/zinc/29/89/45/402298945.db2.gz RRGOQSJPLNCLPK-OAHLLOKOSA-N 1 2 312.369 2.227 20 10 DECDLO C[C@@H]([NH2+]CC1(N2CCOCC2)CC1)c1ccc(F)c(F)c1O ZINC000278527713 402867635 /nfs/dbraw/zinc/86/76/35/402867635.db2.gz TWGFTDNIPNORHL-LLVKDONJSA-N 1 2 312.360 2.186 20 10 DECDLO OC[C@H](C[NH2+]Cc1cc(Cl)cc(Cl)c1O)[C@H]1CCOC1 ZINC000280337516 402989920 /nfs/dbraw/zinc/98/99/20/402989920.db2.gz QZZFCQZHJYWRPK-ONGXEEELSA-N 1 2 320.216 2.434 20 10 DECDLO COc1c(O)c(C[N@@H+]2C[C@@H](C)O[C@H](C3CC3)C2)ccc1[N+](=O)[O-] ZINC000280492815 403005668 /nfs/dbraw/zinc/00/56/68/403005668.db2.gz FLQSGZOLOAIEJC-YGRLFVJLSA-N 1 2 322.361 2.308 20 10 DECDLO COc1c(O)c(C[N@H+]2C[C@@H](C)O[C@H](C3CC3)C2)ccc1[N+](=O)[O-] ZINC000280492815 403005670 /nfs/dbraw/zinc/00/56/70/403005670.db2.gz FLQSGZOLOAIEJC-YGRLFVJLSA-N 1 2 322.361 2.308 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@H+]2C[C@@H](C)O[C@@]3(CCOC3)C2)c1O ZINC000280606786 403018439 /nfs/dbraw/zinc/01/84/39/403018439.db2.gz VQIJFZYPXUFCJM-DIFFPNOSSA-N 1 2 323.364 2.114 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@@H+]2C[C@@H](C)O[C@@]3(CCOC3)C2)c1O ZINC000280606786 403018441 /nfs/dbraw/zinc/01/84/41/403018441.db2.gz VQIJFZYPXUFCJM-DIFFPNOSSA-N 1 2 323.364 2.114 20 10 DECDLO OC[C@H]1CCCCN1c1cc(NCc2ccccc2O)[nH+]cn1 ZINC000277445967 403218683 /nfs/dbraw/zinc/21/86/83/403218683.db2.gz NAEFGCWSUBGBHU-CQSZACIVSA-N 1 2 314.389 2.146 20 10 DECDLO OC[C@H]1CCCCN1c1cc(NCc2ccccc2O)nc[nH+]1 ZINC000277445967 403218686 /nfs/dbraw/zinc/21/86/86/403218686.db2.gz NAEFGCWSUBGBHU-CQSZACIVSA-N 1 2 314.389 2.146 20 10 DECDLO CCC[NH+](CCC)c1ccc(CN[C@H](C(=O)OC)[C@H](C)O)cc1 ZINC000276507257 403181961 /nfs/dbraw/zinc/18/19/61/403181961.db2.gz SQPLVKDTRUTGHR-YOEHRIQHSA-N 1 2 322.449 2.325 20 10 DECDLO COC(=O)COc1ccc([N@H+](C)CCC2CCOCC2)cc1 ZINC000292923007 403383415 /nfs/dbraw/zinc/38/34/15/403383415.db2.gz LWFZZVUOMNTOIV-UHFFFAOYSA-N 1 2 307.390 2.491 20 10 DECDLO COC(=O)COc1ccc([N@@H+](C)CCC2CCOCC2)cc1 ZINC000292923007 403383419 /nfs/dbraw/zinc/38/34/19/403383419.db2.gz LWFZZVUOMNTOIV-UHFFFAOYSA-N 1 2 307.390 2.491 20 10 DECDLO COCC[C@@H]1COCC[N@H+]1Cc1cc(Cl)cc(OC)c1O ZINC000365849938 404732753 /nfs/dbraw/zinc/73/27/53/404732753.db2.gz SYWVORJEHZFKPE-CYBMUJFWSA-N 1 2 315.797 2.292 20 10 DECDLO Cn1c[nH+]c2c1CCN(Cc1cc(Br)ccc1O)C2 ZINC000376204180 227165334 /nfs/dbraw/zinc/16/53/34/227165334.db2.gz XQEVSEYTUDQCCC-UHFFFAOYSA-N 1 2 322.206 2.447 20 10 DECDLO COC(=O)c1ccc(O)c([C@H](C)[NH2+]Cc2nn(C)cc2Cl)c1 ZINC000834883890 649857349 /nfs/dbraw/zinc/85/73/49/649857349.db2.gz UPAPHNYKKSCJRQ-VIFPVBQESA-N 1 2 323.780 2.417 20 10 DECDLO COC[C@H]([NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1O)[C@@H]1CCCO1 ZINC000278628687 293157840 /nfs/dbraw/zinc/15/78/40/293157840.db2.gz CPNRHXBRFABDBS-XEGUGMAKSA-N 1 2 310.350 2.145 20 10 DECDLO CC(=O)c1cc(Cl)cc(C[N@H+](CC(N)=O)C(C)(C)C)c1O ZINC000131418520 518279245 /nfs/dbraw/zinc/27/92/45/518279245.db2.gz OAJKPTVIIKRXMA-UHFFFAOYSA-N 1 2 312.797 2.334 20 10 DECDLO CC(=O)c1cc(Cl)cc(C[N@@H+](CC(N)=O)C(C)(C)C)c1O ZINC000131418520 518279252 /nfs/dbraw/zinc/27/92/52/518279252.db2.gz OAJKPTVIIKRXMA-UHFFFAOYSA-N 1 2 312.797 2.334 20 10 DECDLO COC[C@H]1C[N@H+](Cc2cc(Cl)cc(OC)c2O)C[C@H](C)O1 ZINC000188357557 522870775 /nfs/dbraw/zinc/87/07/75/522870775.db2.gz GVAVTZIBJUPPQY-GXFFZTMASA-N 1 2 315.797 2.290 20 10 DECDLO COC[C@H]1C[N@@H+](Cc2cc(Cl)cc(OC)c2O)C[C@H](C)O1 ZINC000188357557 522870788 /nfs/dbraw/zinc/87/07/88/522870788.db2.gz GVAVTZIBJUPPQY-GXFFZTMASA-N 1 2 315.797 2.290 20 10 DECDLO CC[C@@H]([NH2+][C@@H](C(N)=O)c1ccccn1)c1ccc(N(C)C)cc1 ZINC000297286521 535807843 /nfs/dbraw/zinc/80/78/43/535807843.db2.gz LPDZILGDFGSLIZ-NVXWUHKLSA-N 1 2 312.417 2.415 20 10 DECDLO O=C1N[C@H]2C[N@H+](Cc3cc(Cl)c(F)cc3O)CC[C@@H]2CO1 ZINC000294783114 625080121 /nfs/dbraw/zinc/08/01/21/625080121.db2.gz UQMQQCHIWXEVJK-PELKAZGASA-N 1 2 314.744 2.115 20 10 DECDLO O=C1N[C@H]2C[N@@H+](Cc3cc(Cl)c(F)cc3O)CC[C@@H]2CO1 ZINC000294783114 625080125 /nfs/dbraw/zinc/08/01/25/625080125.db2.gz UQMQQCHIWXEVJK-PELKAZGASA-N 1 2 314.744 2.115 20 10 DECDLO C[C@@H](O)CC[N@H+](C)Cc1cc(Br)cc(F)c1O ZINC000894034320 636094574 /nfs/dbraw/zinc/09/45/74/636094574.db2.gz RCIHYILCOWPSGO-MRVPVSSYSA-N 1 2 306.175 2.497 20 10 DECDLO C[C@@H](O)CC[N@@H+](C)Cc1cc(Br)cc(F)c1O ZINC000894034320 636094575 /nfs/dbraw/zinc/09/45/75/636094575.db2.gz RCIHYILCOWPSGO-MRVPVSSYSA-N 1 2 306.175 2.497 20 10 DECDLO CC[C@@H]1C[N@H+](Cc2cc(Br)cc(F)c2O)C[C@H]1O ZINC000894096796 636113160 /nfs/dbraw/zinc/11/31/60/636113160.db2.gz ZZSSJIWXXBBMMG-PRHODGIISA-N 1 2 318.186 2.497 20 10 DECDLO CC[C@@H]1C[N@@H+](Cc2cc(Br)cc(F)c2O)C[C@H]1O ZINC000894096796 636113163 /nfs/dbraw/zinc/11/31/63/636113163.db2.gz ZZSSJIWXXBBMMG-PRHODGIISA-N 1 2 318.186 2.497 20 10 DECDLO COc1ccc(N2CCC[N@H+](Cc3nncs3)CC2)cc1 ZINC000929316958 636413411 /nfs/dbraw/zinc/41/34/11/636413411.db2.gz SYQBKDSPTSSMSY-UHFFFAOYSA-N 1 2 304.419 2.259 20 10 DECDLO COc1ccc(N2CCC[N@@H+](Cc3nncs3)CC2)cc1 ZINC000929316958 636413417 /nfs/dbraw/zinc/41/34/17/636413417.db2.gz SYQBKDSPTSSMSY-UHFFFAOYSA-N 1 2 304.419 2.259 20 10 DECDLO CCn1ncc(C[N@@H+](Cc2ccccc2O)C[C@H]2CCCO2)n1 ZINC000838783536 637658094 /nfs/dbraw/zinc/65/80/94/637658094.db2.gz KXXOJOXBRCZINZ-MRXNPFEDSA-N 1 2 316.405 2.185 20 10 DECDLO CCn1ncc(C[N@H+](Cc2ccccc2O)C[C@H]2CCCO2)n1 ZINC000838783536 637658101 /nfs/dbraw/zinc/65/81/01/637658101.db2.gz KXXOJOXBRCZINZ-MRXNPFEDSA-N 1 2 316.405 2.185 20 10 DECDLO CCn1ncc(C[N@@H+](Cc2ccccc2O)C[C@@H]2CCCO2)n1 ZINC000838783532 637658556 /nfs/dbraw/zinc/65/85/56/637658556.db2.gz KXXOJOXBRCZINZ-INIZCTEOSA-N 1 2 316.405 2.185 20 10 DECDLO CCn1ncc(C[N@H+](Cc2ccccc2O)C[C@@H]2CCCO2)n1 ZINC000838783532 637658558 /nfs/dbraw/zinc/65/85/58/637658558.db2.gz KXXOJOXBRCZINZ-INIZCTEOSA-N 1 2 316.405 2.185 20 10 DECDLO CC(C)(CN1CCOCC1)[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000840963580 650395593 /nfs/dbraw/zinc/39/55/93/650395593.db2.gz PTOFRTNJBPPOTF-UHFFFAOYSA-N 1 2 316.804 2.385 20 10 DECDLO Oc1c(F)cc(F)cc1C[NH+]1CCC2(CC1)C[C@@H](O)CCO2 ZINC000897257073 639288060 /nfs/dbraw/zinc/28/80/60/639288060.db2.gz HUBGLEYKYVIFRG-ZDUSSCGKSA-N 1 2 313.344 2.176 20 10 DECDLO C[C@@H]([NH2+][C@@H](C)c1cc(F)cc(F)c1O)[C@@H](C)N1CCOCC1 ZINC000756542606 639671243 /nfs/dbraw/zinc/67/12/43/639671243.db2.gz KPIAESAFFIVCFX-GRYCIOLGSA-N 1 2 314.376 2.430 20 10 DECDLO CN(C)c1cc(COC(=O)/C=C\c2ccc(O)c(O)c2)cc[nH+]1 ZINC000767576034 640994910 /nfs/dbraw/zinc/99/49/10/640994910.db2.gz NWBAPXYPAVCOHC-XQRVVYSFSA-N 1 2 314.341 2.315 20 10 DECDLO COc1c(O)c(C[NH2+]Cc2nc(C)cs2)ccc1[N+](=O)[O-] ZINC000774963863 641987825 /nfs/dbraw/zinc/98/78/25/641987825.db2.gz LKVCKCNASHBLEM-UHFFFAOYSA-N 1 2 309.347 2.364 20 10 DECDLO O=C1CC2(CN1)CC[NH+](Cc1cc(Cl)cc(F)c1O)CC2 ZINC000775699522 642080728 /nfs/dbraw/zinc/08/07/28/642080728.db2.gz AEGKHPBBNJREBX-UHFFFAOYSA-N 1 2 312.772 2.287 20 10 DECDLO COCC[N@H+](CCC(=O)OC)Cc1cc(Cl)cc(F)c1O ZINC000775699534 642081397 /nfs/dbraw/zinc/08/13/97/642081397.db2.gz GKWOMNOOLYCBKQ-UHFFFAOYSA-N 1 2 319.760 2.196 20 10 DECDLO COCC[N@@H+](CCC(=O)OC)Cc1cc(Cl)cc(F)c1O ZINC000775699534 642081400 /nfs/dbraw/zinc/08/14/00/642081400.db2.gz GKWOMNOOLYCBKQ-UHFFFAOYSA-N 1 2 319.760 2.196 20 10 DECDLO O=[N+]([O-])c1cc(Cl)cc(C[NH2+][C@H]2CCn3cc[nH+]c3C2)c1[O-] ZINC000778188663 642349628 /nfs/dbraw/zinc/34/96/28/642349628.db2.gz ZITDXEVOKVEQRV-NSHDSACASA-N 1 2 322.752 2.255 20 10 DECDLO COC(=O)c1ccc(O)c([C@@H](C)[NH2+]Cc2csc(N)n2)c1 ZINC000902497836 643053376 /nfs/dbraw/zinc/05/33/76/643053376.db2.gz ABDOOAGDIJABEV-MRVPVSSYSA-N 1 2 307.375 2.068 20 10 DECDLO OCC[C@@H]1CSCC[N@@H+]1Cc1c(O)ccc(Cl)c1F ZINC000792169954 644082973 /nfs/dbraw/zinc/08/29/73/644082973.db2.gz ODPYILIXPADPGZ-SECBINFHSA-N 1 2 305.802 2.485 20 10 DECDLO OCC[C@@H]1CSCC[N@H+]1Cc1c(O)ccc(Cl)c1F ZINC000792169954 644082981 /nfs/dbraw/zinc/08/29/81/644082981.db2.gz ODPYILIXPADPGZ-SECBINFHSA-N 1 2 305.802 2.485 20 10 DECDLO O=C1CCCN1[C@@H]1CC[N@@H+](Cc2cc(Cl)cc(F)c2O)C1 ZINC000792185330 644086032 /nfs/dbraw/zinc/08/60/32/644086032.db2.gz JVMVMVYLVHEIHW-GFCCVEGCSA-N 1 2 312.772 2.381 20 10 DECDLO O=C1CCCN1[C@@H]1CC[N@H+](Cc2cc(Cl)cc(F)c2O)C1 ZINC000792185330 644086036 /nfs/dbraw/zinc/08/60/36/644086036.db2.gz JVMVMVYLVHEIHW-GFCCVEGCSA-N 1 2 312.772 2.381 20 10 DECDLO CCn1ncnc1C[NH2+]Cc1cccc(Br)c1O ZINC000793345905 644236040 /nfs/dbraw/zinc/23/60/40/644236040.db2.gz IMORDARYWSABMN-UHFFFAOYSA-N 1 2 311.183 2.056 20 10 DECDLO COC(=O)[C@H]1[C@@H]2C[N@@H+](Cc3cc(Cl)cc(C(C)=O)c3O)C[C@@H]21 ZINC000794974587 644502298 /nfs/dbraw/zinc/50/22/98/644502298.db2.gz ZSJBNLXZRIWCKI-WDNDVIMCSA-N 1 2 323.776 2.099 20 10 DECDLO COC(=O)[C@H]1[C@@H]2C[N@H+](Cc3cc(Cl)cc(C(C)=O)c3O)C[C@@H]21 ZINC000794974587 644502304 /nfs/dbraw/zinc/50/23/04/644502304.db2.gz ZSJBNLXZRIWCKI-WDNDVIMCSA-N 1 2 323.776 2.099 20 10 DECDLO COc1cccc(C[N@@H+]2CCc3cc(Cl)nnc3C2)c1O ZINC000843418134 650970249 /nfs/dbraw/zinc/97/02/49/650970249.db2.gz ISLLEDJJYMRUFA-UHFFFAOYSA-N 1 2 305.765 2.403 20 10 DECDLO COc1cccc(C[N@H+]2CCc3cc(Cl)nnc3C2)c1O ZINC000843418134 650970255 /nfs/dbraw/zinc/97/02/55/650970255.db2.gz ISLLEDJJYMRUFA-UHFFFAOYSA-N 1 2 305.765 2.403 20 10 DECDLO OC[C@@]1(F)CC[N@H+](Cc2cc(Br)ccc2O)C1 ZINC000802660383 645540643 /nfs/dbraw/zinc/54/06/43/645540643.db2.gz KBNFICXKAVPXBE-GFCCVEGCSA-N 1 2 304.159 2.061 20 10 DECDLO OC[C@@]1(F)CC[N@@H+](Cc2cc(Br)ccc2O)C1 ZINC000802660383 645540646 /nfs/dbraw/zinc/54/06/46/645540646.db2.gz KBNFICXKAVPXBE-GFCCVEGCSA-N 1 2 304.159 2.061 20 10 DECDLO CC(C)OC[C@H](CO)[N@H+](C)Cc1cc(Cl)cc(F)c1O ZINC000809768516 646280434 /nfs/dbraw/zinc/28/04/34/646280434.db2.gz NWUDUFIMMDFEIO-LBPRGKRZSA-N 1 2 305.777 2.402 20 10 DECDLO CC(C)OC[C@H](CO)[N@@H+](C)Cc1cc(Cl)cc(F)c1O ZINC000809768516 646280441 /nfs/dbraw/zinc/28/04/41/646280441.db2.gz NWUDUFIMMDFEIO-LBPRGKRZSA-N 1 2 305.777 2.402 20 10 DECDLO OC[C@H](C[NH2+]Cc1cc(Cl)cc(F)c1O)c1cccnc1 ZINC000809778246 646281946 /nfs/dbraw/zinc/28/19/46/646281946.db2.gz NLJDRTHKXANWPP-LBPRGKRZSA-N 1 2 310.756 2.445 20 10 DECDLO CCN(C)c1ccc(C[N@@H+]2CCC[C@@H](c3n[nH]c(=O)[nH]3)C2)cc1 ZINC000815120005 646973693 /nfs/dbraw/zinc/97/36/93/646973693.db2.gz LSEZPJAVAWCDDV-CQSZACIVSA-N 1 2 315.421 2.346 20 10 DECDLO CCN(C)c1ccc(C[N@H+]2CCC[C@@H](c3n[nH]c(=O)[nH]3)C2)cc1 ZINC000815120005 646973697 /nfs/dbraw/zinc/97/36/97/646973697.db2.gz LSEZPJAVAWCDDV-CQSZACIVSA-N 1 2 315.421 2.346 20 10 DECDLO CS(=O)(=O)CCCC[NH2+]Cc1cc(Cl)cc(F)c1O ZINC000822494944 648219246 /nfs/dbraw/zinc/21/92/46/648219246.db2.gz ZJZDREQZPQPLCW-UHFFFAOYSA-N 1 2 309.790 2.099 20 10 DECDLO CCOC(=O)C[N@H+](C)Cc1cc(Br)cc(C)c1O ZINC000179672845 648406185 /nfs/dbraw/zinc/40/61/85/648406185.db2.gz YUQYIGTVTYFDPV-UHFFFAOYSA-N 1 2 316.195 2.458 20 10 DECDLO CCOC(=O)C[N@@H+](C)Cc1cc(Br)cc(C)c1O ZINC000179672845 648406186 /nfs/dbraw/zinc/40/61/86/648406186.db2.gz YUQYIGTVTYFDPV-UHFFFAOYSA-N 1 2 316.195 2.458 20 10 DECDLO CCOC(=O)C[N@H+](CCOC1CCC1)Cc1ccccc1O ZINC000823576009 648445558 /nfs/dbraw/zinc/44/55/58/648445558.db2.gz GRJXMQULBXWAIH-UHFFFAOYSA-N 1 2 307.390 2.326 20 10 DECDLO CCOC(=O)C[N@@H+](CCOC1CCC1)Cc1ccccc1O ZINC000823576009 648445559 /nfs/dbraw/zinc/44/55/59/648445559.db2.gz GRJXMQULBXWAIH-UHFFFAOYSA-N 1 2 307.390 2.326 20 10 DECDLO COc1c(O)c(CNC(C)(C)C[NH+]2CCCC2)ccc1[N+](=O)[O-] ZINC000825328094 648743260 /nfs/dbraw/zinc/74/32/60/648743260.db2.gz YITOCDLKWNWVQC-UHFFFAOYSA-N 1 2 323.393 2.273 20 10 DECDLO C[N@H+](Cc1cc(Cl)cc(F)c1O)C1(CO)CCOCC1 ZINC000827909680 649104104 /nfs/dbraw/zinc/10/41/04/649104104.db2.gz WXGCAGNOMOSZQM-UHFFFAOYSA-N 1 2 303.761 2.158 20 10 DECDLO C[N@@H+](Cc1cc(Cl)cc(F)c1O)C1(CO)CCOCC1 ZINC000827909680 649104109 /nfs/dbraw/zinc/10/41/09/649104109.db2.gz WXGCAGNOMOSZQM-UHFFFAOYSA-N 1 2 303.761 2.158 20 10 DECDLO Cn1cc(CC[NH2+]Cc2cccc(Br)c2O)cn1 ZINC000101593982 649824087 /nfs/dbraw/zinc/82/40/87/649824087.db2.gz GMPHDJSQNXRRKG-UHFFFAOYSA-N 1 2 310.195 2.221 20 10 DECDLO CC[C@@H]1C[N@H+](Cc2ccc([N+](=O)[O-])c(OC)c2O)[C@@H](C)CO1 ZINC000846042203 651304020 /nfs/dbraw/zinc/30/40/20/651304020.db2.gz AMCSOEURZPEJDV-CMPLNLGQSA-N 1 2 310.350 2.308 20 10 DECDLO CC[C@@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])c(OC)c2O)[C@@H](C)CO1 ZINC000846042203 651304021 /nfs/dbraw/zinc/30/40/21/651304021.db2.gz AMCSOEURZPEJDV-CMPLNLGQSA-N 1 2 310.350 2.308 20 10 DECDLO Oc1c(F)cc(Cl)cc1C[NH2+]CC[C@]1(O)CCCOC1 ZINC000846108615 651308357 /nfs/dbraw/zinc/30/83/57/651308357.db2.gz QESYSFLFZHNVKS-CQSZACIVSA-N 1 2 303.761 2.206 20 10 DECDLO C[C@@H](Cc1c[nH]c[nH+]1)C(=O)NCc1ccc(N(C)C)c(F)c1 ZINC000847405176 651394144 /nfs/dbraw/zinc/39/41/44/651394144.db2.gz ASJKAYIZVPLBER-NSHDSACASA-N 1 2 304.369 2.110 20 10 DECDLO C[C@@H](Cc1c[nH+]c[nH]1)C(=O)NCc1ccc(N(C)C)c(F)c1 ZINC000847405176 651394145 /nfs/dbraw/zinc/39/41/45/651394145.db2.gz ASJKAYIZVPLBER-NSHDSACASA-N 1 2 304.369 2.110 20 10 DECDLO COc1ccc(O)c([C@H](C)NC(=O)[C@@H](C)Cc2c[nH]c[nH+]2)c1 ZINC000847588793 651404409 /nfs/dbraw/zinc/40/44/09/651404409.db2.gz BZJNTSICOOYVAD-QWRGUYRKSA-N 1 2 303.362 2.180 20 10 DECDLO COc1ccc(O)c([C@H](C)NC(=O)[C@@H](C)Cc2c[nH+]c[nH]2)c1 ZINC000847588793 651404411 /nfs/dbraw/zinc/40/44/11/651404411.db2.gz BZJNTSICOOYVAD-QWRGUYRKSA-N 1 2 303.362 2.180 20 10 DECDLO CCOc1cccc(C[NH2+]Cc2nc([C@H]3CCCO3)n[nH]2)c1O ZINC000848561647 651471025 /nfs/dbraw/zinc/47/10/25/651471025.db2.gz AXGVNJPQGBZGNU-CYBMUJFWSA-N 1 2 318.377 2.050 20 10 DECDLO CCc1nnc(C[NH2+]Cc2cccc(Br)c2O)[nH]1 ZINC000392401296 685449269 /nfs/dbraw/zinc/44/92/69/685449269.db2.gz FNFLUXSSGYQOIW-UHFFFAOYSA-N 1 2 311.183 2.125 20 10 DECDLO CCOCCC[N@@H+](CC(=O)OC)Cc1cc(Cl)ccc1O ZINC000119567230 684083759 /nfs/dbraw/zinc/08/37/59/684083759.db2.gz PGUFAYASDWDPIA-UHFFFAOYSA-N 1 2 315.797 2.447 20 10 DECDLO CC[C@@H]1C[N@H+](Cc2ccc(N3CCOCC3)c(F)c2)CCO1 ZINC000125560017 684146784 /nfs/dbraw/zinc/14/67/84/684146784.db2.gz HJLGMPHWTRNVLI-OAHLLOKOSA-N 1 2 308.397 2.273 20 10 DECDLO CC[C@@H]1C[N@@H+](Cc2ccc(N3CCOCC3)c(F)c2)CCO1 ZINC000125560017 684146786 /nfs/dbraw/zinc/14/67/86/684146786.db2.gz HJLGMPHWTRNVLI-OAHLLOKOSA-N 1 2 308.397 2.273 20 10 DECDLO COC(=O)[C@@H]1C[N@H+](C/C=C\c2ccc(N(C)C)cc2)C[C@@H](C)O1 ZINC000862487262 686308717 /nfs/dbraw/zinc/30/87/17/686308717.db2.gz NDXOMONHQXBWBN-SWFLQVRRSA-N 1 2 318.417 2.028 20 10 DECDLO COC(=O)[C@@H]1C[N@@H+](C/C=C\c2ccc(N(C)C)cc2)C[C@@H](C)O1 ZINC000862487262 686308723 /nfs/dbraw/zinc/30/87/23/686308723.db2.gz NDXOMONHQXBWBN-SWFLQVRRSA-N 1 2 318.417 2.028 20 10 DECDLO Cc1cc(N(C)C)ccc1C[C@@H](C)Nc1nc(C)[nH+]c(N)n1 ZINC000865880843 687366497 /nfs/dbraw/zinc/36/64/97/687366497.db2.gz QHDRXVVYRNLCFB-LLVKDONJSA-N 1 2 300.410 2.180 20 10 DECDLO Cc1cc(N(C)C)ccc1C[C@@H](C)Nc1nc(N)nc(C)[nH+]1 ZINC000865880843 687366501 /nfs/dbraw/zinc/36/65/01/687366501.db2.gz QHDRXVVYRNLCFB-LLVKDONJSA-N 1 2 300.410 2.180 20 10 DECDLO C[C@@H](NC(=O)NCCCCn1cc[nH+]c1)c1ccccc1O ZINC000868123374 687917875 /nfs/dbraw/zinc/91/78/75/687917875.db2.gz FTCGEZSTOLMKDO-CYBMUJFWSA-N 1 2 302.378 2.429 20 10 DECDLO O=C(NCCCSc1nccs1)[C@@H]1C[C@H]1c1c[nH]c[nH+]1 ZINC000874464331 689420209 /nfs/dbraw/zinc/42/02/09/689420209.db2.gz BPUHVWPILMRNEU-NXEZZACHSA-N 1 2 308.432 2.268 20 10 DECDLO O=C(NCCCSc1nccs1)[C@@H]1C[C@H]1c1c[nH+]c[nH]1 ZINC000874464331 689420213 /nfs/dbraw/zinc/42/02/13/689420213.db2.gz BPUHVWPILMRNEU-NXEZZACHSA-N 1 2 308.432 2.268 20 10 DECDLO COCCOC1CC[NH+](Cc2ccc(F)c(F)c2O)CC1 ZINC000876726015 689917097 /nfs/dbraw/zinc/91/70/97/689917097.db2.gz SXUOEVBWXGRBHJ-UHFFFAOYSA-N 1 2 301.333 2.298 20 10 DECDLO CCOC(=O)C[N@H+](Cc1ccc(=O)[nH]c1)Cc1ccccc1O ZINC000877598455 690163805 /nfs/dbraw/zinc/16/38/05/690163805.db2.gz GAFBLUZWUJMFBD-UHFFFAOYSA-N 1 2 316.357 2.058 20 10 DECDLO CCOC(=O)C[N@@H+](Cc1ccc(=O)[nH]c1)Cc1ccccc1O ZINC000877598455 690163808 /nfs/dbraw/zinc/16/38/08/690163808.db2.gz GAFBLUZWUJMFBD-UHFFFAOYSA-N 1 2 316.357 2.058 20 10 DECDLO CNC(=O)OC[C@@H]1CCCC[N@@H+]1Cc1cc(F)cc(F)c1O ZINC000894785234 692988622 /nfs/dbraw/zinc/98/86/22/692988622.db2.gz SJPCOCRURKXCMW-LBPRGKRZSA-N 1 2 314.332 2.381 20 10 DECDLO CNC(=O)OC[C@@H]1CCCC[N@H+]1Cc1cc(F)cc(F)c1O ZINC000894785234 692988629 /nfs/dbraw/zinc/98/86/29/692988629.db2.gz SJPCOCRURKXCMW-LBPRGKRZSA-N 1 2 314.332 2.381 20 10 DECDLO O=C(c1cccc(O)c1O)N1CCC(Nc2cccc[nH+]2)CC1 ZINC000927079112 693550123 /nfs/dbraw/zinc/55/01/23/693550123.db2.gz DLOUNNSPZCUGKS-UHFFFAOYSA-N 1 2 313.357 2.210 20 10 DECDLO C[C@@H]1C[C@H](O)C[N@@H+]1Cc1cc(Br)c(F)cc1O ZINC001144299509 790848099 /nfs/dbraw/zinc/84/80/99/790848099.db2.gz YWSDSZCINKGSCC-APPZFPTMSA-N 1 2 304.159 2.249 20 10 DECDLO C[C@@H]1C[C@H](O)C[N@H+]1Cc1cc(Br)c(F)cc1O ZINC001144299509 790848112 /nfs/dbraw/zinc/84/81/12/790848112.db2.gz YWSDSZCINKGSCC-APPZFPTMSA-N 1 2 304.159 2.249 20 10 DECDLO COC1CC[NH+](Cc2c(O)ccc3c(C)cc(=O)oc32)CC1 ZINC001139127493 787705231 /nfs/dbraw/zinc/70/52/31/787705231.db2.gz XESZLARYIRPFFN-UHFFFAOYSA-N 1 2 303.358 2.418 20 10 DECDLO C[C@@H](C[S@](C)=O)[NH2+]Cc1cc(Br)cc(F)c1O ZINC000715792397 792511526 /nfs/dbraw/zinc/51/15/26/792511526.db2.gz OQVQIGSVLVSPPU-SKLCBMLGSA-N 1 2 324.215 2.150 20 10 DECDLO C[C@H](C[S@@](C)=O)[NH2+]Cc1cc(Br)cc(F)c1O ZINC000715792396 792511633 /nfs/dbraw/zinc/51/16/33/792511633.db2.gz OQVQIGSVLVSPPU-IWEMQMMOSA-N 1 2 324.215 2.150 20 10 DECDLO Oc1c(F)cc(Br)cc1C[NH2+]C[C@H](O)C1CC1 ZINC000715758078 792511915 /nfs/dbraw/zinc/51/19/15/792511915.db2.gz IDRBLZVLKGHIOI-NSHDSACASA-N 1 2 304.159 2.154 20 10 DECDLO CCOC(=O)c1nn(C)cc1C[NH2+]Cc1cccc(Cl)c1O ZINC001120071871 795402522 /nfs/dbraw/zinc/40/25/22/795402522.db2.gz OFOOWXMYXIFYOC-UHFFFAOYSA-N 1 2 323.780 2.246 20 10 DECDLO COC[C@H]1C[N@@H+](Cc2cc(F)ccc2O)Cc2ncn(C)c21 ZINC001140054298 796471099 /nfs/dbraw/zinc/47/10/99/796471099.db2.gz PADSACVDRDXLMQ-GFCCVEGCSA-N 1 2 305.353 2.011 20 10 DECDLO CCOC(=O)[C@@H]1CSCC[N@@H+]1Cc1c(C)ccc(C)c1O ZINC001140184391 796487710 /nfs/dbraw/zinc/48/77/10/796487710.db2.gz RNYCOGYGVOPZHJ-AWEZNQCLSA-N 1 2 309.431 2.490 20 10 DECDLO CCOC(=O)[C@@H]1CSCC[N@H+]1Cc1c(C)ccc(C)c1O ZINC001140184391 796487711 /nfs/dbraw/zinc/48/77/11/796487711.db2.gz RNYCOGYGVOPZHJ-AWEZNQCLSA-N 1 2 309.431 2.490 20 10 DECDLO CC[C@H]1COCC[N@@H+]1Cc1ccc(N2CCOCC2)cc1F ZINC001140663568 796553475 /nfs/dbraw/zinc/55/34/75/796553475.db2.gz JGYCDFCYXVUITN-HNNXBMFYSA-N 1 2 308.397 2.273 20 10 DECDLO CC[C@H]1COCC[N@H+]1Cc1ccc(N2CCOCC2)cc1F ZINC001140663568 796553480 /nfs/dbraw/zinc/55/34/80/796553480.db2.gz JGYCDFCYXVUITN-HNNXBMFYSA-N 1 2 308.397 2.273 20 10 DECDLO COC(=O)C[C@H]1C[N@H+](Cc2cccc(C(C)(C)C)c2O)CCO1 ZINC001143111137 796803320 /nfs/dbraw/zinc/80/33/20/796803320.db2.gz YYQJXGJSBCAUJW-AWEZNQCLSA-N 1 2 321.417 2.454 20 10 DECDLO COC(=O)C[C@H]1C[N@@H+](Cc2cccc(C(C)(C)C)c2O)CCO1 ZINC001143111137 796803322 /nfs/dbraw/zinc/80/33/22/796803322.db2.gz YYQJXGJSBCAUJW-AWEZNQCLSA-N 1 2 321.417 2.454 20 10 DECDLO C[C@H](CC(=O)NCc1ccc2cccnc2c1O)n1cc[nH+]c1 ZINC001162612290 799130602 /nfs/dbraw/zinc/13/06/02/799130602.db2.gz GMSOENIHSYEKPN-GFCCVEGCSA-N 1 2 310.357 2.404 20 10 DECDLO OC[C@H]1C[C@H](F)C[N@H+](Cc2cc(Br)ccc2O)C1 ZINC001203635640 800097297 /nfs/dbraw/zinc/09/72/97/800097297.db2.gz BVUDITBFRVHXJO-CABZTGNLSA-N 1 2 318.186 2.307 20 10 DECDLO OC[C@H]1C[C@H](F)C[N@@H+](Cc2cc(Br)ccc2O)C1 ZINC001203635640 800097306 /nfs/dbraw/zinc/09/73/06/800097306.db2.gz BVUDITBFRVHXJO-CABZTGNLSA-N 1 2 318.186 2.307 20 10 DECDLO COc1ccc(O)c(C[N@@H+]2CC[C@@](O)(C(F)(F)F)[C@@H](F)C2)c1 ZINC001203669457 800103112 /nfs/dbraw/zinc/10/31/12/800103112.db2.gz CVEURGFPPCVYND-STQMWFEESA-N 1 2 323.286 2.238 20 10 DECDLO COc1ccc(O)c(C[N@H+]2CC[C@@](O)(C(F)(F)F)[C@@H](F)C2)c1 ZINC001203669457 800103117 /nfs/dbraw/zinc/10/31/17/800103117.db2.gz CVEURGFPPCVYND-STQMWFEESA-N 1 2 323.286 2.238 20 10 DECDLO CC(C)N1CC[N@H+](Cc2ccc(N3CCCC3)cc2)CC1=O ZINC001204329142 800205171 /nfs/dbraw/zinc/20/51/71/800205171.db2.gz YNWUMUUUWDSPDJ-UHFFFAOYSA-N 1 2 301.434 2.339 20 10 DECDLO CC(C)N1CC[N@@H+](Cc2ccc(N3CCCC3)cc2)CC1=O ZINC001204329142 800205176 /nfs/dbraw/zinc/20/51/76/800205176.db2.gz YNWUMUUUWDSPDJ-UHFFFAOYSA-N 1 2 301.434 2.339 20 10 DECDLO COc1cc(CN2CC[NH+](Cc3ccco3)CC2)cc(O)c1O ZINC001204341756 800206108 /nfs/dbraw/zinc/20/61/08/800206108.db2.gz GDYZSZHWOHSRKD-UHFFFAOYSA-N 1 2 318.373 2.017 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@H+]2CCC[C@H]2C2OCCO2)c1O ZINC000933905892 800210671 /nfs/dbraw/zinc/21/06/71/800210671.db2.gz VBXMIFPSYKEUSE-AWEZNQCLSA-N 1 2 309.337 2.071 20 10 DECDLO O=C1CC2(CC[NH+](Cc3cccc(Cl)c3O)CC2)CC(=O)N1 ZINC001231912294 801749946 /nfs/dbraw/zinc/74/99/46/801749946.db2.gz CGTZTUZBPRPAGE-UHFFFAOYSA-N 1 2 322.792 2.064 20 10 DECDLO C[N@H+](Cc1nnc2ccccn21)Cc1cc(Cl)c(O)cc1O ZINC001232258566 801830939 /nfs/dbraw/zinc/83/09/39/801830939.db2.gz AOOGKWUQKZZPSQ-UHFFFAOYSA-N 1 2 318.764 2.426 20 10 DECDLO C[N@@H+](Cc1nnc2ccccn21)Cc1cc(Cl)c(O)cc1O ZINC001232258566 801830944 /nfs/dbraw/zinc/83/09/44/801830944.db2.gz AOOGKWUQKZZPSQ-UHFFFAOYSA-N 1 2 318.764 2.426 20 10 DECDLO C[C@@H]1[C@H](CO)CC[N@@H+]1Cc1c(O)cc(Br)cc1F ZINC001233027454 802006996 /nfs/dbraw/zinc/00/69/96/802006996.db2.gz SETUKECWXVOITR-BDAKNGLRSA-N 1 2 318.186 2.497 20 10 DECDLO COC(=O)[C@@H]1C[N@H+](Cc2cc(C(C)(C)C)ccc2O)CCO1 ZINC001233283961 802063866 /nfs/dbraw/zinc/06/38/66/802063866.db2.gz CEIXZEOSCOITHV-HNNXBMFYSA-N 1 2 307.390 2.064 20 10 DECDLO COC(=O)[C@@H]1C[N@@H+](Cc2cc(C(C)(C)C)ccc2O)CCO1 ZINC001233283961 802063875 /nfs/dbraw/zinc/06/38/75/802063875.db2.gz CEIXZEOSCOITHV-HNNXBMFYSA-N 1 2 307.390 2.064 20 10 DECDLO Cc1nnc([C@H]2CCC[N@H+](Cc3cc(F)c(F)cc3O)C2)[nH]1 ZINC001474432699 1060868967 /nfs/dbraw/zinc/86/89/67/1060868967.db2.gz KLKZBNGFFCNAJQ-JTQLQIEISA-N 1 2 308.332 2.477 20 10 DECDLO Cc1nnc([C@H]2CCC[N@@H+](Cc3cc(F)c(F)cc3O)C2)[nH]1 ZINC001474432699 1060868976 /nfs/dbraw/zinc/86/89/76/1060868976.db2.gz KLKZBNGFFCNAJQ-JTQLQIEISA-N 1 2 308.332 2.477 20 10 DECDLO Cc1n[nH]c([C@H]2CCC[N@H+](Cc3cc(F)c(F)cc3O)C2)n1 ZINC001474432699 1060868989 /nfs/dbraw/zinc/86/89/89/1060868989.db2.gz KLKZBNGFFCNAJQ-JTQLQIEISA-N 1 2 308.332 2.477 20 10 DECDLO Cc1n[nH]c([C@H]2CCC[N@@H+](Cc3cc(F)c(F)cc3O)C2)n1 ZINC001474432699 1060868998 /nfs/dbraw/zinc/86/89/98/1060868998.db2.gz KLKZBNGFFCNAJQ-JTQLQIEISA-N 1 2 308.332 2.477 20 10 DECDLO CS(=O)(=O)C[C@@H]1CCCC[N@@H+]1Cc1ccc(Cl)cc1O ZINC001474523821 1060887958 /nfs/dbraw/zinc/88/79/58/1060887958.db2.gz JKRFBSSTNYDBJQ-ZDUSSCGKSA-N 1 2 317.838 2.445 20 10 DECDLO CS(=O)(=O)C[C@@H]1CCCC[N@H+]1Cc1ccc(Cl)cc1O ZINC001474523821 1060887964 /nfs/dbraw/zinc/88/79/64/1060887964.db2.gz JKRFBSSTNYDBJQ-ZDUSSCGKSA-N 1 2 317.838 2.445 20 10 DECDLO NC(=O)N=Nc1ccc(C(=O)NCCCCn2cc[nH+]c2)cc1 ZINC001628261502 1078294434 /nfs/dbraw/zinc/29/44/34/1078294434.db2.gz GPMWFZNWTCEZJJ-UHFFFAOYSA-N 1 2 314.349 2.256 20 10 DECDLO C[C@H]1OCC[C@@]12C[N@H+](Cc1cc(F)c(F)cc1O)C[C@@H](C)O2 ZINC001560803654 1075146042 /nfs/dbraw/zinc/14/60/42/1075146042.db2.gz CDCADHYADBIEQO-GLKRBJQHSA-N 1 2 313.344 2.439 20 10 DECDLO C[C@H]1OCC[C@@]12C[N@@H+](Cc1cc(F)c(F)cc1O)C[C@@H](C)O2 ZINC001560803654 1075146044 /nfs/dbraw/zinc/14/60/44/1075146044.db2.gz CDCADHYADBIEQO-GLKRBJQHSA-N 1 2 313.344 2.439 20 10 DECDLO Nc1[nH+]cccc1CNC(=O)NCCCSc1nccs1 ZINC001564324183 1075172336 /nfs/dbraw/zinc/17/23/36/1075172336.db2.gz UBZJZXUSTXQGSI-UHFFFAOYSA-N 1 2 323.447 2.102 20 10 DECDLO COCCCN(C)CC[NH2+]Cc1cc(Cl)cc(F)c1O ZINC001620821695 1076283719 /nfs/dbraw/zinc/28/37/19/1076283719.db2.gz GYTLPCREWHNVAW-UHFFFAOYSA-N 1 2 304.793 2.243 20 10 DECDLO CO[C@@H]1CCC[C@@H]1C[NH2+][C@H](C)c1cccc(-c2nn[nH]n2)c1O ZINC001591359490 1076733599 /nfs/dbraw/zinc/73/35/99/1076733599.db2.gz DBTUDPPCQTXZTQ-JTNHKYCSSA-N 1 2 317.393 2.038 20 10 DECDLO Cc1c2ccccc2n(C)c1C[NH2+]Cc1nc(C(N)=O)cs1 ZINC001651340064 1079803631 /nfs/dbraw/zinc/80/36/31/1079803631.db2.gz LLDPPEIDEGXRJW-UHFFFAOYSA-N 1 2 314.414 2.332 20 10 DECDLO Cc1cc(O)c(C[NH2+][C@@H](C(N)=O)c2ccccn2)cc1Cl ZINC001652520458 1079881549 /nfs/dbraw/zinc/88/15/49/1079881549.db2.gz ZZLYCDWSNYHLKC-CQSZACIVSA-N 1 2 305.765 2.065 20 10 DECDLO COc1ccc(N2CC3(CC[N@@H+]3Cc3ccc[nH]3)C2)c(OC)c1 ZINC001276994484 1083725273 /nfs/dbraw/zinc/72/52/73/1083725273.db2.gz OZXXALHBILKTRP-UHFFFAOYSA-N 1 2 313.401 2.497 20 10 DECDLO COc1ccc(N2CC3(CC[N@H+]3Cc3ccc[nH]3)C2)c(OC)c1 ZINC001276994484 1083725284 /nfs/dbraw/zinc/72/52/84/1083725284.db2.gz OZXXALHBILKTRP-UHFFFAOYSA-N 1 2 313.401 2.497 20 10 DECDLO OC[C@@H]1CC[N@H+](Cc2cc(F)cc(Br)c2O)C1 ZINC001235301837 1084378714 /nfs/dbraw/zinc/37/87/14/1084378714.db2.gz JKTXDTXQBKECIG-MRVPVSSYSA-N 1 2 304.159 2.108 20 10 DECDLO OC[C@@H]1CC[N@@H+](Cc2cc(F)cc(Br)c2O)C1 ZINC001235301837 1084378721 /nfs/dbraw/zinc/37/87/21/1084378721.db2.gz JKTXDTXQBKECIG-MRVPVSSYSA-N 1 2 304.159 2.108 20 10 DECDLO Oc1cc(C[N@@H+]2CC[C@]23CCOC3)c(O)cc1Br ZINC001236765610 1138417401 /nfs/dbraw/zinc/41/74/01/1138417401.db2.gz QDMVOJCHWCPOGM-CYBMUJFWSA-N 1 2 314.179 2.225 20 10 DECDLO Oc1cc(C[N@H+]2CC[C@]23CCOC3)c(O)cc1Br ZINC001236765610 1138417405 /nfs/dbraw/zinc/41/74/05/1138417405.db2.gz QDMVOJCHWCPOGM-CYBMUJFWSA-N 1 2 314.179 2.225 20 10 DECDLO CCn1cncc1C[NH+]1CCN(c2ccc(OC)cc2)CC1 ZINC001237590382 1138699864 /nfs/dbraw/zinc/69/98/64/1138699864.db2.gz OIVHSKJMASXBAA-UHFFFAOYSA-N 1 2 300.406 2.234 20 10 DECDLO CCc1[nH]ncc1C[N@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC001237651837 1138739066 /nfs/dbraw/zinc/73/90/66/1138739066.db2.gz ZDUQZAAKKGIBMD-UHFFFAOYSA-N 1 2 314.433 2.441 20 10 DECDLO CCc1[nH]ncc1C[N@@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC001237651837 1138739068 /nfs/dbraw/zinc/73/90/68/1138739068.db2.gz ZDUQZAAKKGIBMD-UHFFFAOYSA-N 1 2 314.433 2.441 20 10 DECDLO COC(=O)N1CCC[N@H+](Cc2cc(F)c(Cl)cc2O)CC1 ZINC001237934239 1138811167 /nfs/dbraw/zinc/81/11/67/1138811167.db2.gz JNGORZVHJDAHGO-UHFFFAOYSA-N 1 2 316.760 2.459 20 10 DECDLO COC(=O)N1CCC[N@@H+](Cc2cc(F)c(Cl)cc2O)CC1 ZINC001237934239 1138811168 /nfs/dbraw/zinc/81/11/68/1138811168.db2.gz JNGORZVHJDAHGO-UHFFFAOYSA-N 1 2 316.760 2.459 20 10 DECDLO Oc1cc(Cl)c(F)cc1C[NH+]1CCN(c2cncnc2)CC1 ZINC001237949363 1138811953 /nfs/dbraw/zinc/81/19/53/1138811953.db2.gz KRCLEIJHJNTNLY-UHFFFAOYSA-N 1 2 322.771 2.297 20 10 DECDLO C[C@H]1C(=O)N(C)CC[N@H+]1Cc1ccc2c(c1O)C=CC(C)(C)O2 ZINC001249252202 1141865308 /nfs/dbraw/zinc/86/53/08/1141865308.db2.gz ISJRJRWZCZLZBZ-LBPRGKRZSA-N 1 2 316.401 2.239 20 10 DECDLO C[C@H]1C(=O)N(C)CC[N@@H+]1Cc1ccc2c(c1O)C=CC(C)(C)O2 ZINC001249252202 1141865310 /nfs/dbraw/zinc/86/53/10/1141865310.db2.gz ISJRJRWZCZLZBZ-LBPRGKRZSA-N 1 2 316.401 2.239 20 10 DECDLO CN(C)c1ccc(C[N@@H+]2CCNC(=O)[C@H]2c2ccccc2)cc1 ZINC000092674805 185333093 /nfs/dbraw/zinc/33/30/93/185333093.db2.gz GHTKJXKBSJNQMN-GOSISDBHSA-N 1 2 309.413 2.426 20 10 DECDLO CN(C)c1ccc(C[N@H+]2CCNC(=O)[C@H]2c2ccccc2)cc1 ZINC000092674805 185333094 /nfs/dbraw/zinc/33/30/94/185333094.db2.gz GHTKJXKBSJNQMN-GOSISDBHSA-N 1 2 309.413 2.426 20 10 DECDLO CCCCNC(=O)[C@@H](C)[NH+]1CCN(c2ccc(OC)cc2)CC1 ZINC000042290053 354191682 /nfs/dbraw/zinc/19/16/82/354191682.db2.gz QYIABQDEPMSUIX-OAHLLOKOSA-N 1 2 319.449 2.122 20 10 DECDLO C[C@](O)(C[NH2+]Cc1cc([N+](=O)[O-])ccc1O)c1ccsc1 ZINC000077460660 355206559 /nfs/dbraw/zinc/20/65/59/355206559.db2.gz FFQHCFUMPWHKGW-AWEZNQCLSA-N 1 2 308.359 2.359 20 10 DECDLO C[C@@H]1C[C@H]([NH2+][C@H](C(N)=O)c2ccccn2)c2c1c(F)ccc2O ZINC000834828251 649852638 /nfs/dbraw/zinc/85/26/38/649852638.db2.gz QTHCJZATOVUUHI-ABYOOWDOSA-N 1 2 315.348 2.291 20 10 DECDLO COC(=O)[C@@H]1C[C@H](OC)CC[N@@H+]1Cc1cccc(Cl)c1O ZINC000376821595 533066796 /nfs/dbraw/zinc/06/67/96/533066796.db2.gz FOJCRFNJDZWFJA-YPMHNXCESA-N 1 2 313.781 2.198 20 10 DECDLO COC(=O)[C@@H]1C[C@H](OC)CC[N@H+]1Cc1cccc(Cl)c1O ZINC000376821595 533066798 /nfs/dbraw/zinc/06/67/98/533066798.db2.gz FOJCRFNJDZWFJA-YPMHNXCESA-N 1 2 313.781 2.198 20 10 DECDLO C[C@H]([C@H](C)[NH2+][C@@H](C)c1ccc(F)c(F)c1O)N1CCOCC1 ZINC000187703329 402508878 /nfs/dbraw/zinc/50/88/78/402508878.db2.gz FEDLMSHRYQFHPY-SDDRHHMPSA-N 1 2 314.376 2.430 20 10 DECDLO C[C@H]1CCN(C(=O)c2cccc(O)c2O)C[C@@H]1n1cc[nH+]c1 ZINC000193133459 402766654 /nfs/dbraw/zinc/76/66/54/402766654.db2.gz KTFGTUYHCNTHGR-AAEUAGOBSA-N 1 2 301.346 2.018 20 10 DECDLO COc1c(O)c(C[N@H+](C)Cc2ccccn2)ccc1[N+](=O)[O-] ZINC000278487491 402867071 /nfs/dbraw/zinc/86/70/71/402867071.db2.gz KVAWZRXFZBJZLQ-UHFFFAOYSA-N 1 2 303.318 2.336 20 10 DECDLO COc1c(O)c(C[N@@H+](C)Cc2ccccn2)ccc1[N+](=O)[O-] ZINC000278487491 402867073 /nfs/dbraw/zinc/86/70/73/402867073.db2.gz KVAWZRXFZBJZLQ-UHFFFAOYSA-N 1 2 303.318 2.336 20 10 DECDLO CN(C)c1ccc(C[NH2+]Cc2ncn(C)n2)c(C(F)(F)F)c1 ZINC000280454244 403001084 /nfs/dbraw/zinc/00/10/84/403001084.db2.gz ZEWVSBGNUOEXRQ-UHFFFAOYSA-N 1 2 313.327 2.190 20 10 DECDLO CN(Cc1ccccc1O)c1cc(N2CCSCC2)nc[nH+]1 ZINC000277693172 403245962 /nfs/dbraw/zinc/24/59/62/403245962.db2.gz FZGUNVHLUBXGQI-UHFFFAOYSA-N 1 2 316.430 2.372 20 10 DECDLO CN(Cc1ccccc1O)c1cc(N2CCSCC2)[nH+]cn1 ZINC000277693172 403245963 /nfs/dbraw/zinc/24/59/63/403245963.db2.gz FZGUNVHLUBXGQI-UHFFFAOYSA-N 1 2 316.430 2.372 20 10 DECDLO COc1ccc(O)c(C[NH2+][C@@H]2CS(=O)(=O)c3ccccc32)c1 ZINC000290312057 404120244 /nfs/dbraw/zinc/12/02/44/404120244.db2.gz CFHHWCNYEPJVGO-CQSZACIVSA-N 1 2 319.382 2.019 20 10 DECDLO C[C@@H](CC(=O)N1CCOc2cc(N(C)C)ccc21)n1cc[nH+]c1 ZINC000516476516 338013333 /nfs/dbraw/zinc/01/33/33/338013333.db2.gz RUSYOXJPOFARPP-ZDUSSCGKSA-N 1 2 314.389 2.326 20 10 DECDLO CC[N@H+](C/C=C\c1ccc(N(C)C)cc1)[C@H]1CCS(=O)(=O)C1 ZINC000835025021 649867901 /nfs/dbraw/zinc/86/79/01/649867901.db2.gz FQQRPAKGKJOROP-OSJSJHBBSA-N 1 2 322.474 2.275 20 10 DECDLO CC[N@@H+](C/C=C\c1ccc(N(C)C)cc1)[C@H]1CCS(=O)(=O)C1 ZINC000835025021 649867902 /nfs/dbraw/zinc/86/79/02/649867902.db2.gz FQQRPAKGKJOROP-OSJSJHBBSA-N 1 2 322.474 2.275 20 10 DECDLO Cn1c(Cl)cnc1C[N@H+](C)Cc1cc2c(cc1O)OCO2 ZINC000180287091 523582080 /nfs/dbraw/zinc/58/20/80/523582080.db2.gz HWXXTTVCHXMOKG-UHFFFAOYSA-N 1 2 309.753 2.140 20 10 DECDLO Cn1c(Cl)cnc1C[N@@H+](C)Cc1cc2c(cc1O)OCO2 ZINC000180287091 523582085 /nfs/dbraw/zinc/58/20/85/523582085.db2.gz HWXXTTVCHXMOKG-UHFFFAOYSA-N 1 2 309.753 2.140 20 10 DECDLO CCC(=O)N1CCC[N@H+](Cc2cc(F)cc(C(C)=O)c2O)CC1 ZINC000371886207 528306095 /nfs/dbraw/zinc/30/60/95/528306095.db2.gz QKMCJENLYIQMBQ-UHFFFAOYSA-N 1 2 322.380 2.178 20 10 DECDLO CCC(=O)N1CCC[N@@H+](Cc2cc(F)cc(C(C)=O)c2O)CC1 ZINC000371886207 528306097 /nfs/dbraw/zinc/30/60/97/528306097.db2.gz QKMCJENLYIQMBQ-UHFFFAOYSA-N 1 2 322.380 2.178 20 10 DECDLO COC(=O)[C@@H]1CC12CC[NH+](Cc1cc(F)cc(F)c1O)CC2 ZINC000894026821 636095448 /nfs/dbraw/zinc/09/54/48/636095448.db2.gz JBVXHSRYVPBCAN-LBPRGKRZSA-N 1 2 311.328 2.446 20 10 DECDLO CC[C@@H](C[NH2+]Cc1cccc(Br)c1O)C(=O)OC ZINC000895120684 637599182 /nfs/dbraw/zinc/59/91/82/637599182.db2.gz QSAWMALHGKEOOL-VIFPVBQESA-N 1 2 316.195 2.444 20 10 DECDLO CC1(CO)C[NH+](Cc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)C1 ZINC000839144857 637788920 /nfs/dbraw/zinc/78/89/20/637788920.db2.gz BMJHPUBZIDIBHY-UHFFFAOYSA-N 1 2 319.405 2.399 20 10 DECDLO COC(=O)[C@H](COC(C)C)[N@H+](C)Cc1ccc(N(C)C)cc1C ZINC000840921286 650383591 /nfs/dbraw/zinc/38/35/91/650383591.db2.gz QZYWGGJKXDZDRS-KRWDZBQOSA-N 1 2 322.449 2.459 20 10 DECDLO COC(=O)[C@H](COC(C)C)[N@@H+](C)Cc1ccc(N(C)C)cc1C ZINC000840921286 650383594 /nfs/dbraw/zinc/38/35/94/650383594.db2.gz QZYWGGJKXDZDRS-KRWDZBQOSA-N 1 2 322.449 2.459 20 10 DECDLO CCS(=O)(=O)CCC[NH2+]Cc1cc(Cl)cc(F)c1O ZINC000840973805 650397584 /nfs/dbraw/zinc/39/75/84/650397584.db2.gz VKGQJIQQNARINF-UHFFFAOYSA-N 1 2 309.790 2.099 20 10 DECDLO Cc1cn(C(C)(C)C(=O)NCc2ccc(N(C)C)c(F)c2)c[nH+]1 ZINC000895980174 638294795 /nfs/dbraw/zinc/29/47/95/638294795.db2.gz DDYFVBNFDKQTER-UHFFFAOYSA-N 1 2 318.396 2.448 20 10 DECDLO C[C@H]1C[N@H+](Cc2cc(Br)cc(F)c2O)C[C@H]1O ZINC000897675787 640898740 /nfs/dbraw/zinc/89/87/40/640898740.db2.gz CAGVVBWZNXSKGU-WRWORJQWSA-N 1 2 304.159 2.106 20 10 DECDLO C[C@H]1C[N@@H+](Cc2cc(Br)cc(F)c2O)C[C@H]1O ZINC000897675787 640898744 /nfs/dbraw/zinc/89/87/44/640898744.db2.gz CAGVVBWZNXSKGU-WRWORJQWSA-N 1 2 304.159 2.106 20 10 DECDLO Cc1cc(Br)cc(C[N@@H+]2CC[C@@H](O)[C@H](F)C2)c1O ZINC000898188861 641054773 /nfs/dbraw/zinc/05/47/73/641054773.db2.gz VBCNJKUEAVIFMC-VXGBXAGGSA-N 1 2 318.186 2.368 20 10 DECDLO Cc1cc(Br)cc(C[N@H+]2CC[C@@H](O)[C@H](F)C2)c1O ZINC000898188861 641054775 /nfs/dbraw/zinc/05/47/75/641054775.db2.gz VBCNJKUEAVIFMC-VXGBXAGGSA-N 1 2 318.186 2.368 20 10 DECDLO Cc1nc(N(C)C)nc(NCc2ccc(N3CCCC3)cc2)[nH+]1 ZINC000768515657 641091361 /nfs/dbraw/zinc/09/13/61/641091361.db2.gz GIJOJTBATHDSBS-UHFFFAOYSA-N 1 2 312.421 2.458 20 10 DECDLO COc1cccc(O)c1C[NH+]1CCN([C@@H](C)C(F)(F)F)CC1 ZINC000769555441 641258845 /nfs/dbraw/zinc/25/88/45/641258845.db2.gz UIMXIUMWVVOYDT-NSHDSACASA-N 1 2 318.339 2.469 20 10 DECDLO C[C@H]1CC[N@H+](CC(=O)NCc2ccc(N(C)C)cc2)C[C@@H]1F ZINC000778229622 642356654 /nfs/dbraw/zinc/35/66/54/642356654.db2.gz AFNBFOLEWZHVGR-BBRMVZONSA-N 1 2 307.413 2.049 20 10 DECDLO C[C@H]1CC[N@@H+](CC(=O)NCc2ccc(N(C)C)cc2)C[C@@H]1F ZINC000778229622 642356661 /nfs/dbraw/zinc/35/66/61/642356661.db2.gz AFNBFOLEWZHVGR-BBRMVZONSA-N 1 2 307.413 2.049 20 10 DECDLO C[C@H]1CC[N@H+](CC(=O)NCc2ccc(N(C)C)cc2)C[C@H]1F ZINC000778229674 642357374 /nfs/dbraw/zinc/35/73/74/642357374.db2.gz AFNBFOLEWZHVGR-XJKSGUPXSA-N 1 2 307.413 2.049 20 10 DECDLO C[C@H]1CC[N@@H+](CC(=O)NCc2ccc(N(C)C)cc2)C[C@H]1F ZINC000778229674 642357377 /nfs/dbraw/zinc/35/73/77/642357377.db2.gz AFNBFOLEWZHVGR-XJKSGUPXSA-N 1 2 307.413 2.049 20 10 DECDLO Oc1ccccc1C[N@@H+]1CCO[C@@H](c2noc(C3CC3)n2)C1 ZINC000779005164 642454634 /nfs/dbraw/zinc/45/46/34/642454634.db2.gz GJSVWIZOPRYQIY-CQSZACIVSA-N 1 2 301.346 2.226 20 10 DECDLO Oc1ccccc1C[N@H+]1CCO[C@@H](c2noc(C3CC3)n2)C1 ZINC000779005164 642454639 /nfs/dbraw/zinc/45/46/39/642454639.db2.gz GJSVWIZOPRYQIY-CQSZACIVSA-N 1 2 301.346 2.226 20 10 DECDLO COCCn1cc(C[NH2+]Cc2cc(Cl)cc(F)c2O)cn1 ZINC000800526686 645284222 /nfs/dbraw/zinc/28/42/22/645284222.db2.gz BVACSYLDMPPHPF-UHFFFAOYSA-N 1 2 313.760 2.317 20 10 DECDLO O=C(NCc1ccc(N2CCCC2)cc1)[C@@H]1CCc2c[nH+]cn2C1 ZINC000816866889 647191846 /nfs/dbraw/zinc/19/18/46/647191846.db2.gz ZUJREOKLEXKBMV-MRXNPFEDSA-N 1 2 324.428 2.362 20 10 DECDLO O=C(NCCCCn1cc[nH+]c1)NCc1c(O)cccc1F ZINC000914308769 647262130 /nfs/dbraw/zinc/26/21/30/647262130.db2.gz ZPXDTKHVSORTQK-UHFFFAOYSA-N 1 2 306.341 2.007 20 10 DECDLO C[C@@H]([NH2+]C[C@@H]1C[NH2+]CCO1)c1ccc(Cl)c(Cl)c1[O-] ZINC000817984157 647400316 /nfs/dbraw/zinc/40/03/16/647400316.db2.gz VMGVCGPQSBAFRY-BDAKNGLRSA-N 1 2 305.205 2.338 20 10 DECDLO C[C@H]([NH2+]CCCCS(C)(=O)=O)c1cc(F)cc(F)c1O ZINC000818351555 647457492 /nfs/dbraw/zinc/45/74/92/647457492.db2.gz UJINSUXIJCNAPD-VIFPVBQESA-N 1 2 307.362 2.146 20 10 DECDLO OCCCN1CCC[C@H]1C[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000824565412 648611269 /nfs/dbraw/zinc/61/12/69/648611269.db2.gz UGVUYNWEXRSSRL-LBPRGKRZSA-N 1 2 316.804 2.121 20 10 DECDLO CCn1ccnc1[C@H](C)[NH2+]Cc1ccc([N+](=O)[O-])c(OC)c1O ZINC000825006068 648684449 /nfs/dbraw/zinc/68/44/49/648684449.db2.gz XVJSOVKXWKXIGS-JTQLQIEISA-N 1 2 320.349 2.376 20 10 DECDLO Cc1cc(O)c(C[N@H+]2CCC[C@@H](S(C)(=O)=O)C2)cc1Cl ZINC000825520187 648774879 /nfs/dbraw/zinc/77/48/79/648774879.db2.gz VSBFEQGAQUUDPS-GFCCVEGCSA-N 1 2 317.838 2.363 20 10 DECDLO C[C@@H]1CC[C@@H]([NH2+]Cc2cc(Cl)cc(F)c2O)CS1(=O)=O ZINC000827169981 648986075 /nfs/dbraw/zinc/98/60/75/648986075.db2.gz GZNUZIJDHUQHPM-LDYMZIIASA-N 1 2 321.801 2.240 20 10 DECDLO O=C1OCCN1C1CC[NH+](Cc2cccc(Cl)c2O)CC1 ZINC000827740573 649078491 /nfs/dbraw/zinc/07/84/91/649078491.db2.gz BUMFKAFTVYFFHB-UHFFFAOYSA-N 1 2 310.781 2.462 20 10 DECDLO O=C(NCc1cc(Cl)ccc1O)N[C@H]1CCn2cc[nH+]c2C1 ZINC000845126883 651207358 /nfs/dbraw/zinc/20/73/58/651207358.db2.gz DESJMOZULRIVTH-LBPRGKRZSA-N 1 2 320.780 2.056 20 10 DECDLO Oc1c(F)cc(Cl)cc1C[NH2+]CC[C@@]1(O)CCCOC1 ZINC000846108614 651308512 /nfs/dbraw/zinc/30/85/12/651308512.db2.gz QESYSFLFZHNVKS-AWEZNQCLSA-N 1 2 303.761 2.206 20 10 DECDLO C[C@H](Cc1c[nH]c[nH+]1)C(=O)NCc1ccc(N(C)C)c(F)c1 ZINC000847405175 651394235 /nfs/dbraw/zinc/39/42/35/651394235.db2.gz ASJKAYIZVPLBER-LLVKDONJSA-N 1 2 304.369 2.110 20 10 DECDLO C[C@H](Cc1c[nH+]c[nH]1)C(=O)NCc1ccc(N(C)C)c(F)c1 ZINC000847405175 651394236 /nfs/dbraw/zinc/39/42/36/651394236.db2.gz ASJKAYIZVPLBER-LLVKDONJSA-N 1 2 304.369 2.110 20 10 DECDLO CCc1cccc(C[NH2+]Cc2nc([C@@H]3CCCO3)n[nH]2)c1O ZINC000848923592 651563410 /nfs/dbraw/zinc/56/34/10/651563410.db2.gz GSLQLXWSWXLVPX-ZDUSSCGKSA-N 1 2 302.378 2.214 20 10 DECDLO CS(=O)(=O)CCC[N@H+](Cc1ccco1)Cc1ccccc1O ZINC000109761025 652070150 /nfs/dbraw/zinc/07/01/50/652070150.db2.gz YBUQMGRKWQKBDD-UHFFFAOYSA-N 1 2 323.414 2.422 20 10 DECDLO CS(=O)(=O)CCC[N@@H+](Cc1ccco1)Cc1ccccc1O ZINC000109761025 652070152 /nfs/dbraw/zinc/07/01/52/652070152.db2.gz YBUQMGRKWQKBDD-UHFFFAOYSA-N 1 2 323.414 2.422 20 10 DECDLO C[C@@H](CS(C)(=O)=O)[N@H+](Cc1cc(Cl)ccc1O)C1CC1 ZINC000093392309 684049363 /nfs/dbraw/zinc/04/93/63/684049363.db2.gz QHINJDSDZIZROJ-JTQLQIEISA-N 1 2 317.838 2.443 20 10 DECDLO C[C@@H](CS(C)(=O)=O)[N@@H+](Cc1cc(Cl)ccc1O)C1CC1 ZINC000093392309 684049366 /nfs/dbraw/zinc/04/93/66/684049366.db2.gz QHINJDSDZIZROJ-JTQLQIEISA-N 1 2 317.838 2.443 20 10 DECDLO O=C(NCc1ccc2cccnc2c1O)[C@H]1CCn2cc[nH+]c2C1 ZINC000862025039 686224614 /nfs/dbraw/zinc/22/46/14/686224614.db2.gz LRHMBSKGARCVME-ZDUSSCGKSA-N 1 2 322.368 2.016 20 10 DECDLO Cc1cccc(O)c1C[N@@H+]1CCNC(=O)[C@@H]1c1cccs1 ZINC000876764501 689930000 /nfs/dbraw/zinc/93/00/00/689930000.db2.gz PWSVREQGSQKMBW-HNNXBMFYSA-N 1 2 302.399 2.435 20 10 DECDLO Cc1cccc(O)c1C[N@H+]1CCNC(=O)[C@@H]1c1cccs1 ZINC000876764501 689930004 /nfs/dbraw/zinc/93/00/04/689930004.db2.gz PWSVREQGSQKMBW-HNNXBMFYSA-N 1 2 302.399 2.435 20 10 DECDLO Cc1noc([C@H](C)[NH2+]Cc2ccc(N3CCC(O)CC3)cc2)n1 ZINC000877469869 690122906 /nfs/dbraw/zinc/12/29/06/690122906.db2.gz APWDUKQIOSYORC-LBPRGKRZSA-N 1 2 316.405 2.190 20 10 DECDLO OC[C@@H]([NH2+]Cc1cc(Br)cc(F)c1O)C1CC1 ZINC000883001362 691406868 /nfs/dbraw/zinc/40/68/68/691406868.db2.gz BVKNCOVDODDLJI-LLVKDONJSA-N 1 2 304.159 2.154 20 10 DECDLO CCOC[C@H]1C[N@H+](Cc2cccc(F)c2O)Cc2cnn(C)c21 ZINC001138124989 796166569 /nfs/dbraw/zinc/16/65/69/796166569.db2.gz GIPXEDADPGRWJS-CQSZACIVSA-N 1 2 319.380 2.401 20 10 DECDLO CCOC[C@H]1C[N@@H+](Cc2cccc(F)c2O)Cc2cnn(C)c21 ZINC001138124989 796166572 /nfs/dbraw/zinc/16/65/72/796166572.db2.gz GIPXEDADPGRWJS-CQSZACIVSA-N 1 2 319.380 2.401 20 10 DECDLO COC[C@@H]1C[N@H+](Cc2cccc(F)c2O)Cc2cn(C)nc21 ZINC001138125191 796167437 /nfs/dbraw/zinc/16/74/37/796167437.db2.gz KLBAOOZCVUPLQF-ZDUSSCGKSA-N 1 2 305.353 2.011 20 10 DECDLO COC[C@@H]1C[N@@H+](Cc2cccc(F)c2O)Cc2cn(C)nc21 ZINC001138125191 796167439 /nfs/dbraw/zinc/16/74/39/796167439.db2.gz KLBAOOZCVUPLQF-ZDUSSCGKSA-N 1 2 305.353 2.011 20 10 DECDLO CCN(CC)c1ccc(C[N@H+](C)CC(=O)N(C)C)c(OC)c1 ZINC001138389137 796210961 /nfs/dbraw/zinc/21/09/61/796210961.db2.gz KVELWBXTBVRKDB-UHFFFAOYSA-N 1 2 307.438 2.061 20 10 DECDLO CCN(CC)c1ccc(C[N@@H+](C)CC(=O)N(C)C)c(OC)c1 ZINC001138389137 796210967 /nfs/dbraw/zinc/21/09/67/796210967.db2.gz KVELWBXTBVRKDB-UHFFFAOYSA-N 1 2 307.438 2.061 20 10 DECDLO CCN(CC)c1ccc(C[N@@H+]2C[C@@H]3C[C@H]2CN3C)c(OC)c1 ZINC001138392142 796211764 /nfs/dbraw/zinc/21/17/64/796211764.db2.gz RRXCDLFNCQKJNP-IRXDYDNUSA-N 1 2 303.450 2.430 20 10 DECDLO CCN(CC)c1ccc(C[N@H+]2C[C@@H]3C[C@H]2CN3C)c(OC)c1 ZINC001138392142 796211766 /nfs/dbraw/zinc/21/17/66/796211766.db2.gz RRXCDLFNCQKJNP-IRXDYDNUSA-N 1 2 303.450 2.430 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CC[C@@H](C)[C@](C)(O)C1 ZINC001139126877 796327098 /nfs/dbraw/zinc/32/70/98/796327098.db2.gz SUKQKNWUYGJYMS-KZULUSFZSA-N 1 2 317.385 2.400 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CC[C@@H](C)[C@](C)(O)C1 ZINC001139126877 796327101 /nfs/dbraw/zinc/32/71/01/796327101.db2.gz SUKQKNWUYGJYMS-KZULUSFZSA-N 1 2 317.385 2.400 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CC[C@@H](O)[C@@H](C)CC1 ZINC001139126849 796327293 /nfs/dbraw/zinc/32/72/93/796327293.db2.gz RZUFBDWNTLCWMH-XHDPSFHLSA-N 1 2 317.385 2.400 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CC[C@@H](O)[C@@H](C)CC1 ZINC001139126849 796327297 /nfs/dbraw/zinc/32/72/97/796327297.db2.gz RZUFBDWNTLCWMH-XHDPSFHLSA-N 1 2 317.385 2.400 20 10 DECDLO COc1ncnc2c1CC[N@H+](Cc1c(O)cccc1Cl)C2 ZINC001140341492 796509927 /nfs/dbraw/zinc/50/99/27/796509927.db2.gz RFXQGXBCBDPRHJ-UHFFFAOYSA-N 1 2 305.765 2.403 20 10 DECDLO COc1ncnc2c1CC[N@@H+](Cc1c(O)cccc1Cl)C2 ZINC001140341492 796509930 /nfs/dbraw/zinc/50/99/30/796509930.db2.gz RFXQGXBCBDPRHJ-UHFFFAOYSA-N 1 2 305.765 2.403 20 10 DECDLO COC[C@@H]1C[N@H+](Cc2cc(F)c(F)cc2O)Cc2cn(C)nc21 ZINC001142512997 796747101 /nfs/dbraw/zinc/74/71/01/796747101.db2.gz SDDUUBDZDIUGJU-LBPRGKRZSA-N 1 2 323.343 2.150 20 10 DECDLO COC[C@@H]1C[N@@H+](Cc2cc(F)c(F)cc2O)Cc2cn(C)nc21 ZINC001142512997 796747107 /nfs/dbraw/zinc/74/71/07/796747107.db2.gz SDDUUBDZDIUGJU-LBPRGKRZSA-N 1 2 323.343 2.150 20 10 DECDLO OC[C@@H]1C[C@@H](F)C[N@H+](Cc2cc(Br)ccc2O)C1 ZINC001203635638 800096526 /nfs/dbraw/zinc/09/65/26/800096526.db2.gz BVUDITBFRVHXJO-BXKDBHETSA-N 1 2 318.186 2.307 20 10 DECDLO OC[C@@H]1C[C@@H](F)C[N@@H+](Cc2cc(Br)ccc2O)C1 ZINC001203635638 800096534 /nfs/dbraw/zinc/09/65/34/800096534.db2.gz BVUDITBFRVHXJO-BXKDBHETSA-N 1 2 318.186 2.307 20 10 DECDLO COc1cc(N(C)C)ccc1C[N@@H+]1CC[C@](O)(CF)[C@@H](F)C1 ZINC001231848903 801737420 /nfs/dbraw/zinc/73/74/20/801737420.db2.gz KVRPUGDVAZOUPX-HOTGVXAUSA-N 1 2 314.376 2.006 20 10 DECDLO COc1cc(N(C)C)ccc1C[N@H+]1CC[C@](O)(CF)[C@@H](F)C1 ZINC001231848903 801737424 /nfs/dbraw/zinc/73/74/24/801737424.db2.gz KVRPUGDVAZOUPX-HOTGVXAUSA-N 1 2 314.376 2.006 20 10 DECDLO Oc1c(Cl)cccc1C[N@@H+]1CC[C@H](Oc2cnccn2)C1 ZINC001231912975 801749565 /nfs/dbraw/zinc/74/95/65/801749565.db2.gz BKGOQHDASCDNEU-LBPRGKRZSA-N 1 2 305.765 2.489 20 10 DECDLO Oc1c(Cl)cccc1C[N@H+]1CC[C@H](Oc2cnccn2)C1 ZINC001231912975 801749571 /nfs/dbraw/zinc/74/95/71/801749571.db2.gz BKGOQHDASCDNEU-LBPRGKRZSA-N 1 2 305.765 2.489 20 10 DECDLO COC(=O)[C@H]1[C@@H]2CC[C@@H](C2)[N@H+]1Cc1cc(Cl)c(O)cc1O ZINC001232264626 801833200 /nfs/dbraw/zinc/83/32/00/801833200.db2.gz KJEZIIBMCRARHB-IPURGOFSSA-N 1 2 311.765 2.277 20 10 DECDLO CC[N@H+](CC(=O)OC)Cc1cccc(OC(F)(F)F)c1O ZINC001233775921 802207972 /nfs/dbraw/zinc/20/79/72/802207972.db2.gz GPRZSPJWONSXFK-UHFFFAOYSA-N 1 2 307.268 2.286 20 10 DECDLO CC[N@@H+](CC(=O)OC)Cc1cccc(OC(F)(F)F)c1O ZINC001233775921 802207977 /nfs/dbraw/zinc/20/79/77/802207977.db2.gz GPRZSPJWONSXFK-UHFFFAOYSA-N 1 2 307.268 2.286 20 10 DECDLO COc1c(C)c[nH+]c(CNC(=O)NCc2ccc(N)cc2)c1C ZINC001335440483 1150416666 /nfs/dbraw/zinc/41/66/66/1150416666.db2.gz LRPIUGKXCNCTFL-UHFFFAOYSA-N 1 2 314.389 2.289 20 10 DECDLO CC(C)O[C@H]1C[C@@H]([NH2+][C@@H](C)c2cccc(-c3nn[nH]n3)c2O)C1 ZINC001603356572 1069954398 /nfs/dbraw/zinc/95/43/98/1069954398.db2.gz DRHKPSDRAZWKIO-SDDRHHMPSA-N 1 2 317.393 2.179 20 10 DECDLO C[C@@H]([NH2+]C[C@@H]1CCO[C@H](C)C1)c1cccc(-c2nn[nH]n2)c1O ZINC001603851266 1070121583 /nfs/dbraw/zinc/12/15/83/1070121583.db2.gz WGHCEJLFKNVYGA-IJLUTSLNSA-N 1 2 317.393 2.038 20 10 DECDLO O=C(CCCn1cc[nH+]c1)NCc1ccc2cccnc2c1O ZINC001451957420 1056966927 /nfs/dbraw/zinc/96/69/27/1056966927.db2.gz SWFOOLHDLKCSJO-UHFFFAOYSA-N 1 2 310.357 2.234 20 10 DECDLO C[C@@H]([NH2+]Cc1cc(Cl)cc(F)c1O)[C@H](C)N1CCOCC1 ZINC001461178288 1058601331 /nfs/dbraw/zinc/60/13/31/1058601331.db2.gz UGSORSSSTUGAJU-MNOVXSKESA-N 1 2 316.804 2.384 20 10 DECDLO C[C@@H]([NH2+][C@@H](C)c1cccc(-c2nn[nH]n2)c1O)c1cscn1 ZINC001589952295 1076533816 /nfs/dbraw/zinc/53/38/16/1076533816.db2.gz MUJIMMGBWBFBPJ-DTWKUNHWSA-N 1 2 316.390 2.441 20 10 DECDLO C[C@@H]([NH2+][C@H](C)c1cccc(-c2nn[nH]n2)c1O)c1cscn1 ZINC001589952299 1076534017 /nfs/dbraw/zinc/53/40/17/1076534017.db2.gz MUJIMMGBWBFBPJ-RKDXNWHRSA-N 1 2 316.390 2.441 20 10 DECDLO C[C@H]([NH2+]C[C@@H]1CCC(C)(C)O1)c1cccc(-c2nn[nH]n2)c1O ZINC001589961168 1076537711 /nfs/dbraw/zinc/53/77/11/1076537711.db2.gz BQLLWDYAQBPRLD-QWRGUYRKSA-N 1 2 317.393 2.181 20 10 DECDLO CC[C@@H]([NH2+]C[C@H](C)CCOC)c1cccc(-c2nn[nH]n2)c1O ZINC001590464869 1076632710 /nfs/dbraw/zinc/63/27/10/1076632710.db2.gz QSDGRFKTFZEDSG-BXUZGUMPSA-N 1 2 319.409 2.286 20 10 DECDLO CC[C@H]([NH2+]C[C@@]1(C)CCCO1)c1cccc(-c2nn[nH]n2)c1O ZINC001590465131 1076633503 /nfs/dbraw/zinc/63/35/03/1076633503.db2.gz SPEMQAWVEZLJSQ-XJKSGUPXSA-N 1 2 317.393 2.182 20 10 DECDLO Cc1cccc(CC[NH2+][C@H](C)c2cccc(-c3nn[nH]n3)c2O)n1 ZINC001592229687 1076877977 /nfs/dbraw/zinc/87/79/77/1076877977.db2.gz PVDARFCFUKCEHG-GFCCVEGCSA-N 1 2 324.388 2.169 20 10 DECDLO C[C@H](CO[C@H]1CCOC1)[NH2+]Cc1cc(Cl)cc(F)c1O ZINC001657545906 1080177358 /nfs/dbraw/zinc/17/73/58/1080177358.db2.gz YQEJKTFPYPZMEF-SKDRFNHKSA-N 1 2 303.761 2.468 20 10 DECDLO NC(=O)[C@@H]1C[C@H](F)C[N@@H+]1Cc1cccc(-c2ccccc2)c1O ZINC001234996666 1084263566 /nfs/dbraw/zinc/26/35/66/1084263566.db2.gz LUHXIUBWSWMTFE-HOCLYGCPSA-N 1 2 314.360 2.457 20 10 DECDLO NC(=O)[C@@H]1C[C@H](F)C[N@H+]1Cc1cccc(-c2ccccc2)c1O ZINC001234996666 1084263574 /nfs/dbraw/zinc/26/35/74/1084263574.db2.gz LUHXIUBWSWMTFE-HOCLYGCPSA-N 1 2 314.360 2.457 20 10 DECDLO CC[N@H+](CC(=O)N(C)C)Cc1c(O)cccc1Br ZINC000707153371 1086662608 /nfs/dbraw/zinc/66/26/08/1086662608.db2.gz WGVSBZMNGZBUBX-UHFFFAOYSA-N 1 2 315.211 2.065 20 10 DECDLO CC[N@@H+](CC(=O)N(C)C)Cc1c(O)cccc1Br ZINC000707153371 1086662612 /nfs/dbraw/zinc/66/26/12/1086662612.db2.gz WGVSBZMNGZBUBX-UHFFFAOYSA-N 1 2 315.211 2.065 20 10 DECDLO CCNC(=O)C[NH2+]Cc1cc(Cl)cc(Br)c1O ZINC000708091371 1086677010 /nfs/dbraw/zinc/67/70/10/1086677010.db2.gz SXRDTGTWUDOWOL-UHFFFAOYSA-N 1 2 321.602 2.034 20 10 DECDLO CN1CC[C@]2(CCC[N@@H+]2Cc2c(O)ccc(F)c2Cl)C1=O ZINC001274823508 1091433133 /nfs/dbraw/zinc/43/31/33/1091433133.db2.gz VMIWRKVUOFDRRI-OAHLLOKOSA-N 1 2 312.772 2.381 20 10 DECDLO CN1CC[C@]2(CCC[N@H+]2Cc2c(O)ccc(F)c2Cl)C1=O ZINC001274823508 1091433140 /nfs/dbraw/zinc/43/31/40/1091433140.db2.gz VMIWRKVUOFDRRI-OAHLLOKOSA-N 1 2 312.772 2.381 20 10 DECDLO COC(=O)C[C@@H]1C[N@H+](Cc2ccc(C(C)C)cc2O)CCO1 ZINC001237047887 1138489629 /nfs/dbraw/zinc/48/96/29/1138489629.db2.gz ALLVNKBNZHQEJD-OAHLLOKOSA-N 1 2 307.390 2.280 20 10 DECDLO COC(=O)C[C@@H]1C[N@@H+](Cc2ccc(C(C)C)cc2O)CCO1 ZINC001237047887 1138489632 /nfs/dbraw/zinc/48/96/32/1138489632.db2.gz ALLVNKBNZHQEJD-OAHLLOKOSA-N 1 2 307.390 2.280 20 10 DECDLO C[C@@]1(CO)CC[N@H+](Cc2c(O)ccc(Cl)c2Cl)C[C@@H]1O ZINC001237077006 1138498584 /nfs/dbraw/zinc/49/85/84/1138498584.db2.gz BMGFWMSEZDTXBI-JSGCOSHPSA-N 1 2 320.216 2.264 20 10 DECDLO C[C@@]1(CO)CC[N@@H+](Cc2c(O)ccc(Cl)c2Cl)C[C@@H]1O ZINC001237077006 1138498594 /nfs/dbraw/zinc/49/85/94/1138498594.db2.gz BMGFWMSEZDTXBI-JSGCOSHPSA-N 1 2 320.216 2.264 20 10 DECDLO Cc1cc(C[N@@H+]2C[C@@H](F)C[C@H]2CO)c(O)cc1Br ZINC001250120680 1142084929 /nfs/dbraw/zinc/08/49/29/1142084929.db2.gz MKGYUJHGISRRCU-QWRGUYRKSA-N 1 2 318.186 2.368 20 10 DECDLO Cc1cc(C[N@H+]2C[C@@H](F)C[C@H]2CO)c(O)cc1Br ZINC001250120680 1142084940 /nfs/dbraw/zinc/08/49/40/1142084940.db2.gz MKGYUJHGISRRCU-QWRGUYRKSA-N 1 2 318.186 2.368 20 10 DECDLO C[C@@H]1C[C@@H]1c1nnc(-c2ccc(O)c(C[NH+]3CCOCC3)c2)o1 ZINC001256774285 1143866929 /nfs/dbraw/zinc/86/69/29/1143866929.db2.gz RHWJIDOYHFMTTG-RISCZKNCSA-N 1 2 315.373 2.398 20 10 DECDLO COc1ccc(N2CC[NH+](Cc3cc(C)n[nH]3)CC2)cc1F ZINC001324775174 1147842792 /nfs/dbraw/zinc/84/27/92/1147842792.db2.gz CXGSDWPJCKIWGZ-UHFFFAOYSA-N 1 2 304.369 2.188 20 10 DECDLO CN1CCCc2cc(CNC(=O)[C@H]3CCn4c[nH+]cc4C3)ccc21 ZINC000131666974 530065882 /nfs/dbraw/zinc/06/58/82/530065882.db2.gz NEXSFFHFLGTZHN-INIZCTEOSA-N 1 2 324.428 2.144 20 10 DECDLO NC(=O)N1CCC[N@H+](Cc2cc(Cl)cc(Cl)c2O)CC1 ZINC000092754160 193188158 /nfs/dbraw/zinc/18/81/58/193188158.db2.gz YHGFEUYDXJVPGZ-UHFFFAOYSA-N 1 2 318.204 2.285 20 10 DECDLO NC(=O)N1CCC[N@@H+](Cc2cc(Cl)cc(Cl)c2O)CC1 ZINC000092754160 193188160 /nfs/dbraw/zinc/18/81/60/193188160.db2.gz YHGFEUYDXJVPGZ-UHFFFAOYSA-N 1 2 318.204 2.285 20 10 DECDLO COCC[N@H+](CC(=O)OC)Cc1ccc(N2CCCCC2)cc1 ZINC000093416143 193246937 /nfs/dbraw/zinc/24/69/37/193246937.db2.gz HGFDYZCYGKMIQO-UHFFFAOYSA-N 1 2 320.433 2.298 20 10 DECDLO COCC[N@@H+](CC(=O)OC)Cc1ccc(N2CCCCC2)cc1 ZINC000093416143 193246939 /nfs/dbraw/zinc/24/69/39/193246939.db2.gz HGFDYZCYGKMIQO-UHFFFAOYSA-N 1 2 320.433 2.298 20 10 DECDLO CC[N@H+](Cc1ccc(N(C)C)c(F)c1)[C@@H](C)CS(C)(=O)=O ZINC000126215040 285100261 /nfs/dbraw/zinc/10/02/61/285100261.db2.gz YGFFSOBDIBSOOT-LBPRGKRZSA-N 1 2 316.442 2.147 20 10 DECDLO CC[N@@H+](Cc1ccc(N(C)C)c(F)c1)[C@@H](C)CS(C)(=O)=O ZINC000126215040 285100262 /nfs/dbraw/zinc/10/02/62/285100262.db2.gz YGFFSOBDIBSOOT-LBPRGKRZSA-N 1 2 316.442 2.147 20 10 DECDLO COC(=O)[C@H]1C[C@@H](OC)CC[N@@H+]1Cc1cc(Cl)ccc1O ZINC000370365386 533540963 /nfs/dbraw/zinc/54/09/63/533540963.db2.gz FOXYHWYKEXZLSB-QWHCGFSZSA-N 1 2 313.781 2.198 20 10 DECDLO COC(=O)[C@H]1C[C@@H](OC)CC[N@H+]1Cc1cc(Cl)ccc1O ZINC000370365386 533540966 /nfs/dbraw/zinc/54/09/66/533540966.db2.gz FOXYHWYKEXZLSB-QWHCGFSZSA-N 1 2 313.781 2.198 20 10 DECDLO O=[N+]([O-])c1ccc(O)c(C[NH2+]C[C@H](O)CCc2ccccc2)c1 ZINC000273075392 130088029 /nfs/dbraw/zinc/08/80/29/130088029.db2.gz HWWAHACDRANMAW-MRXNPFEDSA-N 1 2 316.357 2.384 20 10 DECDLO C[C@H]([NH2+][C@H](CO)C[C@@H](O)C(C)(C)C)c1ccc(F)c(F)c1O ZINC000284368468 131074672 /nfs/dbraw/zinc/07/46/72/131074672.db2.gz ODAHKPFYKBXNIV-OUJBWJOFSA-N 1 2 317.376 2.479 20 10 DECDLO C[C@]1(C(N)=O)CC[N@H+](Cc2cc(Cl)cc(Cl)c2O)C1 ZINC000235742894 402364619 /nfs/dbraw/zinc/36/46/19/402364619.db2.gz ZCRLDJDPOKFAKX-ZDUSSCGKSA-N 1 2 303.189 2.396 20 10 DECDLO C[C@]1(C(N)=O)CC[N@@H+](Cc2cc(Cl)cc(Cl)c2O)C1 ZINC000235742894 402364622 /nfs/dbraw/zinc/36/46/22/402364622.db2.gz ZCRLDJDPOKFAKX-ZDUSSCGKSA-N 1 2 303.189 2.396 20 10 DECDLO Cc1nc2n(n1)C[C@@H]([NH2+][C@H](C)c1ccc(F)c(F)c1O)CC2 ZINC000187692548 402508700 /nfs/dbraw/zinc/50/87/00/402508700.db2.gz ITVJQUDRPPGRFA-SCZZXKLOSA-N 1 2 308.332 2.236 20 10 DECDLO COc1ccc(N2CCC[N@H+](Cc3csnn3)CC2)cc1 ZINC000179550586 402594707 /nfs/dbraw/zinc/59/47/07/402594707.db2.gz SCONOSDHGNUNLM-UHFFFAOYSA-N 1 2 304.419 2.259 20 10 DECDLO COc1ccc(N2CCC[N@@H+](Cc3csnn3)CC2)cc1 ZINC000179550586 402594708 /nfs/dbraw/zinc/59/47/08/402594708.db2.gz SCONOSDHGNUNLM-UHFFFAOYSA-N 1 2 304.419 2.259 20 10 DECDLO O=C(/C=C/c1ccc(O)c(O)c1)N1CCC(c2[nH]cc[nH+]2)CC1 ZINC000272495565 402944382 /nfs/dbraw/zinc/94/43/82/402944382.db2.gz SGFCZBDQIRGORC-DUXPYHPUSA-N 1 2 313.357 2.240 20 10 DECDLO C[C@H]([NH2+][C@H]1C[N@@H+](C2CC2)C[C@@H]1C)c1cc([N+](=O)[O-])ccc1[O-] ZINC000273568021 403016218 /nfs/dbraw/zinc/01/62/18/403016218.db2.gz KCFJENGABHAMTK-PGUXBMHVSA-N 1 2 305.378 2.434 20 10 DECDLO C[C@H]([NH2+][C@H]1C[N@H+](C2CC2)C[C@@H]1C)c1cc([N+](=O)[O-])ccc1[O-] ZINC000273568021 403016221 /nfs/dbraw/zinc/01/62/21/403016221.db2.gz KCFJENGABHAMTK-PGUXBMHVSA-N 1 2 305.378 2.434 20 10 DECDLO CCOCc1cc(C[NH2+][C@H](C)c2ncnn2C)ccc1OC ZINC000276647194 403192697 /nfs/dbraw/zinc/19/26/97/403192697.db2.gz IBKPJJMPXXHDST-GFCCVEGCSA-N 1 2 304.394 2.211 20 10 DECDLO CCOC(=O)[C@@H](F)C1C[NH+](Cc2ccc(N(C)C)c(F)c2)C1 ZINC000293921490 403600133 /nfs/dbraw/zinc/60/01/33/403600133.db2.gz MQDKBIMQNXWTSB-HNNXBMFYSA-N 1 2 312.360 2.225 20 10 DECDLO O=C1NCCN1[C@@H]1CCC[N@@H+](Cc2cccc(Cl)c2O)C1 ZINC000362045172 403920165 /nfs/dbraw/zinc/92/01/65/403920165.db2.gz KMEIBFRKSXIOQR-GFCCVEGCSA-N 1 2 309.797 2.035 20 10 DECDLO O=C1NCCN1[C@@H]1CCC[N@H+](Cc2cccc(Cl)c2O)C1 ZINC000362045172 403920169 /nfs/dbraw/zinc/92/01/69/403920169.db2.gz KMEIBFRKSXIOQR-GFCCVEGCSA-N 1 2 309.797 2.035 20 10 DECDLO CCS(=O)(=O)C[C@H](C)[N@H+](C)Cc1cc(Cl)c(F)cc1O ZINC000295437793 403924644 /nfs/dbraw/zinc/92/46/44/403924644.db2.gz UGHABOBKUSIYDC-VIFPVBQESA-N 1 2 323.817 2.440 20 10 DECDLO CCS(=O)(=O)C[C@H](C)[N@@H+](C)Cc1cc(Cl)c(F)cc1O ZINC000295437793 403924653 /nfs/dbraw/zinc/92/46/53/403924653.db2.gz UGHABOBKUSIYDC-VIFPVBQESA-N 1 2 323.817 2.440 20 10 DECDLO COC(=O)c1ccc(O)c([C@H](C)[NH2+]Cc2nnc(C3CC3)[nH]2)c1 ZINC000296279178 404175875 /nfs/dbraw/zinc/17/58/75/404175875.db2.gz DZEMWBIACJVETF-VIFPVBQESA-N 1 2 316.361 2.025 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@@H+]2CCO[C@@]3(CCO[C@H]3C)C2)c1O ZINC000365562495 404691641 /nfs/dbraw/zinc/69/16/41/404691641.db2.gz YJJVVLVIRSAJLC-SJCJKPOMSA-N 1 2 323.364 2.114 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@H+]2CCO[C@@]3(CCO[C@H]3C)C2)c1O ZINC000365562495 404691644 /nfs/dbraw/zinc/69/16/44/404691644.db2.gz YJJVVLVIRSAJLC-SJCJKPOMSA-N 1 2 323.364 2.114 20 10 DECDLO Oc1ccc(Cl)c(F)c1CNC[C@H]1C[N@@H+]2CCC[C@@H]2CO1 ZINC000377394609 227190250 /nfs/dbraw/zinc/19/02/50/227190250.db2.gz YDGLKRLAEBMTOG-MNOVXSKESA-N 1 2 314.788 2.138 20 10 DECDLO Oc1ccc(Cl)c(F)c1CNC[C@H]1C[N@H+]2CCC[C@@H]2CO1 ZINC000377394609 227190254 /nfs/dbraw/zinc/19/02/54/227190254.db2.gz YDGLKRLAEBMTOG-MNOVXSKESA-N 1 2 314.788 2.138 20 10 DECDLO CC(C)(CCS(C)(=O)=O)[NH2+]Cc1cccc(Cl)c1O ZINC000182492662 519225800 /nfs/dbraw/zinc/22/58/00/519225800.db2.gz WQCHBIYEUDZVGJ-UHFFFAOYSA-N 1 2 305.827 2.349 20 10 DECDLO CCOc1cccc(C[N@@H+]2CCN(CC(C)C)C(=O)C2)c1O ZINC000190100089 521339948 /nfs/dbraw/zinc/33/99/48/521339948.db2.gz PXQYDKDJWYZLKV-UHFFFAOYSA-N 1 2 306.406 2.091 20 10 DECDLO CCOc1cccc(C[N@H+]2CCN(CC(C)C)C(=O)C2)c1O ZINC000190100089 521339960 /nfs/dbraw/zinc/33/99/60/521339960.db2.gz PXQYDKDJWYZLKV-UHFFFAOYSA-N 1 2 306.406 2.091 20 10 DECDLO Cn1cc[nH+]c1CNC(=O)NCc1ccc(N2CCCC2)cc1 ZINC000264206987 534789767 /nfs/dbraw/zinc/78/97/67/534789767.db2.gz RDIKODRFHROSOY-UHFFFAOYSA-N 1 2 313.405 2.020 20 10 DECDLO Cc1n[nH]c(C)c1[C@@H]1COCC[N@@H+]1Cc1cc(F)ccc1O ZINC000368461735 534840910 /nfs/dbraw/zinc/84/09/10/534840910.db2.gz LAYASYMRFDELRE-AWEZNQCLSA-N 1 2 305.353 2.445 20 10 DECDLO Cc1n[nH]c(C)c1[C@@H]1COCC[N@H+]1Cc1cc(F)ccc1O ZINC000368461735 534840914 /nfs/dbraw/zinc/84/09/14/534840914.db2.gz LAYASYMRFDELRE-AWEZNQCLSA-N 1 2 305.353 2.445 20 10 DECDLO CCCN(Cc1ccccc1O)C(=O)NCc1c[nH+]cn1C ZINC000292378428 625518472 /nfs/dbraw/zinc/51/84/72/625518472.db2.gz PYYWCEOZZXXLFJ-UHFFFAOYSA-N 1 2 302.378 2.248 20 10 DECDLO CC[C@H]1C[N@H+](Cc2cc(Br)cc(F)c2O)C[C@@H]1O ZINC000894096801 636113313 /nfs/dbraw/zinc/11/33/13/636113313.db2.gz ZZSSJIWXXBBMMG-UFBFGSQYSA-N 1 2 318.186 2.497 20 10 DECDLO CC[C@H]1C[N@@H+](Cc2cc(Br)cc(F)c2O)C[C@@H]1O ZINC000894096801 636113314 /nfs/dbraw/zinc/11/33/14/636113314.db2.gz ZZSSJIWXXBBMMG-UFBFGSQYSA-N 1 2 318.186 2.497 20 10 DECDLO COCCC[N@H+](C)CCNCc1c(O)cc(C)cc1Cl ZINC000840906691 650376524 /nfs/dbraw/zinc/37/65/24/650376524.db2.gz XRFTWAZRYWRCGX-UHFFFAOYSA-N 1 2 300.830 2.412 20 10 DECDLO COCCC[N@@H+](C)CCNCc1c(O)cc(C)cc1Cl ZINC000840906691 650376526 /nfs/dbraw/zinc/37/65/26/650376526.db2.gz XRFTWAZRYWRCGX-UHFFFAOYSA-N 1 2 300.830 2.412 20 10 DECDLO CNC(=O)NC1CC[NH+](Cc2cc(Cl)cc(F)c2O)CC1 ZINC000840975041 650397835 /nfs/dbraw/zinc/39/78/35/650397835.db2.gz SMAWTRKCDWRAEX-UHFFFAOYSA-N 1 2 315.776 2.078 20 10 DECDLO Oc1c(C[NH2+]Cc2nc3c(s2)COCC3)ccc(F)c1F ZINC000897239417 639271728 /nfs/dbraw/zinc/27/17/28/639271728.db2.gz CEYYDXQHXFCIHQ-UHFFFAOYSA-N 1 2 312.341 2.489 20 10 DECDLO COC[C@](C)(CC(=O)OC)[NH2+]Cc1cc(Cl)cc(F)c1O ZINC000757922568 639895646 /nfs/dbraw/zinc/89/56/46/639895646.db2.gz CZEPXFZSZFLXRK-AWEZNQCLSA-N 1 2 319.760 2.243 20 10 DECDLO COC[C@@](C)(CC(=O)OC)[NH2+]Cc1cc(Cl)cc(F)c1O ZINC000757922575 639895996 /nfs/dbraw/zinc/89/59/96/639895996.db2.gz CZEPXFZSZFLXRK-CQSZACIVSA-N 1 2 319.760 2.243 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@@H+]2CCSC[C@@H]2CCO)c1O ZINC000759726836 640108841 /nfs/dbraw/zinc/10/88/41/640108841.db2.gz HTBRNTXREIKZED-ZDUSSCGKSA-N 1 2 313.394 2.034 20 10 DECDLO CC(=O)c1cc(F)cc(C[N@H+]2CCSC[C@@H]2CCO)c1O ZINC000759726836 640108842 /nfs/dbraw/zinc/10/88/42/640108842.db2.gz HTBRNTXREIKZED-ZDUSSCGKSA-N 1 2 313.394 2.034 20 10 DECDLO CCOc1ccc([N@H+](CC)CCCNS(=O)(=O)CC)cc1 ZINC000753168471 640303419 /nfs/dbraw/zinc/30/34/19/640303419.db2.gz JQTPBYNXIUOTRG-UHFFFAOYSA-N 1 2 314.451 2.241 20 10 DECDLO CCOc1ccc([N@@H+](CC)CCCNS(=O)(=O)CC)cc1 ZINC000753168471 640303424 /nfs/dbraw/zinc/30/34/24/640303424.db2.gz JQTPBYNXIUOTRG-UHFFFAOYSA-N 1 2 314.451 2.241 20 10 DECDLO CC[N@H+](Cc1c(O)cccc1OC)[C@@H](C)CS(=O)(=O)CC ZINC000769425718 641239142 /nfs/dbraw/zinc/23/91/42/641239142.db2.gz UDGMPOQGJAHCPK-LBPRGKRZSA-N 1 2 315.435 2.046 20 10 DECDLO CC[N@@H+](Cc1c(O)cccc1OC)[C@@H](C)CS(=O)(=O)CC ZINC000769425718 641239145 /nfs/dbraw/zinc/23/91/45/641239145.db2.gz UDGMPOQGJAHCPK-LBPRGKRZSA-N 1 2 315.435 2.046 20 10 DECDLO Cc1nnc(C[NH2+]C[C@H](c2ccc(N(C)C)cc2)N(C)C)s1 ZINC000898448451 641661101 /nfs/dbraw/zinc/66/11/01/641661101.db2.gz SRAVPZAMVSHDQA-OAHLLOKOSA-N 1 2 319.478 2.305 20 10 DECDLO C[N@H+](Cc1cc(Cl)cc(F)c1O)[C@@H]1CCCCNC1=O ZINC000775666983 642075577 /nfs/dbraw/zinc/07/55/77/642075577.db2.gz BSAMYUIGCMVPIR-GFCCVEGCSA-N 1 2 300.761 2.285 20 10 DECDLO C[N@@H+](Cc1cc(Cl)cc(F)c1O)[C@@H]1CCCCNC1=O ZINC000775666983 642075581 /nfs/dbraw/zinc/07/55/81/642075581.db2.gz BSAMYUIGCMVPIR-GFCCVEGCSA-N 1 2 300.761 2.285 20 10 DECDLO COC(=O)C[N@H+](Cc1cccc(Cl)c1O)C1CCOCC1 ZINC000775725137 642085548 /nfs/dbraw/zinc/08/55/48/642085548.db2.gz SWDBBBZJTXZYNA-UHFFFAOYSA-N 1 2 313.781 2.200 20 10 DECDLO COC(=O)C[N@@H+](Cc1cccc(Cl)c1O)C1CCOCC1 ZINC000775725137 642085552 /nfs/dbraw/zinc/08/55/52/642085552.db2.gz SWDBBBZJTXZYNA-UHFFFAOYSA-N 1 2 313.781 2.200 20 10 DECDLO CCn1nccc1C[N@H+](CCO)Cc1ccc(N(C)C)c(F)c1 ZINC000793303318 644230796 /nfs/dbraw/zinc/23/07/96/644230796.db2.gz DEQPBXBBUNDHDD-UHFFFAOYSA-N 1 2 320.412 2.103 20 10 DECDLO CCn1nccc1C[N@@H+](CCO)Cc1ccc(N(C)C)c(F)c1 ZINC000793303318 644230807 /nfs/dbraw/zinc/23/08/07/644230807.db2.gz DEQPBXBBUNDHDD-UHFFFAOYSA-N 1 2 320.412 2.103 20 10 DECDLO COc1c(O)c(C[N@@H+]2C[C@@H](C)OC3(CCC3)C2)ccc1[N+](=O)[O-] ZINC000843431938 650973593 /nfs/dbraw/zinc/97/35/93/650973593.db2.gz FEUJMXRVWVFVKK-LLVKDONJSA-N 1 2 322.361 2.452 20 10 DECDLO COc1c(O)c(C[N@H+]2C[C@@H](C)OC3(CCC3)C2)ccc1[N+](=O)[O-] ZINC000843431938 650973597 /nfs/dbraw/zinc/97/35/97/650973597.db2.gz FEUJMXRVWVFVKK-LLVKDONJSA-N 1 2 322.361 2.452 20 10 DECDLO CCN(CC)c1ccc(CN(C)C(=O)Cc2c[nH+]cn2C)cc1 ZINC000806325782 645819061 /nfs/dbraw/zinc/81/90/61/645819061.db2.gz IUIGPRILPQDPHW-UHFFFAOYSA-N 1 2 314.433 2.467 20 10 DECDLO O=S1(=O)CCC[C@@H](C[NH2+]Cc2cc(Cl)cc(F)c2O)C1 ZINC000809770059 646280926 /nfs/dbraw/zinc/28/09/26/646280926.db2.gz QFGVZBHHBUNQFM-VIFPVBQESA-N 1 2 321.801 2.099 20 10 DECDLO Cc1cc(C[N@H+]2CCN(CC(C)C)C(=O)C2)ccc1N(C)C ZINC000815096179 646967727 /nfs/dbraw/zinc/96/77/27/646967727.db2.gz JZWKCZIZSDLKSD-UHFFFAOYSA-N 1 2 303.450 2.361 20 10 DECDLO Cc1cc(C[N@@H+]2CCN(CC(C)C)C(=O)C2)ccc1N(C)C ZINC000815096179 646967729 /nfs/dbraw/zinc/96/77/29/646967729.db2.gz JZWKCZIZSDLKSD-UHFFFAOYSA-N 1 2 303.450 2.361 20 10 DECDLO COC(=O)c1conc1C(C)(C)[NH2+]Cc1cccc(OC)c1O ZINC000822534248 648227087 /nfs/dbraw/zinc/22/70/87/648227087.db2.gz AXTRFAQRESHEKU-UHFFFAOYSA-N 1 2 320.345 2.200 20 10 DECDLO CN(C)c1ccc(CNC(=O)[C@@H]2C[C@H]2c2c[nH+]cn2C)cc1F ZINC000824670275 648633520 /nfs/dbraw/zinc/63/35/20/648633520.db2.gz YJJSSLKQBSJJIU-CHWSQXEVSA-N 1 2 316.380 2.045 20 10 DECDLO CN(C)c1ccc(/C=C\C[NH+]2CCN([C@H]3CCOC3)CC2)cc1 ZINC000827126130 648977263 /nfs/dbraw/zinc/97/72/63/648977263.db2.gz WOWKEVQAWRWLAQ-LLHWWHOWSA-N 1 2 315.461 2.172 20 10 DECDLO O=C(NCc1cc(Cl)ccc1O)[C@@H]1CCn2c[nH+]cc2C1 ZINC000846477929 651332688 /nfs/dbraw/zinc/33/26/88/651332688.db2.gz XSOKYDKUUFDLGT-SNVBAGLBSA-N 1 2 305.765 2.121 20 10 DECDLO CCOc1ccc(C[NH2+]Cc2nc([C@H]3CCCO3)n[nH]2)c(O)c1 ZINC000848562993 651471656 /nfs/dbraw/zinc/47/16/56/651471656.db2.gz OUIKYXHYOOLKPW-CQSZACIVSA-N 1 2 318.377 2.050 20 10 DECDLO C[C@@H]([NH2+]C[C@@H]1CN(C2CC2)C(=O)O1)c1cc(F)cc(F)c1O ZINC000848572809 651473253 /nfs/dbraw/zinc/47/32/53/651473253.db2.gz VYPYPIUOSHSVJN-LDYMZIIASA-N 1 2 312.316 2.304 20 10 DECDLO CO[C@H](C[NH2+][C@H](C)c1cc(F)cc(F)c1O)[C@H]1CCOC1 ZINC000850484922 651937167 /nfs/dbraw/zinc/93/71/67/651937167.db2.gz ULDMSLVZKDBLKC-ISTVAULSSA-N 1 2 301.333 2.373 20 10 DECDLO CC[C@@H]([NH2+][C@@H](C)C(=O)N(C)OC)c1cccc(Cl)c1O ZINC000858579992 685560720 /nfs/dbraw/zinc/56/07/20/685560720.db2.gz JEXSFAGZOHGDTA-JOYOIKCWSA-N 1 2 300.786 2.495 20 10 DECDLO CCS(=O)(=O)C[C@H](C)[N@H+](C)Cc1cc(Cl)ccc1O ZINC000093417017 684049788 /nfs/dbraw/zinc/04/97/88/684049788.db2.gz MMCIIBNIZUMFPQ-JTQLQIEISA-N 1 2 305.827 2.301 20 10 DECDLO CCS(=O)(=O)C[C@H](C)[N@@H+](C)Cc1cc(Cl)ccc1O ZINC000093417017 684049790 /nfs/dbraw/zinc/04/97/90/684049790.db2.gz MMCIIBNIZUMFPQ-JTQLQIEISA-N 1 2 305.827 2.301 20 10 DECDLO CN(C)c1cc(F)c(C[N@@H+]2CCSC[C@@H]2CCO)cc1F ZINC000862251773 686266192 /nfs/dbraw/zinc/26/61/92/686266192.db2.gz MTZACGWRMPYBPV-LBPRGKRZSA-N 1 2 316.417 2.331 20 10 DECDLO CN(C)c1cc(F)c(C[N@H+]2CCSC[C@@H]2CCO)cc1F ZINC000862251773 686266195 /nfs/dbraw/zinc/26/61/95/686266195.db2.gz MTZACGWRMPYBPV-LBPRGKRZSA-N 1 2 316.417 2.331 20 10 DECDLO Oc1cccc(Br)c1C[N@@H+]1CCc2n[nH]cc2C1 ZINC000862430989 686300037 /nfs/dbraw/zinc/30/00/37/686300037.db2.gz HWXXFIOWOIHHSM-UHFFFAOYSA-N 1 2 308.179 2.436 20 10 DECDLO Oc1cccc(Br)c1C[N@H+]1CCc2n[nH]cc2C1 ZINC000862430989 686300043 /nfs/dbraw/zinc/30/00/43/686300043.db2.gz HWXXFIOWOIHHSM-UHFFFAOYSA-N 1 2 308.179 2.436 20 10 DECDLO CC[C@H](C(=O)NCc1cc(C)ccc1O)[N@@H+]1CCO[C@@H](CC)C1 ZINC000862756215 686369154 /nfs/dbraw/zinc/36/91/54/686369154.db2.gz UAERMAATTIZKFO-JKSUJKDBSA-N 1 2 320.433 2.206 20 10 DECDLO CC[C@H](C(=O)NCc1cc(C)ccc1O)[N@H+]1CCO[C@@H](CC)C1 ZINC000862756215 686369160 /nfs/dbraw/zinc/36/91/60/686369160.db2.gz UAERMAATTIZKFO-JKSUJKDBSA-N 1 2 320.433 2.206 20 10 DECDLO COc1ccc(C[NH2+]Cc2ccc(F)c(F)c2O)c(OC)n1 ZINC000877542568 690146431 /nfs/dbraw/zinc/14/64/31/690146431.db2.gz PFOXEUGFZGUFEE-UHFFFAOYSA-N 1 2 310.300 2.372 20 10 DECDLO COC(=O)C1(C)C[NH+](Cc2ccc(Br)cc2O)C1 ZINC001350619157 1151375435 /nfs/dbraw/zinc/37/54/35/1151375435.db2.gz AWAISJGJLBXSKY-UHFFFAOYSA-N 1 2 314.179 2.150 20 10 DECDLO C[C@@]1(O)CC[N@H+](Cc2cc(Br)c(F)cc2O)C1 ZINC001144298973 790848698 /nfs/dbraw/zinc/84/86/98/790848698.db2.gz NOHSMIDLIYNFFR-GFCCVEGCSA-N 1 2 304.159 2.251 20 10 DECDLO C[C@@]1(O)CC[N@@H+](Cc2cc(Br)c(F)cc2O)C1 ZINC001144298973 790848707 /nfs/dbraw/zinc/84/87/07/790848707.db2.gz NOHSMIDLIYNFFR-GFCCVEGCSA-N 1 2 304.159 2.251 20 10 DECDLO Oc1cc(O)c(C[N@@H+]2CC[C@@H](N3CCCCC3)[C@@H](F)C2)c(O)c1 ZINC001144519927 790938949 /nfs/dbraw/zinc/93/89/49/790938949.db2.gz DRDOKVYDNDIJOS-LSDHHAIUSA-N 1 2 324.396 2.202 20 10 DECDLO Oc1cc(O)c(C[N@H+]2CC[C@@H](N3CCCCC3)[C@@H](F)C2)c(O)c1 ZINC001144519927 790938953 /nfs/dbraw/zinc/93/89/53/790938953.db2.gz DRDOKVYDNDIJOS-LSDHHAIUSA-N 1 2 324.396 2.202 20 10 DECDLO COC(=O)N1CC(C)([NH2+]Cc2cc(Cl)cc(F)c2O)C1 ZINC000824156079 783584307 /nfs/dbraw/zinc/58/43/07/783584307.db2.gz HREYKHPNJBIDKF-UHFFFAOYSA-N 1 2 302.733 2.115 20 10 DECDLO C[C@H]1COC[C@@H]1[NH2+]Cc1cc(Br)cc(F)c1O ZINC000715713963 792508413 /nfs/dbraw/zinc/50/84/13/792508413.db2.gz SVZOCHGCCSIQKC-CPCISQLKSA-N 1 2 304.159 2.418 20 10 DECDLO Oc1c(F)cc(Br)cc1C[NH2+]CCc1cn[nH]c1 ZINC000715811576 792524897 /nfs/dbraw/zinc/52/48/97/792524897.db2.gz GPJNXBKWIJCIEY-UHFFFAOYSA-N 1 2 314.158 2.349 20 10 DECDLO COC(=O)NC1C[NH+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC001117813701 795108616 /nfs/dbraw/zinc/10/86/16/795108616.db2.gz CAMHCAGEELOGGC-UHFFFAOYSA-N 1 2 303.406 2.217 20 10 DECDLO Oc1c(C[N@@H+]2Cc3cncnc3C2)cc2c3c1CCCN3CCC2 ZINC001138337601 796199181 /nfs/dbraw/zinc/19/91/81/796199181.db2.gz BNOLKSSQAARFTH-UHFFFAOYSA-N 1 2 322.412 2.397 20 10 DECDLO Oc1c(C[N@H+]2Cc3cncnc3C2)cc2c3c1CCCN3CCC2 ZINC001138337601 796199186 /nfs/dbraw/zinc/19/91/86/796199186.db2.gz BNOLKSSQAARFTH-UHFFFAOYSA-N 1 2 322.412 2.397 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CCCC[C@@H]1CO ZINC001139126751 796327453 /nfs/dbraw/zinc/32/74/53/796327453.db2.gz OYRXAZRLSOJZMK-GFCCVEGCSA-N 1 2 303.358 2.154 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CCCC[C@@H]1CO ZINC001139126751 796327457 /nfs/dbraw/zinc/32/74/57/796327457.db2.gz OYRXAZRLSOJZMK-GFCCVEGCSA-N 1 2 303.358 2.154 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CC[C@H](O)C[C@@H]1C ZINC001139132726 796331071 /nfs/dbraw/zinc/33/10/71/796331071.db2.gz ZMJDEPSNEKBZKU-RYUDHWBXSA-N 1 2 303.358 2.152 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CC[C@H](O)C[C@@H]1C ZINC001139132726 796331072 /nfs/dbraw/zinc/33/10/72/796331072.db2.gz ZMJDEPSNEKBZKU-RYUDHWBXSA-N 1 2 303.358 2.152 20 10 DECDLO COC(=O)[C@H]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1c(O)cc(F)cc1F)C2 ZINC001140584565 796541681 /nfs/dbraw/zinc/54/16/81/796541681.db2.gz WXRNDORJEBLEDM-NHCYSSNCSA-N 1 2 311.328 2.444 20 10 DECDLO C[N@H+](Cc1cncnc1)Cc1ccc(N2CCOCC2)cc1F ZINC001140667579 796554542 /nfs/dbraw/zinc/55/45/42/796554542.db2.gz YKCRMGHXNUVVRE-UHFFFAOYSA-N 1 2 316.380 2.084 20 10 DECDLO C[N@@H+](Cc1cncnc1)Cc1ccc(N2CCOCC2)cc1F ZINC001140667579 796554545 /nfs/dbraw/zinc/55/45/45/796554545.db2.gz YKCRMGHXNUVVRE-UHFFFAOYSA-N 1 2 316.380 2.084 20 10 DECDLO CCN(CC)c1cc(NCCc2cc(O)c(O)cc2O)[nH+]cn1 ZINC001157245640 798169371 /nfs/dbraw/zinc/16/93/71/798169371.db2.gz GFHAJQBZMJSBLS-UHFFFAOYSA-N 1 2 318.377 2.094 20 10 DECDLO CCN(CC)c1cc(NCCc2cc(O)c(O)cc2O)nc[nH+]1 ZINC001157245640 798169374 /nfs/dbraw/zinc/16/93/74/798169374.db2.gz GFHAJQBZMJSBLS-UHFFFAOYSA-N 1 2 318.377 2.094 20 10 DECDLO CC(C)(C)OC(=O)N[C@H]1C[N@H+](Cc2ccccc2O)C[C@@H]1F ZINC001203547861 800076872 /nfs/dbraw/zinc/07/68/72/800076872.db2.gz ZOEOXKFZFAUYGY-STQMWFEESA-N 1 2 310.369 2.439 20 10 DECDLO CC(C)(C)OC(=O)N[C@H]1C[N@@H+](Cc2ccccc2O)C[C@@H]1F ZINC001203547861 800076878 /nfs/dbraw/zinc/07/68/78/800076878.db2.gz ZOEOXKFZFAUYGY-STQMWFEESA-N 1 2 310.369 2.439 20 10 DECDLO COc1ccc(N2CC[NH+](Cc3cc(C)nn3C)CC2)c(C)c1 ZINC001205936018 800446336 /nfs/dbraw/zinc/44/63/36/800446336.db2.gz ZCNUWQDLVZFRIX-UHFFFAOYSA-N 1 2 314.433 2.368 20 10 DECDLO COC(=O)c1c(C[N@H+](C)Cc2cnccn2)c2ccccc2n1C ZINC001232408270 801872875 /nfs/dbraw/zinc/87/28/75/801872875.db2.gz YOWZNMGBHVTYHG-UHFFFAOYSA-N 1 2 324.384 2.387 20 10 DECDLO COC(=O)c1c(C[N@@H+](C)Cc2cnccn2)c2ccccc2n1C ZINC001232408270 801872879 /nfs/dbraw/zinc/87/28/79/801872879.db2.gz YOWZNMGBHVTYHG-UHFFFAOYSA-N 1 2 324.384 2.387 20 10 DECDLO COc1cc(Cl)cc(C[N@@H+]2CCc3nn(C)cc3C2)c1O ZINC001233289879 802064347 /nfs/dbraw/zinc/06/43/47/802064347.db2.gz VJIKIUZZKFYBEA-UHFFFAOYSA-N 1 2 307.781 2.346 20 10 DECDLO COc1cc(Cl)cc(C[N@H+]2CCc3nn(C)cc3C2)c1O ZINC001233289879 802064351 /nfs/dbraw/zinc/06/43/51/802064351.db2.gz VJIKIUZZKFYBEA-UHFFFAOYSA-N 1 2 307.781 2.346 20 10 DECDLO CC(=O)[C@H]1C[N@H+](Cc2cccc(OC(F)(F)F)c2O)CCO1 ZINC001233776190 802207143 /nfs/dbraw/zinc/20/71/43/802207143.db2.gz MPDYTSZLNNTWLI-GFCCVEGCSA-N 1 2 319.279 2.081 20 10 DECDLO CC(=O)[C@H]1C[N@@H+](Cc2cccc(OC(F)(F)F)c2O)CCO1 ZINC001233776190 802207149 /nfs/dbraw/zinc/20/71/49/802207149.db2.gz MPDYTSZLNNTWLI-GFCCVEGCSA-N 1 2 319.279 2.081 20 10 DECDLO C[NH+]1CCN(c2ccc(C[NH2+][C@@H](C[NH3+])C(C)(C)C)cc2F)CC1 ZINC001328682463 1148823991 /nfs/dbraw/zinc/82/39/91/1148823991.db2.gz VAZFVHWVYGYJEO-KRWDZBQOSA-N 1 2 322.472 2.041 20 10 DECDLO O=C(NCc1cccc(O)c1O)c1ccc(-n2cc[nH+]c2)cc1 ZINC001455321550 1057696060 /nfs/dbraw/zinc/69/60/60/1057696060.db2.gz ZMCZNPDZEJMAON-UHFFFAOYSA-N 1 2 309.325 2.214 20 10 DECDLO CC(C)C[C@H](C(=O)NCc1cc(O)ccc1O)n1cc[nH+]c1 ZINC001471661986 1060265920 /nfs/dbraw/zinc/26/59/20/1060265920.db2.gz JRKBPPCBBLWHTC-CQSZACIVSA-N 1 2 303.362 2.198 20 10 DECDLO NC(=O)c1cccc(CC[NH2+]Cc2cccc(Cl)c2O)c1 ZINC001474445047 1060873093 /nfs/dbraw/zinc/87/30/93/1060873093.db2.gz XVQPUJJZKCZQHW-UHFFFAOYSA-N 1 2 304.777 2.477 20 10 DECDLO Cc1[nH+]c[nH]c1CNC(=O)c1cc2cc(O)c(O)cc2s1 ZINC001634960199 1078441377 /nfs/dbraw/zinc/44/13/77/1078441377.db2.gz WFRIWVVZBMWPLT-UHFFFAOYSA-N 1 2 303.343 2.274 20 10 DECDLO NC(=O)c1cccc2c1CC[N@H+](Cc1cc(F)cc(F)c1O)C2 ZINC001560947733 1075148252 /nfs/dbraw/zinc/14/82/52/1075148252.db2.gz GQRFBMCPCJAEGF-UHFFFAOYSA-N 1 2 318.323 2.328 20 10 DECDLO NC(=O)c1cccc2c1CC[N@@H+](Cc1cc(F)cc(F)c1O)C2 ZINC001560947733 1075148258 /nfs/dbraw/zinc/14/82/58/1075148258.db2.gz GQRFBMCPCJAEGF-UHFFFAOYSA-N 1 2 318.323 2.328 20 10 DECDLO CSC(C)(C)C[NH2+][C@@H](C)c1cccc(-c2nn[nH]n2)c1O ZINC001591685020 1076770646 /nfs/dbraw/zinc/77/06/46/1076770646.db2.gz MOPBNZGLUNAFSI-VIFPVBQESA-N 1 2 307.423 2.365 20 10 DECDLO CCN(CC)c1ccc(CNC(=O)Cc2[nH]c[nH+]c2C)cc1 ZINC001596577909 1077080086 /nfs/dbraw/zinc/08/00/86/1077080086.db2.gz DDOOXFQBQYMEKA-UHFFFAOYSA-N 1 2 300.406 2.423 20 10 DECDLO O=S1(=O)CC[C@H]([N@H+](Cc2ccc(Cl)cc2O)C2CC2)C1 ZINC001651877928 1079838475 /nfs/dbraw/zinc/83/84/75/1079838475.db2.gz PWPHGTUFSMPOJM-ZDUSSCGKSA-N 1 2 315.822 2.197 20 10 DECDLO O=S1(=O)CC[C@H]([N@@H+](Cc2ccc(Cl)cc2O)C2CC2)C1 ZINC001651877928 1079838478 /nfs/dbraw/zinc/83/84/78/1079838478.db2.gz PWPHGTUFSMPOJM-ZDUSSCGKSA-N 1 2 315.822 2.197 20 10 DECDLO CCc1nc(C[NH2+]Cc2ccc([N+](=O)[O-])c(OC)c2O)co1 ZINC001659809738 1080252693 /nfs/dbraw/zinc/25/26/93/1080252693.db2.gz WZRNVEQJWFPUHO-UHFFFAOYSA-N 1 2 307.306 2.149 20 10 DECDLO C[N@@H+]1CCC12CN(Cc1c(O)cc(Br)cc1F)C2 ZINC001276837348 1083640123 /nfs/dbraw/zinc/64/01/23/1083640123.db2.gz KGHGXGUPQRTNFR-UHFFFAOYSA-N 1 2 315.186 2.184 20 10 DECDLO C[N@H+]1CCC12CN(Cc1c(O)cc(Br)cc1F)C2 ZINC001276837348 1083640126 /nfs/dbraw/zinc/64/01/26/1083640126.db2.gz KGHGXGUPQRTNFR-UHFFFAOYSA-N 1 2 315.186 2.184 20 10 DECDLO C[C@]1(CO)CC[N@H+](Cc2cc(Br)cc(F)c2O)C1 ZINC001235058243 1084293846 /nfs/dbraw/zinc/29/38/46/1084293846.db2.gz ZVLRFYRQZBCJMM-ZDUSSCGKSA-N 1 2 318.186 2.498 20 10 DECDLO C[C@]1(CO)CC[N@@H+](Cc2cc(Br)cc(F)c2O)C1 ZINC001235058243 1084293853 /nfs/dbraw/zinc/29/38/53/1084293853.db2.gz ZVLRFYRQZBCJMM-ZDUSSCGKSA-N 1 2 318.186 2.498 20 10 DECDLO CN(Cc1cc(Br)cc(F)c1O)[C@H]1CC[N@H+](C)C1 ZINC000715718447 1084945566 /nfs/dbraw/zinc/94/55/66/1084945566.db2.gz NCHLWJHDVFSAAS-NSHDSACASA-N 1 2 317.202 2.430 20 10 DECDLO CN(Cc1cc(Br)cc(F)c1O)[C@H]1CC[N@@H+](C)C1 ZINC000715718447 1084945570 /nfs/dbraw/zinc/94/55/70/1084945570.db2.gz NCHLWJHDVFSAAS-NSHDSACASA-N 1 2 317.202 2.430 20 10 DECDLO COC[C@H]1C[N@H+](Cc2c(O)cccc2F)Cc2ncn(C)c21 ZINC001137834386 1086519576 /nfs/dbraw/zinc/51/95/76/1086519576.db2.gz DZWDPOWNEJXKGQ-LLVKDONJSA-N 1 2 305.353 2.011 20 10 DECDLO COC[C@H]1C[N@@H+](Cc2c(O)cccc2F)Cc2ncn(C)c21 ZINC001137834386 1086519584 /nfs/dbraw/zinc/51/95/84/1086519584.db2.gz DZWDPOWNEJXKGQ-LLVKDONJSA-N 1 2 305.353 2.011 20 10 DECDLO C[N@@H+]1CCC12CN(Cc1cc(Br)cc(F)c1O)C2 ZINC001276156126 1091611838 /nfs/dbraw/zinc/61/18/38/1091611838.db2.gz OPCKDCSFEYIXAW-UHFFFAOYSA-N 1 2 315.186 2.184 20 10 DECDLO C[N@H+]1CCC12CN(Cc1cc(Br)cc(F)c1O)C2 ZINC001276156126 1091611843 /nfs/dbraw/zinc/61/18/43/1091611843.db2.gz OPCKDCSFEYIXAW-UHFFFAOYSA-N 1 2 315.186 2.184 20 10 DECDLO CC(C)NC(=O)N1C[C@H]2C[C@@H](C1)[N@H+]2Cc1cc(Cl)ccc1O ZINC001275277500 1091650890 /nfs/dbraw/zinc/65/08/90/1091650890.db2.gz ZYPYYDBEKIDGQB-OKILXGFUSA-N 1 2 323.824 2.422 20 10 DECDLO CC(C)NC(=O)N1C[C@H]2C[C@@H](C1)[N@@H+]2Cc1cc(Cl)ccc1O ZINC001275277500 1091650893 /nfs/dbraw/zinc/65/08/93/1091650893.db2.gz ZYPYYDBEKIDGQB-OKILXGFUSA-N 1 2 323.824 2.422 20 10 DECDLO COC(=O)[C@H](C)[N@H+](C)Cc1ccc(OCC(F)(F)F)cc1O ZINC001237057693 1138493334 /nfs/dbraw/zinc/49/33/34/1138493334.db2.gz UXAIYRKKPCZSEN-VIFPVBQESA-N 1 2 321.295 2.327 20 10 DECDLO COC(=O)[C@H](C)[N@@H+](C)Cc1ccc(OCC(F)(F)F)cc1O ZINC001237057693 1138493343 /nfs/dbraw/zinc/49/33/43/1138493343.db2.gz UXAIYRKKPCZSEN-VIFPVBQESA-N 1 2 321.295 2.327 20 10 DECDLO O=C1NC[C@@]2(CCC[N@@H+](Cc3cc(Cl)cc(F)c3O)C2)O1 ZINC001237621487 1138720021 /nfs/dbraw/zinc/72/00/21/1138720021.db2.gz BAGLRKZOKLIJSD-CQSZACIVSA-N 1 2 314.744 2.259 20 10 DECDLO O=C1NC[C@@]2(CCC[N@H+](Cc3cc(Cl)cc(F)c3O)C2)O1 ZINC001237621487 1138720027 /nfs/dbraw/zinc/72/00/27/1138720027.db2.gz BAGLRKZOKLIJSD-CQSZACIVSA-N 1 2 314.744 2.259 20 10 DECDLO CCC[N@H+](CC(=O)OCC)Cc1cc(OC)cc(OC)c1O ZINC001237680605 1138754743 /nfs/dbraw/zinc/75/47/43/1138754743.db2.gz KUWKFZCRIVKWDA-UHFFFAOYSA-N 1 2 311.378 2.185 20 10 DECDLO CCC[N@@H+](CC(=O)OCC)Cc1cc(OC)cc(OC)c1O ZINC001237680605 1138754753 /nfs/dbraw/zinc/75/47/53/1138754753.db2.gz KUWKFZCRIVKWDA-UHFFFAOYSA-N 1 2 311.378 2.185 20 10 DECDLO O=C(Cc1ccc(-n2cc[nH+]c2)cc1)NCc1ccccc1O ZINC001294924660 1139306171 /nfs/dbraw/zinc/30/61/71/1139306171.db2.gz FUAUKDUXJNESAI-UHFFFAOYSA-N 1 2 307.353 2.437 20 10 DECDLO CCOc1ccc(N2CC[NH+](CC(=O)NC(C)(C)C)CC2)cc1 ZINC001324299571 1142051292 /nfs/dbraw/zinc/05/12/92/1142051292.db2.gz XFRTYARFXKEZQO-UHFFFAOYSA-N 1 2 319.449 2.122 20 10 DECDLO Oc1c(Cl)cccc1C[NH2+]Cc1ccnc(-n2cncn2)c1 ZINC001308898943 1147489403 /nfs/dbraw/zinc/48/94/03/1147489403.db2.gz MTAFGSKIYWFETC-UHFFFAOYSA-N 1 2 315.764 2.311 20 10 DECDLO CN(C)c1ccc(CNC(=O)NCCNc2cccc[nH+]2)cc1 ZINC000031053959 354131756 /nfs/dbraw/zinc/13/17/56/354131756.db2.gz PNUWOIYNZDBCST-UHFFFAOYSA-N 1 2 313.405 2.059 20 10 DECDLO C[C@H]([NH2+]CC1(CS(C)(=O)=O)CC1)c1ccc(F)c(F)c1O ZINC000187792352 299280594 /nfs/dbraw/zinc/28/05/94/299280594.db2.gz UCQATWMEKHSUQP-VIFPVBQESA-N 1 2 319.373 2.146 20 10 DECDLO COC(=O)c1ccc(O)c([C@H](C)[NH2+][C@H]2CCn3ccnc32)c1 ZINC000834829922 649852690 /nfs/dbraw/zinc/85/26/90/649852690.db2.gz ABNFCFJAWIGHCV-GWCFXTLKSA-N 1 2 301.346 2.171 20 10 DECDLO Oc1c(F)cccc1C[NH+]1CCN(Cc2cccnc2)CC1 ZINC000273416203 130119182 /nfs/dbraw/zinc/11/91/82/130119182.db2.gz PMWSNJFBCMCMSA-UHFFFAOYSA-N 1 2 301.365 2.244 20 10 DECDLO COC(=O)c1ccc(O)c([C@@H](C)[NH2+][C@@H](C)Cc2cc(C)[nH]n2)c1 ZINC000273533142 130134115 /nfs/dbraw/zinc/13/41/15/130134115.db2.gz WTIWINHFDXGHES-CMPLNLGQSA-N 1 2 317.389 2.492 20 10 DECDLO Oc1c(Cl)cccc1C[N@@H+]1CCC[C@H]1CN1CCOCC1 ZINC000179803098 402601121 /nfs/dbraw/zinc/60/11/21/402601121.db2.gz UCQBWGVTXCNPDN-AWEZNQCLSA-N 1 2 310.825 2.342 20 10 DECDLO Oc1c(Cl)cccc1C[N@H+]1CCC[C@H]1CN1CCOCC1 ZINC000179803098 402601125 /nfs/dbraw/zinc/60/11/25/402601125.db2.gz UCQBWGVTXCNPDN-AWEZNQCLSA-N 1 2 310.825 2.342 20 10 DECDLO CS(=O)(=O)[C@@H]1CCCC[N@H+](Cc2cccc(Cl)c2O)C1 ZINC000278799803 402872462 /nfs/dbraw/zinc/87/24/62/402872462.db2.gz XNAZZVBKXXVVEE-GFCCVEGCSA-N 1 2 317.838 2.445 20 10 DECDLO CS(=O)(=O)[C@@H]1CCCC[N@@H+](Cc2cccc(Cl)c2O)C1 ZINC000278799803 402872464 /nfs/dbraw/zinc/87/24/64/402872464.db2.gz XNAZZVBKXXVVEE-GFCCVEGCSA-N 1 2 317.838 2.445 20 10 DECDLO COc1c(O)c(CNCC[NH+]2CCCCCC2)ccc1[N+](=O)[O-] ZINC000278876296 402880752 /nfs/dbraw/zinc/88/07/52/402880752.db2.gz NKQOBUMYZQWFBH-UHFFFAOYSA-N 1 2 323.393 2.275 20 10 DECDLO COC(=O)[C@H](Cc1ccccc1)[NH2+]Cc1cccc(OC)c1O ZINC000276498808 403181272 /nfs/dbraw/zinc/18/12/72/403181272.db2.gz RJGOLRGDODIHMY-HNNXBMFYSA-N 1 2 315.369 2.275 20 10 DECDLO C[C@H](O)CNc1cc(NCc2ccc(N(C)C)c(F)c2)nc[nH+]1 ZINC000298206854 403331029 /nfs/dbraw/zinc/33/10/29/403331029.db2.gz IPSNPMJVPFRHAF-NSHDSACASA-N 1 2 319.384 2.087 20 10 DECDLO C[C@H](O)CNc1cc(NCc2ccc(N(C)C)c(F)c2)[nH+]cn1 ZINC000298206854 403331033 /nfs/dbraw/zinc/33/10/33/403331033.db2.gz IPSNPMJVPFRHAF-NSHDSACASA-N 1 2 319.384 2.087 20 10 DECDLO CCNC(=O)N1CC[NH+](Cc2cc(Cl)c(F)cc2O)CC1 ZINC000295029920 403741277 /nfs/dbraw/zinc/74/12/77/403741277.db2.gz XMFCNDMFDMMLQE-UHFFFAOYSA-N 1 2 315.776 2.032 20 10 DECDLO COc1cccc(CNc2cc(N3CCCC3)nc[nH+]2)c1O ZINC000302902780 403742435 /nfs/dbraw/zinc/74/24/35/403742435.db2.gz RBDONAZCVZHPQC-UHFFFAOYSA-N 1 2 300.362 2.403 20 10 DECDLO COc1cccc(CNc2cc(N3CCCC3)[nH+]cn2)c1O ZINC000302902780 403742439 /nfs/dbraw/zinc/74/24/39/403742439.db2.gz RBDONAZCVZHPQC-UHFFFAOYSA-N 1 2 300.362 2.403 20 10 DECDLO CS(=O)(=O)C[C@@H]1CC[N@H+](Cc2c(O)ccc(Cl)c2F)C1 ZINC000366493233 404802553 /nfs/dbraw/zinc/80/25/53/404802553.db2.gz XQRKXFFCBFTODZ-SECBINFHSA-N 1 2 321.801 2.051 20 10 DECDLO CS(=O)(=O)C[C@@H]1CC[N@@H+](Cc2c(O)ccc(Cl)c2F)C1 ZINC000366493233 404802555 /nfs/dbraw/zinc/80/25/55/404802555.db2.gz XQRKXFFCBFTODZ-SECBINFHSA-N 1 2 321.801 2.051 20 10 DECDLO CN(C)c1ccc(C[N@@H+]2CCO[C@H]([C@H]3CCCO3)C2)cc1F ZINC000367546203 405079481 /nfs/dbraw/zinc/07/94/81/405079481.db2.gz DRXFEPWLICLCBE-SJORKVTESA-N 1 2 308.397 2.272 20 10 DECDLO CN(C)c1ccc(C[N@H+]2CCO[C@H]([C@H]3CCCO3)C2)cc1F ZINC000367546203 405079487 /nfs/dbraw/zinc/07/94/87/405079487.db2.gz DRXFEPWLICLCBE-SJORKVTESA-N 1 2 308.397 2.272 20 10 DECDLO CCNC(=O)N1CC[NH+](C/C=C\c2ccc(N(C)C)cc2)CC1 ZINC000835025813 649868303 /nfs/dbraw/zinc/86/83/03/649868303.db2.gz NRDOXIZAHLJQGJ-WAYWQWQTSA-N 1 2 316.449 2.113 20 10 DECDLO CCC(CC)[C@H](C(=O)NCc1ccccc1O)[NH+]1CCOCC1 ZINC000266522874 521614809 /nfs/dbraw/zinc/61/48/09/521614809.db2.gz JARCGMZLRMSYGV-QGZVFWFLSA-N 1 2 320.433 2.145 20 10 DECDLO COC(=O)C[N@H+](CCC(C)(C)O)Cc1cc(Cl)ccc1O ZINC000267429165 523161005 /nfs/dbraw/zinc/16/10/05/523161005.db2.gz MBXVPCZYORTWJH-UHFFFAOYSA-N 1 2 315.797 2.182 20 10 DECDLO COC(=O)C[N@@H+](CCC(C)(C)O)Cc1cc(Cl)ccc1O ZINC000267429165 523161014 /nfs/dbraw/zinc/16/10/14/523161014.db2.gz MBXVPCZYORTWJH-UHFFFAOYSA-N 1 2 315.797 2.182 20 10 DECDLO Cc1noc(C[N@@H+](C)Cc2cc(Br)ccc2O)n1 ZINC000848926998 624879248 /nfs/dbraw/zinc/87/92/48/624879248.db2.gz ABCMXSNCBKYGTG-UHFFFAOYSA-N 1 2 312.167 2.478 20 10 DECDLO Cc1noc(C[N@H+](C)Cc2cc(Br)ccc2O)n1 ZINC000848926998 624879249 /nfs/dbraw/zinc/87/92/49/624879249.db2.gz ABCMXSNCBKYGTG-UHFFFAOYSA-N 1 2 312.167 2.478 20 10 DECDLO CN(Cc1ccccc1O)C(=O)NCc1ccn2cc[nH+]c2c1 ZINC000177752834 625083323 /nfs/dbraw/zinc/08/33/23/625083323.db2.gz WGQGCSLRWNUDHC-UHFFFAOYSA-N 1 2 310.357 2.382 20 10 DECDLO O=C1CCCN1[C@H]1CCC[N@@H+](Cc2cc(F)cc(F)c2O)C1 ZINC000894014483 636092660 /nfs/dbraw/zinc/09/26/60/636092660.db2.gz LTRRASXKRIALTK-ZDUSSCGKSA-N 1 2 310.344 2.257 20 10 DECDLO O=C1CCCN1[C@H]1CCC[N@H+](Cc2cc(F)cc(F)c2O)C1 ZINC000894014483 636092662 /nfs/dbraw/zinc/09/26/62/636092662.db2.gz LTRRASXKRIALTK-ZDUSSCGKSA-N 1 2 310.344 2.257 20 10 DECDLO CN(C)Cc1csc(C[NH2+]Cc2cc(F)cc(F)c2O)n1 ZINC000922487683 636198681 /nfs/dbraw/zinc/19/86/81/636198681.db2.gz UWAGEDPSEHZRNL-UHFFFAOYSA-N 1 2 313.373 2.478 20 10 DECDLO COc1c(C)c[nH+]c(CNC(=O)NCc2ccccc2O)c1C ZINC000726250805 636419552 /nfs/dbraw/zinc/41/95/52/636419552.db2.gz GHUCGPSLOLEQHI-UHFFFAOYSA-N 1 2 315.373 2.412 20 10 DECDLO Oc1c(F)cc(F)cc1C[NH2+]Cc1nc2c(s1)COCC2 ZINC000922960752 636887249 /nfs/dbraw/zinc/88/72/49/636887249.db2.gz UOOZAJHQYQGFBT-UHFFFAOYSA-N 1 2 312.341 2.489 20 10 DECDLO C[C@H]1CC[N@H+](Cc2cc(Br)cc(F)c2O)[C@@H]1CO ZINC000894533464 637093938 /nfs/dbraw/zinc/09/39/38/637093938.db2.gz MSLILADODOAQFB-QPUJVOFHSA-N 1 2 318.186 2.497 20 10 DECDLO C[C@H]1CC[N@@H+](Cc2cc(Br)cc(F)c2O)[C@@H]1CO ZINC000894533464 637093941 /nfs/dbraw/zinc/09/39/41/637093941.db2.gz MSLILADODOAQFB-QPUJVOFHSA-N 1 2 318.186 2.497 20 10 DECDLO Cc1cc(N(C)C)ccc1C[N@H+](CCS(C)(=O)=O)C1CC1 ZINC000840916244 650379707 /nfs/dbraw/zinc/37/97/07/650379707.db2.gz IETSWBCZSGKUBR-UHFFFAOYSA-N 1 2 310.463 2.070 20 10 DECDLO Cc1cc(N(C)C)ccc1C[N@@H+](CCS(C)(=O)=O)C1CC1 ZINC000840916244 650379708 /nfs/dbraw/zinc/37/97/08/650379708.db2.gz IETSWBCZSGKUBR-UHFFFAOYSA-N 1 2 310.463 2.070 20 10 DECDLO CC(=O)c1cc(Cl)cc(C[N@H+](C)CCN2CCCC2=O)c1O ZINC000750044039 638705829 /nfs/dbraw/zinc/70/58/29/638705829.db2.gz AHDNDAMLXZRZHA-UHFFFAOYSA-N 1 2 324.808 2.302 20 10 DECDLO CC(=O)c1cc(Cl)cc(C[N@@H+](C)CCN2CCCC2=O)c1O ZINC000750044039 638705830 /nfs/dbraw/zinc/70/58/30/638705830.db2.gz AHDNDAMLXZRZHA-UHFFFAOYSA-N 1 2 324.808 2.302 20 10 DECDLO Cc1nc(N(C)C)nc(NCc2ccc(N3CC=CC3)cc2)[nH+]1 ZINC000768537043 641093853 /nfs/dbraw/zinc/09/38/53/641093853.db2.gz OBJHGAVJSWDHES-UHFFFAOYSA-N 1 2 310.405 2.234 20 10 DECDLO CCOC(=O)[C@@H]1C[N@H+](Cc2ccc(N(CC)CC)cc2)CCO1 ZINC000769467702 641244912 /nfs/dbraw/zinc/24/49/12/641244912.db2.gz QPJANIPHCJWHGB-KRWDZBQOSA-N 1 2 320.433 2.297 20 10 DECDLO CCOC(=O)[C@@H]1C[N@@H+](Cc2ccc(N(CC)CC)cc2)CCO1 ZINC000769467702 641244923 /nfs/dbraw/zinc/24/49/23/641244923.db2.gz QPJANIPHCJWHGB-KRWDZBQOSA-N 1 2 320.433 2.297 20 10 DECDLO Cc1nc(N(C)C)nc(N[C@H](C)c2ccc(N(C)C)cc2)[nH+]1 ZINC000772300829 641622266 /nfs/dbraw/zinc/62/22/66/641622266.db2.gz OTGLRLLKYWXPOV-LLVKDONJSA-N 1 2 300.410 2.485 20 10 DECDLO CCO[C@@H]1C[C@@H]([NH2+]Cc2cc(Cl)cc(F)c2O)[C@H]1OC ZINC000775979543 642119593 /nfs/dbraw/zinc/11/95/93/642119593.db2.gz VUNXCHQPZNWQSW-YRGRVCCFSA-N 1 2 303.761 2.467 20 10 DECDLO OCC[N@H+](Cc1cc(Cl)cc(F)c1O)C1CCOCC1 ZINC000783716659 643041570 /nfs/dbraw/zinc/04/15/70/643041570.db2.gz CTALZSFXKUJUHG-UHFFFAOYSA-N 1 2 303.761 2.158 20 10 DECDLO OCC[N@@H+](Cc1cc(Cl)cc(F)c1O)C1CCOCC1 ZINC000783716659 643041577 /nfs/dbraw/zinc/04/15/77/643041577.db2.gz CTALZSFXKUJUHG-UHFFFAOYSA-N 1 2 303.761 2.158 20 10 DECDLO C[C@H]([NH2+]CCN1CCCOCC1)c1cc(F)cc(F)c1O ZINC000903227708 643299451 /nfs/dbraw/zinc/29/94/51/643299451.db2.gz NBIMQUYJSSWBAK-NSHDSACASA-N 1 2 300.349 2.043 20 10 DECDLO COc1ccc(O)c([C@@H](C)NC(=O)[C@@H]2CCc3[nH+]ccn3C2)c1 ZINC000787131911 643457052 /nfs/dbraw/zinc/45/70/52/643457052.db2.gz UHFZVMKKLSTCHH-VXGBXAGGSA-N 1 2 315.373 2.037 20 10 DECDLO CCOC(=O)[C@H]([NH2+]Cc1cccc(C)c1O)C1CCOCC1 ZINC000789579283 643750770 /nfs/dbraw/zinc/75/07/70/643750770.db2.gz FYRUFQVIPGZOCZ-OAHLLOKOSA-N 1 2 307.390 2.149 20 10 DECDLO COCC1(O)CC[NH+](Cc2c(O)ccc(Cl)c2F)CC1 ZINC000792166895 644081945 /nfs/dbraw/zinc/08/19/45/644081945.db2.gz VFBWRQZZBKZOQS-UHFFFAOYSA-N 1 2 303.761 2.158 20 10 DECDLO O=[N+]([O-])c1cc(Cl)cc(C[N@@H+]2CC[C@@H]3[NH2+]CC[C@@H]3C2)c1[O-] ZINC000843128902 650902317 /nfs/dbraw/zinc/90/23/17/650902317.db2.gz YUTUNZNSXGXSAA-SKDRFNHKSA-N 1 2 311.769 2.138 20 10 DECDLO O=[N+]([O-])c1cc(Cl)cc(C[N@H+]2CC[C@@H]3[NH2+]CC[C@@H]3C2)c1[O-] ZINC000843128902 650902319 /nfs/dbraw/zinc/90/23/19/650902319.db2.gz YUTUNZNSXGXSAA-SKDRFNHKSA-N 1 2 311.769 2.138 20 10 DECDLO C[C@H]([NH2+][C@H](CO)C[C@@H](O)C(C)(C)C)c1cc(F)cc(F)c1O ZINC000793566525 644274888 /nfs/dbraw/zinc/27/48/88/644274888.db2.gz GJBOZUAXYQSPEC-NURSFMCSSA-N 1 2 317.376 2.479 20 10 DECDLO Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)Cc1c[nH]c[nH+]1 ZINC000910558901 645501710 /nfs/dbraw/zinc/50/17/10/645501710.db2.gz RMXHXQMPPYQUJD-ZDUSSCGKSA-N 1 2 300.406 2.074 20 10 DECDLO CC[C@@H]([NH2+]C[C@@H]1CN(C)CCN1C)c1cccc(Cl)c1O ZINC000806139578 645802739 /nfs/dbraw/zinc/80/27/39/645802739.db2.gz PVOMSMVSXGRKMF-IUODEOHRSA-N 1 2 311.857 2.332 20 10 DECDLO COc1ccc(O)c([C@H](C)NC(=O)NCCCn2cc[nH+]c2)c1 ZINC000171409062 646699922 /nfs/dbraw/zinc/69/99/22/646699922.db2.gz LANLGKUZHFEONZ-LBPRGKRZSA-N 1 2 318.377 2.048 20 10 DECDLO OC[C@]1([C@@H]([NH2+]Cc2cccc(Cl)c2O)C2CC2)CCCO1 ZINC000816667247 647165207 /nfs/dbraw/zinc/16/52/07/647165207.db2.gz HNRSUSLQNVPAMG-HOTGVXAUSA-N 1 2 311.809 2.455 20 10 DECDLO CN(C)C(=O)O[C@@H]1CC[N@H+](Cc2c(O)ccc(Cl)c2F)C1 ZINC000824576749 648614494 /nfs/dbraw/zinc/61/44/94/648614494.db2.gz RYORZFBQKUCZQD-SECBINFHSA-N 1 2 316.760 2.457 20 10 DECDLO CN(C)C(=O)O[C@@H]1CC[N@@H+](Cc2c(O)ccc(Cl)c2F)C1 ZINC000824576749 648614497 /nfs/dbraw/zinc/61/44/97/648614497.db2.gz RYORZFBQKUCZQD-SECBINFHSA-N 1 2 316.760 2.457 20 10 DECDLO OCCN1CCCC[C@@H]1C[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000824583495 648616357 /nfs/dbraw/zinc/61/63/57/648616357.db2.gz NJAODZAGHYHSPI-GFCCVEGCSA-N 1 2 316.804 2.121 20 10 DECDLO CC[C@@H](C(=O)N[C@H](C)c1ccccc1O)[N@@H+]1CCO[C@H](CC)C1 ZINC000827946681 649109661 /nfs/dbraw/zinc/10/96/61/649109661.db2.gz OLOCEEWFLPSXDB-FMKPAKJESA-N 1 2 320.433 2.459 20 10 DECDLO CC[C@@H](C(=O)N[C@H](C)c1ccccc1O)[N@H+]1CCO[C@H](CC)C1 ZINC000827946681 649109662 /nfs/dbraw/zinc/10/96/62/649109662.db2.gz OLOCEEWFLPSXDB-FMKPAKJESA-N 1 2 320.433 2.459 20 10 DECDLO C[C@@H](NC(=O)[C@@H]1COCC[N@@H+]1C1CCCC1)c1ccccc1O ZINC000827947036 649109695 /nfs/dbraw/zinc/10/96/95/649109695.db2.gz ZAELRDAGLPYFPF-CJNGLKHVSA-N 1 2 318.417 2.213 20 10 DECDLO C[C@@H](NC(=O)[C@@H]1COCC[N@H+]1C1CCCC1)c1ccccc1O ZINC000827947036 649109698 /nfs/dbraw/zinc/10/96/98/649109698.db2.gz ZAELRDAGLPYFPF-CJNGLKHVSA-N 1 2 318.417 2.213 20 10 DECDLO COc1ccc(O)c([C@H](C)NC(=O)[C@@H]2C[C@H]2c2c[nH+]cn2C)c1 ZINC000830541441 649459040 /nfs/dbraw/zinc/45/90/40/649459040.db2.gz XZFQAISDUAYOAR-ZLKJLUDKSA-N 1 2 315.373 2.115 20 10 DECDLO O=C1C[C@@H](C[NH2+]Cc2cc(Cl)cc(F)c2O)CN1C1CC1 ZINC000846073502 651306397 /nfs/dbraw/zinc/30/63/97/651306397.db2.gz WOIIWOLNJHDFAE-VIFPVBQESA-N 1 2 312.772 2.285 20 10 DECDLO COc1cc(C[NH2+]CC(F)(F)CO)c(O)c(C(C)(C)C)c1 ZINC000850249166 651877172 /nfs/dbraw/zinc/87/71/72/651877172.db2.gz RPVPQJXOHINKBO-UHFFFAOYSA-N 1 2 303.349 2.416 20 10 DECDLO C[C@@H]([NH2+]Cc1nc(C(N)=O)cs1)c1ccc(N(C)C)cc1 ZINC000850541496 651948591 /nfs/dbraw/zinc/94/85/91/651948591.db2.gz WRRLMZWRTVVEJR-SNVBAGLBSA-N 1 2 304.419 2.159 20 10 DECDLO CC[C@H]([NH2+][C@@H](C)C(=O)N(C)OC)c1cccc(Cl)c1O ZINC000858579991 685560361 /nfs/dbraw/zinc/56/03/61/685560361.db2.gz JEXSFAGZOHGDTA-CABZTGNLSA-N 1 2 300.786 2.495 20 10 DECDLO Cc1c[nH]c(C[N@@H+](C)Cc2ccc(N3CCOCC3)cc2)n1 ZINC000862214325 686256569 /nfs/dbraw/zinc/25/65/69/686256569.db2.gz NUBBESFCHQSZJP-UHFFFAOYSA-N 1 2 300.406 2.187 20 10 DECDLO Cc1c[nH]c(C[N@H+](C)Cc2ccc(N3CCOCC3)cc2)n1 ZINC000862214325 686256572 /nfs/dbraw/zinc/25/65/72/686256572.db2.gz NUBBESFCHQSZJP-UHFFFAOYSA-N 1 2 300.406 2.187 20 10 DECDLO CC(C)C(=O)NC1CC[NH+](Cc2ccc(F)c(F)c2O)CC1 ZINC000876579063 689864120 /nfs/dbraw/zinc/86/41/20/689864120.db2.gz MSUMFOVDLGYMFE-UHFFFAOYSA-N 1 2 312.360 2.407 20 10 DECDLO Oc1c(C[N@H+]2C[C@@H](O)[C@H](Oc3ccccc3)C2)ccc(F)c1F ZINC000877665840 690183756 /nfs/dbraw/zinc/18/37/56/690183756.db2.gz LEJSZXFJAXSUDT-HUUCEWRRSA-N 1 2 321.323 2.295 20 10 DECDLO Oc1c(C[N@@H+]2C[C@@H](O)[C@H](Oc3ccccc3)C2)ccc(F)c1F ZINC000877665840 690183760 /nfs/dbraw/zinc/18/37/60/690183760.db2.gz LEJSZXFJAXSUDT-HUUCEWRRSA-N 1 2 321.323 2.295 20 10 DECDLO CCC[C@H](C)C(=O)NCC[NH2+]Cc1cc(F)cc(F)c1O ZINC000883130115 691436135 /nfs/dbraw/zinc/43/61/35/691436135.db2.gz RGTITHIFOYXLII-JTQLQIEISA-N 1 2 300.349 2.312 20 10 DECDLO C[C@H]1COC[C@H]1[NH2+]Cc1cc(Br)cc(F)c1O ZINC000715713966 792508206 /nfs/dbraw/zinc/50/82/06/792508206.db2.gz SVZOCHGCCSIQKC-WRWORJQWSA-N 1 2 304.159 2.418 20 10 DECDLO Cn1cc[nH+]c1CCC(=O)NCc1c(O)ccc2c1CCCC2 ZINC001123768529 795974077 /nfs/dbraw/zinc/97/40/77/795974077.db2.gz AZHARFXQURVPTI-UHFFFAOYSA-N 1 2 313.401 2.254 20 10 DECDLO CCOC[C@H]1C[N@H+](Cc2cccc(F)c2O)Cc2c1cnn2C ZINC001138123919 796166024 /nfs/dbraw/zinc/16/60/24/796166024.db2.gz ROURIWJOQKMGCB-CYBMUJFWSA-N 1 2 319.380 2.401 20 10 DECDLO CCOC[C@H]1C[N@@H+](Cc2cccc(F)c2O)Cc2c1cnn2C ZINC001138123919 796166027 /nfs/dbraw/zinc/16/60/27/796166027.db2.gz ROURIWJOQKMGCB-CYBMUJFWSA-N 1 2 319.380 2.401 20 10 DECDLO CCn1ncc2c1[C@H](COC)C[N@H+](Cc1cccc(F)c1O)C2 ZINC001138125302 796167375 /nfs/dbraw/zinc/16/73/75/796167375.db2.gz NNANDFXIMWKANB-AWEZNQCLSA-N 1 2 319.380 2.494 20 10 DECDLO CCn1ncc2c1[C@H](COC)C[N@@H+](Cc1cccc(F)c1O)C2 ZINC001138125302 796167377 /nfs/dbraw/zinc/16/73/77/796167377.db2.gz NNANDFXIMWKANB-AWEZNQCLSA-N 1 2 319.380 2.494 20 10 DECDLO COC[C@H]1Cn2ccnc2C[N@H+](Cc2cccc(F)c2O)C1 ZINC001138125879 796168080 /nfs/dbraw/zinc/16/80/80/796168080.db2.gz YRENWTHIMYCGJE-GFCCVEGCSA-N 1 2 305.353 2.006 20 10 DECDLO COC[C@H]1Cn2ccnc2C[N@@H+](Cc2cccc(F)c2O)C1 ZINC001138125879 796168082 /nfs/dbraw/zinc/16/80/82/796168082.db2.gz YRENWTHIMYCGJE-GFCCVEGCSA-N 1 2 305.353 2.006 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+](C)Cc1cnn(C)c1 ZINC001139126551 796327773 /nfs/dbraw/zinc/32/77/73/796327773.db2.gz JZFDQCBKCXGSAL-UHFFFAOYSA-N 1 2 313.357 2.173 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+](C)Cc1cnn(C)c1 ZINC001139126551 796327778 /nfs/dbraw/zinc/32/77/78/796327778.db2.gz JZFDQCBKCXGSAL-UHFFFAOYSA-N 1 2 313.357 2.173 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CC[C@@H](CO)[C@H]1C ZINC001139126264 796327797 /nfs/dbraw/zinc/32/77/97/796327797.db2.gz CUUGGPKAAHVBDB-NEPJUHHUSA-N 1 2 303.358 2.010 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CC[C@@H](CO)[C@H]1C ZINC001139126264 796327801 /nfs/dbraw/zinc/32/78/01/796327801.db2.gz CUUGGPKAAHVBDB-NEPJUHHUSA-N 1 2 303.358 2.010 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1CC[C@H](O)[C@H](C)C1 ZINC001139127363 796328550 /nfs/dbraw/zinc/32/85/50/796328550.db2.gz UGFVGNPYFUQELW-RISCZKNCSA-N 1 2 303.358 2.010 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1CC[C@H](O)[C@H](C)C1 ZINC001139127363 796328553 /nfs/dbraw/zinc/32/85/53/796328553.db2.gz UGFVGNPYFUQELW-RISCZKNCSA-N 1 2 303.358 2.010 20 10 DECDLO Cc1cc(=O)oc2c1ccc(O)c2C[NH+]1CC2(CSC2)C1 ZINC001139133623 796330191 /nfs/dbraw/zinc/33/01/91/796330191.db2.gz JRFSXDWFSQUNPM-UHFFFAOYSA-N 1 2 303.383 2.356 20 10 DECDLO COc1ncnc2c1CC[N@H+](Cc1ccc(Cl)cc1O)C2 ZINC001140466913 796526431 /nfs/dbraw/zinc/52/64/31/796526431.db2.gz MCOOGEUJWDZFSV-UHFFFAOYSA-N 1 2 305.765 2.403 20 10 DECDLO COc1ncnc2c1CC[N@@H+](Cc1ccc(Cl)cc1O)C2 ZINC001140466913 796526435 /nfs/dbraw/zinc/52/64/35/796526435.db2.gz MCOOGEUJWDZFSV-UHFFFAOYSA-N 1 2 305.765 2.403 20 10 DECDLO CCO[C@@H]1C[N@H+](Cc2c(O)cc(F)cc2F)[C@@H]2CCCO[C@H]12 ZINC001140581708 796541109 /nfs/dbraw/zinc/54/11/09/796541109.db2.gz YHWYUYNUUMEVAK-BMFZPTHFSA-N 1 2 313.344 2.439 20 10 DECDLO CCO[C@@H]1C[N@@H+](Cc2c(O)cc(F)cc2F)[C@@H]2CCCO[C@H]12 ZINC001140581708 796541111 /nfs/dbraw/zinc/54/11/11/796541111.db2.gz YHWYUYNUUMEVAK-BMFZPTHFSA-N 1 2 313.344 2.439 20 10 DECDLO O=C1CCCN1C1CC[NH+](Cc2c(O)cc(F)cc2F)CC1 ZINC001140584138 796541885 /nfs/dbraw/zinc/54/18/85/796541885.db2.gz FTSLPLPWZWVNHY-UHFFFAOYSA-N 1 2 310.344 2.257 20 10 DECDLO CC1(C)CN(C2C[NH+](Cc3cc(Cl)ccc3O)C2)CCO1 ZINC001203663725 796547504 /nfs/dbraw/zinc/54/75/04/796547504.db2.gz FVJXXRQKKQPEAI-UHFFFAOYSA-N 1 2 310.825 2.341 20 10 DECDLO CCn1nnc2c1CC[N@H+](Cc1ccc(C)cc1O)[C@H]2COC ZINC001140951991 796606293 /nfs/dbraw/zinc/60/62/93/796606293.db2.gz AWSVBRRWXCFBHV-HNNXBMFYSA-N 1 2 316.405 2.058 20 10 DECDLO CCn1nnc2c1CC[N@@H+](Cc1ccc(C)cc1O)[C@H]2COC ZINC001140951991 796606295 /nfs/dbraw/zinc/60/62/95/796606295.db2.gz AWSVBRRWXCFBHV-HNNXBMFYSA-N 1 2 316.405 2.058 20 10 DECDLO CCOC(=O)[C@H]1CCCC[N@@H+]1Cc1ccc2c(c1)OCCN2C ZINC001141144082 796638950 /nfs/dbraw/zinc/63/89/50/796638950.db2.gz WAZFXFPKZCIAPS-MRXNPFEDSA-N 1 2 318.417 2.433 20 10 DECDLO CCOC(=O)[C@H]1CCCC[N@H+]1Cc1ccc2c(c1)OCCN2C ZINC001141144082 796638952 /nfs/dbraw/zinc/63/89/52/796638952.db2.gz WAZFXFPKZCIAPS-MRXNPFEDSA-N 1 2 318.417 2.433 20 10 DECDLO O=C(C[N@@H+]1CCc2sccc2C1)NCc1ccccc1O ZINC001142224026 796725527 /nfs/dbraw/zinc/72/55/27/796725527.db2.gz WHJPTMSDAKETOL-UHFFFAOYSA-N 1 2 302.399 2.128 20 10 DECDLO O=C(C[N@H+]1CCc2sccc2C1)NCc1ccccc1O ZINC001142224026 796725529 /nfs/dbraw/zinc/72/55/29/796725529.db2.gz WHJPTMSDAKETOL-UHFFFAOYSA-N 1 2 302.399 2.128 20 10 DECDLO NC(=[NH2+])N(C(=O)c1cc(O)c(O)c(Cl)c1)c1ccccc1F ZINC001193626553 797595290 /nfs/dbraw/zinc/59/52/90/797595290.db2.gz WODAAILQBXCAGI-UHFFFAOYSA-N 1 2 323.711 2.431 20 10 DECDLO COc1ccc(O)c(C[N@@H+]2C[C@@H]3C[C@H]2[C@H](C(F)(F)F)O3)c1 ZINC001203680063 800105098 /nfs/dbraw/zinc/10/50/98/800105098.db2.gz BNGQBSMERGTETN-GMXVVIOVSA-N 1 2 303.280 2.305 20 10 DECDLO COc1ccc(O)c(C[N@H+]2C[C@@H]3C[C@H]2[C@H](C(F)(F)F)O3)c1 ZINC001203680063 800105105 /nfs/dbraw/zinc/10/51/05/800105105.db2.gz BNGQBSMERGTETN-GMXVVIOVSA-N 1 2 303.280 2.305 20 10 DECDLO CCOc1ccc(N2CC[NH+](Cc3cn(C)cn3)CC2)cc1 ZINC001206249449 800497531 /nfs/dbraw/zinc/49/75/31/800497531.db2.gz UXHCNFYLVBMEAS-UHFFFAOYSA-N 1 2 300.406 2.141 20 10 DECDLO CCN(CC)c1ccc(CN2CC[NH2+]CC(F)(F)C2)c(O)c1 ZINC001211341174 801549121 /nfs/dbraw/zinc/54/91/21/801549121.db2.gz HAAJWGYMDASSPZ-UHFFFAOYSA-N 1 2 313.392 2.279 20 10 DECDLO COC1C[C@@H]2COC[C@H](C1)[N@@H+]2Cc1cc(Cl)c(O)cc1O ZINC001232261602 801831859 /nfs/dbraw/zinc/83/18/59/801831859.db2.gz KFMWOTHWBBLCDR-FOSCPWQOSA-N 1 2 313.781 2.129 20 10 DECDLO COC1C[C@@H]2COC[C@H](C1)[N@H+]2Cc1cc(Cl)c(O)cc1O ZINC001232261602 801831865 /nfs/dbraw/zinc/83/18/65/801831865.db2.gz KFMWOTHWBBLCDR-FOSCPWQOSA-N 1 2 313.781 2.129 20 10 DECDLO Cc1ccnc(O[C@H]2CC[N@H+](Cc3ccc(F)c(F)c3O)C2)n1 ZINC001233079423 802023546 /nfs/dbraw/zinc/02/35/46/802023546.db2.gz BKSWRHCMEZEADT-LBPRGKRZSA-N 1 2 321.327 2.422 20 10 DECDLO Cc1ccnc(O[C@H]2CC[N@@H+](Cc3c(O)ccc(F)c3F)C2)n1 ZINC001233336390 802079587 /nfs/dbraw/zinc/07/95/87/802079587.db2.gz KBJPEAKOZBWVQW-NSHDSACASA-N 1 2 321.327 2.422 20 10 DECDLO C[N@@H+]1CC[C@@H](Oc2ccc(O)c3c2C(=O)c2ccccc2C3=O)C1 ZINC001228213111 803331803 /nfs/dbraw/zinc/33/18/03/803331803.db2.gz UMPLPKZXEDRVPO-LLVKDONJSA-N 1 2 323.348 2.251 20 10 DECDLO C[N@H+]1CC[C@@H](Oc2ccc(O)c3c2C(=O)c2ccccc2C3=O)C1 ZINC001228213111 803331809 /nfs/dbraw/zinc/33/18/09/803331809.db2.gz UMPLPKZXEDRVPO-LLVKDONJSA-N 1 2 323.348 2.251 20 10 DECDLO CCCCNC(=O)C[NH+]1CCN(c2ccc(OCC)cc2)CC1 ZINC001335132760 1150378074 /nfs/dbraw/zinc/37/80/74/1150378074.db2.gz GNJUYDPMBZPVPA-UHFFFAOYSA-N 1 2 319.449 2.124 20 10 DECDLO C[C@H]([NH2+][C@@H](C)c1cccc(-c2nn[nH]n2)c1O)c1ccns1 ZINC001603650563 1070020838 /nfs/dbraw/zinc/02/08/38/1070020838.db2.gz LBJSYMJSIRJRMX-IUCAKERBSA-N 1 2 316.390 2.441 20 10 DECDLO C[C@@H]([NH2+]CC[C@@H]1CCSC1)c1cccc(-c2nn[nH]n2)c1O ZINC001603661905 1070029513 /nfs/dbraw/zinc/02/95/13/1070029513.db2.gz DDNMAHXYXQSYKT-GHMZBOCLSA-N 1 2 319.434 2.366 20 10 DECDLO CC[C@H]([NH2+]CC[C@H](C)CCO)c1cccc(-c2nn[nH]n2)c1O ZINC001604053412 1070187556 /nfs/dbraw/zinc/18/75/56/1070187556.db2.gz CBPOHHFDMOHHFA-FZMZJTMJSA-N 1 2 319.409 2.022 20 10 DECDLO CCCCOCC[NH2+][C@@H](C)c1cccc(-c2nn[nH]n2)c1O ZINC001604187971 1070271446 /nfs/dbraw/zinc/27/14/46/1070271446.db2.gz DMMQHXFSSZDOGA-NSHDSACASA-N 1 2 305.382 2.040 20 10 DECDLO C[C@H]([NH2+][C@H](CO)CC(C)(C)C)c1cccc(-c2nn[nH]n2)c1O ZINC001589953883 1076534388 /nfs/dbraw/zinc/53/43/88/1076534388.db2.gz WTLXHVOTMOKNKT-QWRGUYRKSA-N 1 2 319.409 2.020 20 10 DECDLO C[C@@H]([NH2+]C1CC[NH+](C2CC2)CC1)c1cc(C(=O)[O-])ccc1O ZINC001609780698 1077922422 /nfs/dbraw/zinc/92/24/22/1077922422.db2.gz VAEAGVPKHNEBJQ-LLVKDONJSA-N 1 2 304.390 2.368 20 10 DECDLO COC(=O)C[C@H]1C[N@H+](Cc2cc(C(C)C)ccc2O)CCO1 ZINC001657252246 1080167832 /nfs/dbraw/zinc/16/78/32/1080167832.db2.gz IICHIUSGLCLFQO-HNNXBMFYSA-N 1 2 307.390 2.280 20 10 DECDLO COC(=O)C[C@H]1C[N@@H+](Cc2cc(C(C)C)ccc2O)CCO1 ZINC001657252246 1080167837 /nfs/dbraw/zinc/16/78/37/1080167837.db2.gz IICHIUSGLCLFQO-HNNXBMFYSA-N 1 2 307.390 2.280 20 10 DECDLO CNC(=O)[C@@H](Cc1ccccc1)[NH2+]Cc1cccc(Cl)c1O ZINC001659447370 1080240826 /nfs/dbraw/zinc/24/08/26/1080240826.db2.gz WOXSODYXROVAHQ-OAHLLOKOSA-N 1 2 318.804 2.493 20 10 DECDLO COc1ccc(C[NH2+]CCNC(=O)C(F)C(F)(F)F)cc1C ZINC001127737607 1080683304 /nfs/dbraw/zinc/68/33/04/1080683304.db2.gz RGUYECWDIYCKEP-LBPRGKRZSA-N 1 2 322.302 2.110 20 10 DECDLO COc1ccc(C[NH2+]CCNC(=O)[C@H](F)C(F)(F)F)cc1C ZINC001127737607 1080683309 /nfs/dbraw/zinc/68/33/09/1080683309.db2.gz RGUYECWDIYCKEP-LBPRGKRZSA-N 1 2 322.302 2.110 20 10 DECDLO CCC[N@H+](Cc1cc(F)c(F)cc1O)[C@H]1CCS(=O)(=O)C1 ZINC001664152305 1080867309 /nfs/dbraw/zinc/86/73/09/1080867309.db2.gz UXQWNUSKVLDGLY-NSHDSACASA-N 1 2 319.373 2.070 20 10 DECDLO CCC[N@@H+](Cc1cc(F)c(F)cc1O)[C@H]1CCS(=O)(=O)C1 ZINC001664152305 1080867327 /nfs/dbraw/zinc/86/73/27/1080867327.db2.gz UXQWNUSKVLDGLY-NSHDSACASA-N 1 2 319.373 2.070 20 10 DECDLO Oc1cccc(Br)c1C[NH+]1CCN(CCF)CC1 ZINC000707142262 1082340085 /nfs/dbraw/zinc/34/00/85/1082340085.db2.gz HXKHOGRJJQGLNV-UHFFFAOYSA-N 1 2 317.202 2.242 20 10 DECDLO COCCOC[N@@H+]1C[C@H]2C[C@@H](C1)N(c1ccc(OC)cc1C)C2 ZINC001277018558 1083733680 /nfs/dbraw/zinc/73/36/80/1083733680.db2.gz MQLPQHOCORZNRI-CVEARBPZSA-N 1 2 320.433 2.135 20 10 DECDLO COCCOC[N@H+]1C[C@H]2C[C@@H](C1)N(c1ccc(OC)cc1C)C2 ZINC001277018558 1083733691 /nfs/dbraw/zinc/73/36/91/1083733691.db2.gz MQLPQHOCORZNRI-CVEARBPZSA-N 1 2 320.433 2.135 20 10 DECDLO CC(C)(C)NC(=O)[C@]12C[C@H]1CC[N@@H+]2Cc1c(O)cccc1F ZINC001277484042 1083997284 /nfs/dbraw/zinc/99/72/84/1083997284.db2.gz HUFMKZSZJYKYFO-DIFFPNOSSA-N 1 2 306.381 2.410 20 10 DECDLO CC(C)(C)NC(=O)[C@]12C[C@H]1CC[N@H+]2Cc1c(O)cccc1F ZINC001277484042 1083997293 /nfs/dbraw/zinc/99/72/93/1083997293.db2.gz HUFMKZSZJYKYFO-DIFFPNOSSA-N 1 2 306.381 2.410 20 10 DECDLO O=C(N1CCCCO1)[C@@]12C[C@@H]1CC[N@H+]2Cc1c(O)cccc1F ZINC001277492853 1084000561 /nfs/dbraw/zinc/00/05/61/1084000561.db2.gz FFRMBZVTWFEDEJ-YVEFUNNKSA-N 1 2 320.364 2.050 20 10 DECDLO O=C(N1CCCCO1)[C@@]12C[C@@H]1CC[N@@H+]2Cc1c(O)cccc1F ZINC001277492853 1084000568 /nfs/dbraw/zinc/00/05/68/1084000568.db2.gz FFRMBZVTWFEDEJ-YVEFUNNKSA-N 1 2 320.364 2.050 20 10 DECDLO C[C@@H]1C[N@@H+](Cc2cc(F)cc(Br)c2O)CC[C@@H]1O ZINC001235297482 1084376568 /nfs/dbraw/zinc/37/65/68/1084376568.db2.gz MMZYKLXOVUBRNP-PELKAZGASA-N 1 2 318.186 2.497 20 10 DECDLO C[C@@H]1C[N@H+](Cc2cc(F)cc(Br)c2O)CC[C@@H]1O ZINC001235297482 1084376560 /nfs/dbraw/zinc/37/65/60/1084376560.db2.gz MMZYKLXOVUBRNP-PELKAZGASA-N 1 2 318.186 2.497 20 10 DECDLO C[NH+]1CCN(C2CN(Cc3ccc(C(C)(C)C)cc3O)C2)CC1 ZINC001235681521 1084496515 /nfs/dbraw/zinc/49/65/15/1084496515.db2.gz MWMAKLFDZDGGFO-UHFFFAOYSA-N 1 2 317.477 2.121 20 10 DECDLO C[C@@]1(CO)CC[N@H+](Cc2cc(Cl)c(Cl)cc2O)C[C@@H]1O ZINC001236792093 1138429834 /nfs/dbraw/zinc/42/98/34/1138429834.db2.gz BMUHZYQPYOWYHW-KBPBESRZSA-N 1 2 320.216 2.264 20 10 DECDLO C[C@@]1(CO)CC[N@@H+](Cc2cc(Cl)c(Cl)cc2O)C[C@@H]1O ZINC001236792093 1138429844 /nfs/dbraw/zinc/42/98/44/1138429844.db2.gz BMUHZYQPYOWYHW-KBPBESRZSA-N 1 2 320.216 2.264 20 10 DECDLO Oc1ccc(Cl)c(Cl)c1C[N@H+]1CCc2nncn2CC1 ZINC001237077376 1138500670 /nfs/dbraw/zinc/50/06/70/1138500670.db2.gz GOZJAJUSVJFNBS-UHFFFAOYSA-N 1 2 313.188 2.349 20 10 DECDLO Oc1ccc(Cl)c(Cl)c1C[N@@H+]1CCc2nncn2CC1 ZINC001237077376 1138500678 /nfs/dbraw/zinc/50/06/78/1138500678.db2.gz GOZJAJUSVJFNBS-UHFFFAOYSA-N 1 2 313.188 2.349 20 10 DECDLO Oc1cccc(OC(F)(F)F)c1C[N@@H+]1CCC2(C1)OCCO2 ZINC001237110583 1138506160 /nfs/dbraw/zinc/50/61/60/1138506160.db2.gz HKHUYVSIVMBDPY-UHFFFAOYSA-N 1 2 319.279 2.240 20 10 DECDLO Oc1cccc(OC(F)(F)F)c1C[N@H+]1CCC2(C1)OCCO2 ZINC001237110583 1138506167 /nfs/dbraw/zinc/50/61/67/1138506167.db2.gz HKHUYVSIVMBDPY-UHFFFAOYSA-N 1 2 319.279 2.240 20 10 DECDLO O=C1NCC[C@]12CCC[N@@H+](Cc1cc(Cl)cc(F)c1O)C2 ZINC001237618095 1138717684 /nfs/dbraw/zinc/71/76/84/1138717684.db2.gz FOZSOZRWYOULCU-HNNXBMFYSA-N 1 2 312.772 2.287 20 10 DECDLO O=C1NCC[C@]12CCC[N@H+](Cc1cc(Cl)cc(F)c1O)C2 ZINC001237618095 1138717704 /nfs/dbraw/zinc/71/77/04/1138717704.db2.gz FOZSOZRWYOULCU-HNNXBMFYSA-N 1 2 312.772 2.287 20 10 DECDLO CC(=O)N1CCC[N@H+](Cc2cc(F)c(Cl)cc2O)CC1 ZINC001237946938 1138812155 /nfs/dbraw/zinc/81/21/55/1138812155.db2.gz PNIPUIJTNKYEJF-UHFFFAOYSA-N 1 2 300.761 2.239 20 10 DECDLO CC(=O)N1CCC[N@@H+](Cc2cc(F)c(Cl)cc2O)CC1 ZINC001237946938 1138812158 /nfs/dbraw/zinc/81/21/58/1138812158.db2.gz PNIPUIJTNKYEJF-UHFFFAOYSA-N 1 2 300.761 2.239 20 10 DECDLO COc1ccc(CNC(=O)c2ccn3c(C)c[nH+]c3c2)c(O)c1 ZINC001296968498 1139834694 /nfs/dbraw/zinc/83/46/94/1139834694.db2.gz PLFXZAHEDYWVOW-UHFFFAOYSA-N 1 2 311.341 2.287 20 10 DECDLO COC(=O)Cc1ccc(C[N@H+](C)Cc2nccs2)c(O)c1 ZINC001249207859 1141859981 /nfs/dbraw/zinc/85/99/81/1141859981.db2.gz KINSGVLTVZGYRN-UHFFFAOYSA-N 1 2 306.387 2.196 20 10 DECDLO COC(=O)Cc1ccc(C[N@@H+](C)Cc2nccs2)c(O)c1 ZINC001249207859 1141859982 /nfs/dbraw/zinc/85/99/82/1141859982.db2.gz KINSGVLTVZGYRN-UHFFFAOYSA-N 1 2 306.387 2.196 20 10 DECDLO Oc1c(F)cc(Cl)cc1C[NH2+]CCCO[C@H]1CCOC1 ZINC001308327225 1147466474 /nfs/dbraw/zinc/46/64/74/1147466474.db2.gz CUFUXXSXBZPPCN-LBPRGKRZSA-N 1 2 303.761 2.470 20 10 DECDLO COc1cccc(C[N@@H+]2CCNC(=O)[C@@H]2c2ccccc2)c1O ZINC000092675813 185333046 /nfs/dbraw/zinc/33/30/46/185333046.db2.gz WNDKEDYNHZSFIP-INIZCTEOSA-N 1 2 312.369 2.074 20 10 DECDLO COc1cccc(C[N@H+]2CCNC(=O)[C@@H]2c2ccccc2)c1O ZINC000092675813 185333047 /nfs/dbraw/zinc/33/30/47/185333047.db2.gz WNDKEDYNHZSFIP-INIZCTEOSA-N 1 2 312.369 2.074 20 10 DECDLO C[C@@](O)(C[NH2+]Cc1cc([N+](=O)[O-])ccc1O)c1ccsc1 ZINC000077460657 355206674 /nfs/dbraw/zinc/20/66/74/355206674.db2.gz FFQHCFUMPWHKGW-CQSZACIVSA-N 1 2 308.359 2.359 20 10 DECDLO COC(=O)COc1ccc([N@H+](C)CC2CCC(=O)CC2)cc1 ZINC000294886768 533559416 /nfs/dbraw/zinc/55/94/16/533559416.db2.gz CNGJMJNUIKKVJJ-UHFFFAOYSA-N 1 2 305.374 2.434 20 10 DECDLO COC(=O)COc1ccc([N@@H+](C)CC2CCC(=O)CC2)cc1 ZINC000294886768 533559420 /nfs/dbraw/zinc/55/94/20/533559420.db2.gz CNGJMJNUIKKVJJ-UHFFFAOYSA-N 1 2 305.374 2.434 20 10 DECDLO Cc1cc[nH+]c(C)c1NC(=O)NCCc1ccc(O)c(O)c1 ZINC000286977042 131259133 /nfs/dbraw/zinc/25/91/33/131259133.db2.gz BPNBDUGLKCYWMO-UHFFFAOYSA-N 1 2 301.346 2.474 20 10 DECDLO CCCOc1ccc(C[N@H+](C)CCS(=O)(=O)CC)c(O)c1 ZINC000093643488 402017277 /nfs/dbraw/zinc/01/72/77/402017277.db2.gz XUBNYNSEZFTLPB-UHFFFAOYSA-N 1 2 315.435 2.048 20 10 DECDLO CCCOc1ccc(C[N@@H+](C)CCS(=O)(=O)CC)c(O)c1 ZINC000093643488 402017280 /nfs/dbraw/zinc/01/72/80/402017280.db2.gz XUBNYNSEZFTLPB-UHFFFAOYSA-N 1 2 315.435 2.048 20 10 DECDLO Oc1cc2c(cc1C[N@@H+]1CCC[C@@H](c3ccn[nH]3)C1)OCO2 ZINC000121272019 402024656 /nfs/dbraw/zinc/02/46/56/402024656.db2.gz VTWOZWUXWKDXKR-LLVKDONJSA-N 1 2 301.346 2.224 20 10 DECDLO Oc1cc2c(cc1C[N@H+]1CCC[C@@H](c3ccn[nH]3)C1)OCO2 ZINC000121272019 402024659 /nfs/dbraw/zinc/02/46/59/402024659.db2.gz VTWOZWUXWKDXKR-LLVKDONJSA-N 1 2 301.346 2.224 20 10 DECDLO COC(=O)C[N@H+](Cc1cc(Cl)cc(OC)c1O)C(C)C ZINC000184681108 402291386 /nfs/dbraw/zinc/29/13/86/402291386.db2.gz BXTQOHIVTFZTPR-UHFFFAOYSA-N 1 2 301.770 2.438 20 10 DECDLO COC(=O)C[N@@H+](Cc1cc(Cl)cc(OC)c1O)C(C)C ZINC000184681108 402291392 /nfs/dbraw/zinc/29/13/92/402291392.db2.gz BXTQOHIVTFZTPR-UHFFFAOYSA-N 1 2 301.770 2.438 20 10 DECDLO CCNC(=O)N1CC[C@@H]([NH2+][C@H](C)c2ccc(F)c(F)c2O)C1 ZINC000187795843 402511515 /nfs/dbraw/zinc/51/15/15/402511515.db2.gz GMGZNCRWMJYBJK-NXEZZACHSA-N 1 2 313.348 2.125 20 10 DECDLO C[C@H]([NH2+]CCN1CCOC(C)(C)C1)c1ccc(F)c(F)c1O ZINC000187701682 402508688 /nfs/dbraw/zinc/50/86/88/402508688.db2.gz XHPRXMGMPVUQPZ-NSHDSACASA-N 1 2 314.376 2.432 20 10 DECDLO CS(=O)(=O)CC[N@H+](Cc1cccc(Cl)c1O)C1CC1 ZINC000180576738 402620085 /nfs/dbraw/zinc/62/00/85/402620085.db2.gz QAWMIVHGMLFIJK-UHFFFAOYSA-N 1 2 303.811 2.055 20 10 DECDLO CS(=O)(=O)CC[N@@H+](Cc1cccc(Cl)c1O)C1CC1 ZINC000180576738 402620088 /nfs/dbraw/zinc/62/00/88/402620088.db2.gz QAWMIVHGMLFIJK-UHFFFAOYSA-N 1 2 303.811 2.055 20 10 DECDLO CCS(=O)(=O)C1CC[NH+](Cc2ccc(N(C)C)cc2)CC1 ZINC000195160414 402834053 /nfs/dbraw/zinc/83/40/53/402834053.db2.gz ZYXRRNNVIWSSDD-UHFFFAOYSA-N 1 2 310.463 2.152 20 10 DECDLO CCOC1CC(O)(C[NH2+][C@H](C)c2ccc(F)c(F)c2O)C1 ZINC000278398604 402864077 /nfs/dbraw/zinc/86/40/77/402864077.db2.gz GJQURKGUDIINQT-SBTGLGLWSA-N 1 2 301.333 2.251 20 10 DECDLO CC(C)c1nc(N(C)Cc2ccccc2O)nc(N(C)C)[nH+]1 ZINC000271103146 403264651 /nfs/dbraw/zinc/26/46/51/403264651.db2.gz NWAURTMZARWIRU-UHFFFAOYSA-N 1 2 301.394 2.403 20 10 DECDLO CC(C)c1nc(N(C)C)nc(N(C)Cc2ccccc2O)[nH+]1 ZINC000271103146 403264654 /nfs/dbraw/zinc/26/46/54/403264654.db2.gz NWAURTMZARWIRU-UHFFFAOYSA-N 1 2 301.394 2.403 20 10 DECDLO CN(C)C(=O)[C@@H]1CCC[N@@H+]1Cc1cc(Cl)c(F)cc1O ZINC000294823968 403735898 /nfs/dbraw/zinc/73/58/98/403735898.db2.gz GMPUFZSIPWVEAM-LBPRGKRZSA-N 1 2 300.761 2.237 20 10 DECDLO CN(C)C(=O)[C@@H]1CCC[N@H+]1Cc1cc(Cl)c(F)cc1O ZINC000294823968 403735905 /nfs/dbraw/zinc/73/59/05/403735905.db2.gz GMPUFZSIPWVEAM-LBPRGKRZSA-N 1 2 300.761 2.237 20 10 DECDLO O=C(NC1CC1)[C@H]1CCC[N@H+]1Cc1cc(Cl)c(F)cc1O ZINC000295266477 403819720 /nfs/dbraw/zinc/81/97/20/403819720.db2.gz HJJKSULFIASVJP-CYBMUJFWSA-N 1 2 312.772 2.428 20 10 DECDLO O=C(NC1CC1)[C@H]1CCC[N@@H+]1Cc1cc(Cl)c(F)cc1O ZINC000295266477 403819723 /nfs/dbraw/zinc/81/97/23/403819723.db2.gz HJJKSULFIASVJP-CYBMUJFWSA-N 1 2 312.772 2.428 20 10 DECDLO CCOCc1nc([C@H](C)[NH2+]Cc2cc(OC)ccc2O)no1 ZINC000290922755 404359692 /nfs/dbraw/zinc/35/96/92/404359692.db2.gz NZCQOURCXCHLKF-JTQLQIEISA-N 1 2 307.350 2.171 20 10 DECDLO C[N@H+](Cc1c(O)ccc(Cl)c1F)[C@H]1CCCCNC1=O ZINC000365267564 404593324 /nfs/dbraw/zinc/59/33/24/404593324.db2.gz XTVKDQDIKRKRGU-NSHDSACASA-N 1 2 300.761 2.285 20 10 DECDLO C[N@@H+](Cc1c(O)ccc(Cl)c1F)[C@H]1CCCCNC1=O ZINC000365267564 404593335 /nfs/dbraw/zinc/59/33/35/404593335.db2.gz XTVKDQDIKRKRGU-NSHDSACASA-N 1 2 300.761 2.285 20 10 DECDLO COC(=O)[C@@H]1C[C@H](OC)CC[N@@H+]1Cc1ccc(N(C)C)c(F)c1 ZINC000359993968 404811593 /nfs/dbraw/zinc/81/15/93/404811593.db2.gz AMQNOCXZZURYGW-CJNGLKHVSA-N 1 2 324.396 2.044 20 10 DECDLO COC(=O)[C@@H]1C[C@H](OC)CC[N@H+]1Cc1ccc(N(C)C)c(F)c1 ZINC000359993968 404811595 /nfs/dbraw/zinc/81/15/95/404811595.db2.gz AMQNOCXZZURYGW-CJNGLKHVSA-N 1 2 324.396 2.044 20 10 DECDLO C[C@@H]1CC(=O)NCC[N@@H+]1Cc1cc(Cl)cc(Cl)c1O ZINC000377827059 287200491 /nfs/dbraw/zinc/20/04/91/287200491.db2.gz SKYWUNIWYWUDFX-MRVPVSSYSA-N 1 2 303.189 2.409 20 10 DECDLO C[C@@H]1CC(=O)NCC[N@H+]1Cc1cc(Cl)cc(Cl)c1O ZINC000377827059 287200493 /nfs/dbraw/zinc/20/04/93/287200493.db2.gz SKYWUNIWYWUDFX-MRVPVSSYSA-N 1 2 303.189 2.409 20 10 DECDLO CO[C@@H]1COCC[C@@H]1C[NH2+][C@@H](C)c1cc(F)cc(F)c1O ZINC000834881003 649857123 /nfs/dbraw/zinc/85/71/23/649857123.db2.gz XVUXIUHDTOINOK-IMSIIYSGSA-N 1 2 301.333 2.373 20 10 DECDLO C[C@@H]([NH2+][C@H]1C[C@@H](O)C1)c1cc(Br)c(F)cc1O ZINC000834907194 649859122 /nfs/dbraw/zinc/85/91/22/649859122.db2.gz YIQZTTBLLPVMIO-PRJMDXOYSA-N 1 2 304.159 2.468 20 10 DECDLO CCC[C@H]1C(=O)NCC[N@H+]1C/C=C\c1ccc(N(C)C)cc1 ZINC000835028040 649868704 /nfs/dbraw/zinc/86/87/04/649868704.db2.gz IRBRESNNHOOHHF-WVRJYTFGSA-N 1 2 301.434 2.366 20 10 DECDLO CCC[C@H]1C(=O)NCC[N@@H+]1C/C=C\c1ccc(N(C)C)cc1 ZINC000835028040 649868708 /nfs/dbraw/zinc/86/87/08/649868708.db2.gz IRBRESNNHOOHHF-WVRJYTFGSA-N 1 2 301.434 2.366 20 10 DECDLO Cc1ccc(C(=O)N2CC[C@@H](Oc3cc[nH+]cc3)C2)c(O)c1O ZINC000364185628 526124412 /nfs/dbraw/zinc/12/44/12/526124412.db2.gz GZHDOXMPWWXFKB-CYBMUJFWSA-N 1 2 314.341 2.095 20 10 DECDLO CC(=O)c1cc(Cl)cc(C[N@@H+]2CC[C@@H](n3cncn3)C2)c1O ZINC000368888796 527207089 /nfs/dbraw/zinc/20/70/89/527207089.db2.gz NFYDHNGISVJNQC-CYBMUJFWSA-N 1 2 320.780 2.287 20 10 DECDLO CC(=O)c1cc(Cl)cc(C[N@H+]2CC[C@@H](n3cncn3)C2)c1O ZINC000368888796 527207092 /nfs/dbraw/zinc/20/70/92/527207092.db2.gz NFYDHNGISVJNQC-CYBMUJFWSA-N 1 2 320.780 2.287 20 10 DECDLO O=C(NCc1cccc(Cl)c1O)[C@@H]1CCn2c[nH+]cc2C1 ZINC000890760603 623198373 /nfs/dbraw/zinc/19/83/73/623198373.db2.gz VCFYXSGWHHWWPV-SNVBAGLBSA-N 1 2 305.765 2.121 20 10 DECDLO CCCCOC(=O)C[N@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000071124007 623821080 /nfs/dbraw/zinc/82/10/80/623821080.db2.gz UIELTHVRYXUHJU-UHFFFAOYSA-N 1 2 320.433 2.298 20 10 DECDLO CCCCOC(=O)C[N@@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000071124007 623821086 /nfs/dbraw/zinc/82/10/86/623821086.db2.gz UIELTHVRYXUHJU-UHFFFAOYSA-N 1 2 320.433 2.298 20 10 DECDLO CCOC(=O)[C@@H]1CCCC[N@@H+]1Cc1ccc(OC)c(OC)c1O ZINC000891486017 624213707 /nfs/dbraw/zinc/21/37/07/624213707.db2.gz YUNGBFIXJDHHRT-ZDUSSCGKSA-N 1 2 323.389 2.327 20 10 DECDLO CCOC(=O)[C@@H]1CCCC[N@H+]1Cc1ccc(OC)c(OC)c1O ZINC000891486017 624213708 /nfs/dbraw/zinc/21/37/08/624213708.db2.gz YUNGBFIXJDHHRT-ZDUSSCGKSA-N 1 2 323.389 2.327 20 10 DECDLO CC[C@@H](CO)Nc1cc(N(C)Cc2ccccc2O)nc[nH+]1 ZINC000893019540 625054910 /nfs/dbraw/zinc/05/49/10/625054910.db2.gz VJRVCNJBLFBLGO-ZDUSSCGKSA-N 1 2 302.378 2.001 20 10 DECDLO CC[C@@H](CO)Nc1cc(N(C)Cc2ccccc2O)[nH+]cn1 ZINC000893019540 625054919 /nfs/dbraw/zinc/05/49/19/625054919.db2.gz VJRVCNJBLFBLGO-ZDUSSCGKSA-N 1 2 302.378 2.001 20 10 DECDLO OC[C@H]1CC[N@H+](Cc2cc(Br)cc(F)c2O)C1 ZINC000893987342 636085059 /nfs/dbraw/zinc/08/50/59/636085059.db2.gz UNULMTQNUXKRIG-QMMMGPOBSA-N 1 2 304.159 2.108 20 10 DECDLO OC[C@H]1CC[N@@H+](Cc2cc(Br)cc(F)c2O)C1 ZINC000893987342 636085060 /nfs/dbraw/zinc/08/50/60/636085060.db2.gz UNULMTQNUXKRIG-QMMMGPOBSA-N 1 2 304.159 2.108 20 10 DECDLO CN(C)c1ccc(C[NH2+]Cc2noc3c2COCC3)cc1F ZINC000923016035 636915800 /nfs/dbraw/zinc/91/58/00/636915800.db2.gz IGLYVQUJPUPODR-UHFFFAOYSA-N 1 2 305.353 2.242 20 10 DECDLO COc1ccc(N(C)CCN(C)c2nccn3c[nH+]cc23)cc1 ZINC000894389351 636984056 /nfs/dbraw/zinc/98/40/56/636984056.db2.gz PSIBEIQLUQNLCG-UHFFFAOYSA-N 1 2 311.389 2.311 20 10 DECDLO CC(C)(O)C1C[NH+](Cc2cc(Br)cc(F)c2O)C1 ZINC000894976544 637354457 /nfs/dbraw/zinc/35/44/57/637354457.db2.gz LBNDYABNMGYQQF-UHFFFAOYSA-N 1 2 318.186 2.497 20 10 DECDLO Cc1n[nH]c([C@@H]2CC[N@@H+](Cc3cc(F)c(N(C)C)cc3F)C2)n1 ZINC000895011858 637374839 /nfs/dbraw/zinc/37/48/39/637374839.db2.gz MCGBJTRNKRXOEB-LLVKDONJSA-N 1 2 321.375 2.447 20 10 DECDLO Cc1n[nH]c([C@@H]2CC[N@H+](Cc3cc(F)c(N(C)C)cc3F)C2)n1 ZINC000895011858 637374844 /nfs/dbraw/zinc/37/48/44/637374844.db2.gz MCGBJTRNKRXOEB-LLVKDONJSA-N 1 2 321.375 2.447 20 10 DECDLO Cc1nc([C@@H]2CC[N@@H+](Cc3cc(F)c(N(C)C)cc3F)C2)n[nH]1 ZINC000895011858 637374849 /nfs/dbraw/zinc/37/48/49/637374849.db2.gz MCGBJTRNKRXOEB-LLVKDONJSA-N 1 2 321.375 2.447 20 10 DECDLO Cc1nc([C@@H]2CC[N@H+](Cc3cc(F)c(N(C)C)cc3F)C2)n[nH]1 ZINC000895011858 637374852 /nfs/dbraw/zinc/37/48/52/637374852.db2.gz MCGBJTRNKRXOEB-LLVKDONJSA-N 1 2 321.375 2.447 20 10 DECDLO COC(=O)[C@]12CCC[C@H]1C[N@H+](Cc1cc(F)cc(F)c1O)C2 ZINC000895582850 638101761 /nfs/dbraw/zinc/10/17/61/638101761.db2.gz HUKRGRAPAJHCBM-ZBEGNZNMSA-N 1 2 311.328 2.446 20 10 DECDLO COC(=O)[C@]12CCC[C@H]1C[N@@H+](Cc1cc(F)cc(F)c1O)C2 ZINC000895582850 638101763 /nfs/dbraw/zinc/10/17/63/638101763.db2.gz HUKRGRAPAJHCBM-ZBEGNZNMSA-N 1 2 311.328 2.446 20 10 DECDLO CC(C)(C[NH2+]Cc1cc(Cl)cc(F)c1O)CS(C)(=O)=O ZINC000896870619 638748475 /nfs/dbraw/zinc/74/84/75/638748475.db2.gz ORIGZIRTTPMDTB-UHFFFAOYSA-N 1 2 323.817 2.345 20 10 DECDLO C[C@H]([NH2+]CCCN1CCOCC1)c1cc(F)cc(F)c1O ZINC000756342961 639652244 /nfs/dbraw/zinc/65/22/44/639652244.db2.gz LZWZVRYVYXRKMX-NSHDSACASA-N 1 2 300.349 2.043 20 10 DECDLO COCCN1CCC[C@H]1C[NH2+][C@H](C)c1cc(F)cc(F)c1O ZINC000756531836 639669701 /nfs/dbraw/zinc/66/97/01/639669701.db2.gz BEHOGKPZBCKIQD-YPMHNXCESA-N 1 2 314.376 2.432 20 10 DECDLO C[C@H](C[NH2+][C@H](C)c1cc(F)cc(F)c1O)CN1CCOCC1 ZINC000756591061 639678278 /nfs/dbraw/zinc/67/82/78/639678278.db2.gz DYKFNJSWPCSINP-VXGBXAGGSA-N 1 2 314.376 2.289 20 10 DECDLO COC1CCN(CC[NH2+][C@H](C)c2cc(F)cc(F)c2O)CC1 ZINC000756641913 639680757 /nfs/dbraw/zinc/68/07/57/639680757.db2.gz JMMFHBMEKFHKPA-LLVKDONJSA-N 1 2 314.376 2.432 20 10 DECDLO CCNC(=O)N1CC[C@H]([NH2+][C@@H](C)c2cc(F)cc(F)c2O)C1 ZINC000756760343 639693076 /nfs/dbraw/zinc/69/30/76/639693076.db2.gz NSZSVPYCQOXZGV-ONGXEEELSA-N 1 2 313.348 2.125 20 10 DECDLO C[C@H]([NH2+]Cc1cccc(Cl)c1O)C1CCS(=O)(=O)CC1 ZINC000898219168 641051501 /nfs/dbraw/zinc/05/15/01/641051501.db2.gz WAEUXUMYNPSGIM-JTQLQIEISA-N 1 2 317.838 2.349 20 10 DECDLO COC(=O)C[C@]1([NH2+]Cc2cccc(Cl)c2O)CCCOC1 ZINC000770681324 641407375 /nfs/dbraw/zinc/40/73/75/641407375.db2.gz VZUHXHXNNPZELG-OAHLLOKOSA-N 1 2 313.781 2.248 20 10 DECDLO COc1c(O)c(CNCC2([NH+](C)C)CCCC2)ccc1[N+](=O)[O-] ZINC000774953476 641985966 /nfs/dbraw/zinc/98/59/66/641985966.db2.gz JQCIGVCMKCOSIL-UHFFFAOYSA-N 1 2 323.393 2.273 20 10 DECDLO CC(=O)NC1CC[NH+](Cc2cc(Cl)cc(F)c2O)CC1 ZINC000775665491 642075500 /nfs/dbraw/zinc/07/55/00/642075500.db2.gz DBXFKNHQKXZMTK-UHFFFAOYSA-N 1 2 300.761 2.285 20 10 DECDLO O=C(CNc1cccc[nH+]1)NCc1ccc(N2CCCC2)cc1 ZINC000900188468 642285560 /nfs/dbraw/zinc/28/55/60/642285560.db2.gz WODBORFXWGVRCH-UHFFFAOYSA-N 1 2 310.401 2.410 20 10 DECDLO C[C@H]1CC[N@H+](CC(=O)N(C)Cc2ccc(N(C)C)cc2)C[C@@H]1F ZINC000778235853 642357914 /nfs/dbraw/zinc/35/79/14/642357914.db2.gz JBXNBKZWEPDQAN-YOEHRIQHSA-N 1 2 321.440 2.391 20 10 DECDLO C[C@H]1CC[N@@H+](CC(=O)N(C)Cc2ccc(N(C)C)cc2)C[C@@H]1F ZINC000778235853 642357916 /nfs/dbraw/zinc/35/79/16/642357916.db2.gz JBXNBKZWEPDQAN-YOEHRIQHSA-N 1 2 321.440 2.391 20 10 DECDLO CC(C)CN1CC[N@H+](Cc2ccc(N(C)C)cc2)[C@H](C)C1=O ZINC000779203025 642472138 /nfs/dbraw/zinc/47/21/38/642472138.db2.gz VQWGWUZCDPELKI-OAHLLOKOSA-N 1 2 303.450 2.441 20 10 DECDLO CC(C)CN1CC[N@@H+](Cc2ccc(N(C)C)cc2)[C@H](C)C1=O ZINC000779203025 642472141 /nfs/dbraw/zinc/47/21/41/642472141.db2.gz VQWGWUZCDPELKI-OAHLLOKOSA-N 1 2 303.450 2.441 20 10 DECDLO NC(=O)[C@@H]1[C@@H]2CCC[C@H]2C[N@@H+]1Cc1cc(Cl)cc(F)c1O ZINC000787422326 643493850 /nfs/dbraw/zinc/49/38/50/643493850.db2.gz DZYZZDFSURRUIY-KDDOJWQBSA-N 1 2 312.772 2.271 20 10 DECDLO NC(=O)[C@@H]1[C@@H]2CCC[C@H]2C[N@H+]1Cc1cc(Cl)cc(F)c1O ZINC000787422326 643493854 /nfs/dbraw/zinc/49/38/54/643493854.db2.gz DZYZZDFSURRUIY-KDDOJWQBSA-N 1 2 312.772 2.271 20 10 DECDLO CCOC(=O)[C@@H]([NH2+]Cc1cc(C)c(C)cc1O)[C@@H]1CCCOC1 ZINC000789581725 643751284 /nfs/dbraw/zinc/75/12/84/643751284.db2.gz SYGJGDJYDNWLHY-PBHICJAKSA-N 1 2 321.417 2.457 20 10 DECDLO COc1cccc(O)c1C[NH+]1CC(O)(c2ccc(F)cc2)C1 ZINC000811503486 646537469 /nfs/dbraw/zinc/53/74/69/646537469.db2.gz OWBJCALBPJHWEJ-UHFFFAOYSA-N 1 2 303.333 2.243 20 10 DECDLO Cc1cc(C[N@@H+]2CCO[C@@H](C(=O)C3CC3)C2)ccc1N(C)C ZINC000815094361 646967222 /nfs/dbraw/zinc/96/72/22/646967222.db2.gz JZEODRYOTPZZHO-QGZVFWFLSA-N 1 2 302.418 2.241 20 10 DECDLO Cc1cc(C[N@H+]2CCO[C@@H](C(=O)C3CC3)C2)ccc1N(C)C ZINC000815094361 646967228 /nfs/dbraw/zinc/96/72/28/646967228.db2.gz JZEODRYOTPZZHO-QGZVFWFLSA-N 1 2 302.418 2.241 20 10 DECDLO OCCCN1CCC[C@@H]1C[NH2+]Cc1cc(Cl)cc(F)c1O ZINC000824565493 648611592 /nfs/dbraw/zinc/61/15/92/648611592.db2.gz XCAWRKPAVCWPGZ-CYBMUJFWSA-N 1 2 316.804 2.121 20 10 DECDLO C[C@H]1C[N@H+](CCO)CCN1Cc1cc(Cl)cc(Cl)c1O ZINC000825337434 648744434 /nfs/dbraw/zinc/74/44/34/648744434.db2.gz GRNYECKLZXPZKF-JTQLQIEISA-N 1 2 319.232 2.197 20 10 DECDLO C[C@H]1C[N@@H+](CCO)CCN1Cc1cc(Cl)cc(Cl)c1O ZINC000825337434 648744437 /nfs/dbraw/zinc/74/44/37/648744437.db2.gz GRNYECKLZXPZKF-JTQLQIEISA-N 1 2 319.232 2.197 20 10 DECDLO COC(=O)C[C@H]1COCC[N@@H+]1Cc1cc(Cl)c(C)cc1O ZINC000825940140 648829501 /nfs/dbraw/zinc/82/95/01/648829501.db2.gz NLEGTXFINJSEBR-LBPRGKRZSA-N 1 2 313.781 2.118 20 10 DECDLO COC(=O)C[C@H]1COCC[N@H+]1Cc1cc(Cl)c(C)cc1O ZINC000825940140 648829504 /nfs/dbraw/zinc/82/95/04/648829504.db2.gz NLEGTXFINJSEBR-LBPRGKRZSA-N 1 2 313.781 2.118 20 10 DECDLO O=C1C[C@H](C[NH2+]Cc2cc(Cl)cc(F)c2O)CN1C1CC1 ZINC000846073501 651306419 /nfs/dbraw/zinc/30/64/19/651306419.db2.gz WOIIWOLNJHDFAE-SECBINFHSA-N 1 2 312.772 2.285 20 10 DECDLO O=C(NCc1cc(Cl)ccc1O)[C@@H]1CCn2cc[nH+]c2C1 ZINC000846475279 651332544 /nfs/dbraw/zinc/33/25/44/651332544.db2.gz FFJAUUAMXMIQMN-SNVBAGLBSA-N 1 2 305.765 2.121 20 10 DECDLO CCc1cccc(C[N@@H+]2CCc3[nH]nc(C(=O)OC)c3C2)c1O ZINC000848914959 651560341 /nfs/dbraw/zinc/56/03/41/651560341.db2.gz POCZCABNWUINAQ-UHFFFAOYSA-N 1 2 315.373 2.023 20 10 DECDLO CCc1cccc(C[N@H+]2CCc3[nH]nc(C(=O)OC)c3C2)c1O ZINC000848914959 651560348 /nfs/dbraw/zinc/56/03/48/651560348.db2.gz POCZCABNWUINAQ-UHFFFAOYSA-N 1 2 315.373 2.023 20 10 DECDLO COc1c(O)c(C[NH+]2CC3(CC3(F)F)C2)ccc1[N+](=O)[O-] ZINC000848922100 651562041 /nfs/dbraw/zinc/56/20/41/651562041.db2.gz MMBXLYHBZUDHIH-UHFFFAOYSA-N 1 2 300.261 2.150 20 10 DECDLO COC(=O)[C@@H](C[C@H]1CCCOC1)[NH2+]Cc1cccc(C)c1O ZINC000862516353 686313029 /nfs/dbraw/zinc/31/30/29/686313029.db2.gz PLTOOVMCFLOESI-UKRRQHHQSA-N 1 2 307.390 2.149 20 10 DECDLO COC(=O)[C@H](C[C@@H]1CCCOC1)[NH2+]Cc1cccc(C)c1O ZINC000862516354 686313703 /nfs/dbraw/zinc/31/37/03/686313703.db2.gz PLTOOVMCFLOESI-ZFWWWQNUSA-N 1 2 307.390 2.149 20 10 DECDLO C[C@H]([NH2+]Cc1ccc(F)c(F)c1O)C(=O)NCc1ccco1 ZINC000877150319 690030408 /nfs/dbraw/zinc/03/04/08/690030408.db2.gz OPOQSSFUKMMTLQ-VIFPVBQESA-N 1 2 310.300 2.058 20 10 DECDLO C[C@@]1(NC(=O)C(F)(F)F)CC[N@H+](Cc2ccccc2O)C1 ZINC000877775361 690223652 /nfs/dbraw/zinc/22/36/52/690223652.db2.gz LIBKUUPVRBNTAN-CYBMUJFWSA-N 1 2 302.296 2.035 20 10 DECDLO C[C@@]1(NC(=O)C(F)(F)F)CC[N@@H+](Cc2ccccc2O)C1 ZINC000877775361 690223655 /nfs/dbraw/zinc/22/36/55/690223655.db2.gz LIBKUUPVRBNTAN-CYBMUJFWSA-N 1 2 302.296 2.035 20 10 DECDLO CCN(CC)c1ccc(C[NH+]2CCN([S@@](C)(=N)=O)CC2)cc1 ZINC000877793891 690232643 /nfs/dbraw/zinc/23/26/43/690232643.db2.gz CSNHMIRXWQZXFX-JOCHJYFZSA-N 1 2 324.494 2.242 20 10 DECDLO