smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CN1CCC(NC(=O)N2CCN(C(=O)C(=O)N3CCOCC3)CC2)CC1 ZINC000043180369 483691377 /nfs/dbraw/zinc/69/13/77/483691377.db2.gz UIYGVXZMSDQQOT-UHFFFAOYSA-N 0 3 367.450 -1.207 20 0 FAADHN CNC(=O)NC(=O)CCN1CCN(CCC(=O)NC(=O)NC)[C@H](C)C1 ZINC000046781794 483692001 /nfs/dbraw/zinc/69/20/01/483692001.db2.gz ACUNAKUSKZWGIJ-LLVKDONJSA-N 0 3 356.427 -1.316 20 0 FAADHN CNC(=O)NC(=O)CCN1CCN(CCC(=O)NC(=O)NC)[C@@H](C)C1 ZINC000046781798 483692400 /nfs/dbraw/zinc/69/24/00/483692400.db2.gz ACUNAKUSKZWGIJ-NSHDSACASA-N 0 3 356.427 -1.316 20 0 FAADHN CCN1CCN([C@@H](C)CNC(=O)CN2CCN(CC)C(=O)C2=O)CC1 ZINC000046948366 482563011 /nfs/dbraw/zinc/56/30/11/482563011.db2.gz WHHVXOFFPYZTLX-AWEZNQCLSA-N 0 3 353.467 -1.181 20 0 FAADHN CCN1CCN([C@H](C)CNC(=O)CN2CCN(CC)C(=O)C2=O)CC1 ZINC000046948367 482562098 /nfs/dbraw/zinc/56/20/98/482562098.db2.gz WHHVXOFFPYZTLX-CQSZACIVSA-N 0 3 353.467 -1.181 20 0 FAADHN CC(C(=O)N1CCN(S(=O)(=O)N2CCOCC2)CC1)S(C)(=O)=O ZINC000048192984 482587498 /nfs/dbraw/zinc/58/74/98/482587498.db2.gz QZRNBLFGPZDOJN-NSHDSACASA-N 0 3 369.465 -1.859 20 0 FAADHN CC(C(=O)N1CCN(S(=O)(=O)N2CCOCC2)CC1)S(C)(=O)=O ZINC000048192985 482588389 /nfs/dbraw/zinc/58/83/89/482588389.db2.gz QZRNBLFGPZDOJN-LLVKDONJSA-N 0 3 369.465 -1.859 20 0 FAADHN COCCN1C(=O)C(=CNCCC[NH+]2CCN(C)CC2)C(=O)[N-]C1=S ZINC000052529085 657323982 /nfs/dbraw/zinc/32/39/82/657323982.db2.gz WIVOIRBTBDTMNN-SEYXRHQNSA-N 0 3 369.491 -1.013 20 0 FAADHN CCN1CCN(C[C@@H](C)CNC(=O)Cn2ccc(=O)n(C)c2=O)CC1 ZINC000053091846 482578419 /nfs/dbraw/zinc/57/84/19/482578419.db2.gz MLBYKFNBNIQSPS-AWEZNQCLSA-N 0 3 351.451 -1.063 20 0 FAADHN CCN1CCN(C[C@H](C)CNC(=O)Cn2ccc(=O)n(C)c2=O)CC1 ZINC000053091847 482577971 /nfs/dbraw/zinc/57/79/71/482577971.db2.gz MLBYKFNBNIQSPS-CQSZACIVSA-N 0 3 351.451 -1.063 20 0 FAADHN COCCN(C(=O)CNC1(CO)CCOCC1)[C@@H]1CCS(=O)(=O)C1 ZINC000069248156 791018545 /nfs/dbraw/zinc/01/85/45/791018545.db2.gz JIKVHLGHRYHIOY-CYBMUJFWSA-N 0 3 364.464 -1.220 20 0 FAADHN COCCN(C(=O)CNC1(CO)CCOCC1)[C@H]1CCS(=O)(=O)C1 ZINC000069248157 791018352 /nfs/dbraw/zinc/01/83/52/791018352.db2.gz JIKVHLGHRYHIOY-ZDUSSCGKSA-N 0 3 364.464 -1.220 20 0 FAADHN Cn1c2[n-]c(CN3CCN(C(=O)C[NH+](C)C)CC3)nc2c(=O)n(C)c1=O ZINC000093158949 482637608 /nfs/dbraw/zinc/63/76/08/482637608.db2.gz LJHMLOITKDIBKD-UHFFFAOYSA-N 0 3 363.422 -1.834 20 0 FAADHN C[C@@H](CNC(=O)c1cn(CC(=O)N(C)C)nn1)CN1CCN(C)CC1 ZINC000098035914 792893949 /nfs/dbraw/zinc/89/39/49/792893949.db2.gz GMZAKGQNUXWBKV-ZDUSSCGKSA-N 0 3 351.455 -1.020 20 0 FAADHN C[C@H](CNC(=O)c1cn(CC(=O)N(C)C)nn1)CN1CCN(C)CC1 ZINC000098035915 792894666 /nfs/dbraw/zinc/89/46/66/792894666.db2.gz GMZAKGQNUXWBKV-CYBMUJFWSA-N 0 3 351.455 -1.020 20 0 FAADHN C[C@@H](O)CN1CCN(CCn2cnc3c2c(=O)n(C)c(=O)n3C)C[C@H]1C ZINC000106100171 483195584 /nfs/dbraw/zinc/19/55/84/483195584.db2.gz BOZCRWAAJXURPN-CHWSQXEVSA-N 0 3 364.450 -1.179 20 0 FAADHN C[C@@H](O)CN1CCN(CCn2cnc3c2c(=O)n(C)c(=O)n3C)C[C@@H]1C ZINC000106100174 483195305 /nfs/dbraw/zinc/19/53/05/483195305.db2.gz BOZCRWAAJXURPN-QWHCGFSZSA-N 0 3 364.450 -1.179 20 0 FAADHN CN(C)CCn1cc(NC(=O)Cn2c(=O)c3c(ncn3C)n(C)c2=O)cn1 ZINC000109536680 482832158 /nfs/dbraw/zinc/83/21/58/482832158.db2.gz ZCSVCNCXEZKABE-UHFFFAOYSA-N 0 3 374.405 -1.170 20 0 FAADHN CN(CCn1cnc2c1c(=O)n(C)c(=O)n2C)CCN1CCOCC1 ZINC000114190541 482670802 /nfs/dbraw/zinc/67/08/02/482670802.db2.gz HQXSBONCDRUVLJ-UHFFFAOYSA-N 0 3 350.423 -1.302 20 0 FAADHN CC[C@H](O)CN1CCN(CCn2cnc3c2c(=O)n(C)c(=O)n3C)CC1 ZINC000118857471 482821621 /nfs/dbraw/zinc/82/16/21/482821621.db2.gz QWCAELUIUUAWDX-ZDUSSCGKSA-N 0 3 364.450 -1.178 20 0 FAADHN CC[C@@H](O)CN1CCN(CCn2cnc3c2c(=O)n(C)c(=O)n3C)CC1 ZINC000118857472 482822172 /nfs/dbraw/zinc/82/21/72/482822172.db2.gz QWCAELUIUUAWDX-CYBMUJFWSA-N 0 3 364.450 -1.178 20 0 FAADHN CN(C)CCn1ccc(NC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)n1 ZINC000120058427 482658076 /nfs/dbraw/zinc/65/80/76/482658076.db2.gz KACQFISXSMMHML-UHFFFAOYSA-N 0 3 374.405 -1.170 20 0 FAADHN CN(C)CCn1cc(NC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)cn1 ZINC000130234752 483301798 /nfs/dbraw/zinc/30/17/98/483301798.db2.gz PMAKRYVCTGWQBF-UHFFFAOYSA-N 0 3 374.405 -1.170 20 0 FAADHN CN1CCC[C@@H]1CNC(=O)N1CCN(C(=O)C(=O)N2CCOCC2)CC1 ZINC000139459812 483556573 /nfs/dbraw/zinc/55/65/73/483556573.db2.gz FOIVMJQNXFZFSZ-CQSZACIVSA-N 0 3 367.450 -1.207 20 0 FAADHN CN1CCC[C@H]1CNC(=O)N1CCN(C(=O)C(=O)N2CCOCC2)CC1 ZINC000139459968 482551003 /nfs/dbraw/zinc/55/10/03/482551003.db2.gz FOIVMJQNXFZFSZ-AWEZNQCLSA-N 0 3 367.450 -1.207 20 0 FAADHN OC[C@H]1O[C@@H](n2cnc3c2ncnc3NCCN2CCCC2)[C@H](O)[C@@H]1O ZINC000142343703 482706398 /nfs/dbraw/zinc/70/63/98/482706398.db2.gz YNKUHRYLOSWPTB-XNIJJKJLSA-N 0 3 364.406 -1.055 20 0 FAADHN C[NH+](C)C[C@](C)(O)CNC(=O)Cn1cc(Br)c(=O)[n-]c1=O ZINC000152898264 482716973 /nfs/dbraw/zinc/71/69/73/482716973.db2.gz ZAOWIDQZQXHMRV-GFCCVEGCSA-N 0 3 363.212 -1.272 20 0 FAADHN C[NH+](C)C[C@@](C)(O)CNC(=O)Cn1cc(Br)c(=O)[n-]c1=O ZINC000152898364 482716988 /nfs/dbraw/zinc/71/69/88/482716988.db2.gz ZAOWIDQZQXHMRV-LBPRGKRZSA-N 0 3 363.212 -1.272 20 0 FAADHN CN1CCN(C(=O)Cn2cc(Br)c(=O)[n-]c2=O)[C@H](C[NH3+])C1 ZINC000162349213 483310257 /nfs/dbraw/zinc/31/02/57/483310257.db2.gz IXNGPHDIXJHLKQ-MRVPVSSYSA-N 0 3 360.212 -1.600 20 0 FAADHN CN1CCN(C(=O)Cn2cc(Br)c(=O)[n-]c2=O)[C@@H](C[NH3+])C1 ZINC000162349349 483309672 /nfs/dbraw/zinc/30/96/72/483309672.db2.gz IXNGPHDIXJHLKQ-QMMMGPOBSA-N 0 3 360.212 -1.600 20 0 FAADHN COCCN(C)CCNC(=O)Cn1cc(Br)c(=O)[nH]c1=O ZINC000171129712 482756613 /nfs/dbraw/zinc/75/66/13/482756613.db2.gz VETDJYUEFXXDTM-UHFFFAOYSA-N 0 3 363.212 -1.007 20 0 FAADHN Cn1c2[nH]c(CN3CCN(CC(C)(C)O)CC3)nc2c(=O)n(C)c1=O ZINC000171152724 482704479 /nfs/dbraw/zinc/70/44/79/482704479.db2.gz ZMXLGWRSEQSEND-UHFFFAOYSA-N 0 3 350.423 -1.151 20 0 FAADHN Cn1c2ncn(CCN3CCN(CC(C)(C)O)CC3)c2c(=O)n(C)c1=O ZINC000171153059 483263539 /nfs/dbraw/zinc/26/35/39/483263539.db2.gz IFVFZEJMNDUUIB-UHFFFAOYSA-N 0 3 364.450 -1.178 20 0 FAADHN Cn1c2ncn(CCN3CCC[C@H](OCCO)C3)c2c(=O)n(C)c1=O ZINC000172292916 482755747 /nfs/dbraw/zinc/75/57/47/482755747.db2.gz RPGHTBSGPHJWKT-LBPRGKRZSA-N 0 3 351.407 -1.093 20 0 FAADHN Cn1c2ncn(CCN3CCC[C@@H](OCCO)C3)c2c(=O)n(C)c1=O ZINC000172292919 272805402 /nfs/dbraw/zinc/80/54/02/272805402.db2.gz RPGHTBSGPHJWKT-GFCCVEGCSA-N 0 3 351.407 -1.093 20 0 FAADHN CC[C@@H](CO)N1CCN(Cc2nc3c([nH]2)n(C)c(=O)n(C)c3=O)CC1 ZINC000173743489 272805670 /nfs/dbraw/zinc/80/56/70/272805670.db2.gz VDRJRHFPHYYKNV-NSHDSACASA-N 0 3 350.423 -1.151 20 0 FAADHN CC[C@H](CO)N1CCN(Cc2nc3c([nH]2)n(C)c(=O)n(C)c3=O)CC1 ZINC000173743503 482757972 /nfs/dbraw/zinc/75/79/72/482757972.db2.gz VDRJRHFPHYYKNV-LLVKDONJSA-N 0 3 350.423 -1.151 20 0 FAADHN CC[C@@H](CO)N1CCN(CCn2cnc3c2c(=O)n(C)c(=O)n3C)CC1 ZINC000173748167 272805349 /nfs/dbraw/zinc/80/53/49/272805349.db2.gz ORYNDMHVBDGUDH-ZDUSSCGKSA-N 0 3 364.450 -1.178 20 0 FAADHN CC[C@H](CO)N1CCN(CCn2cnc3c2c(=O)n(C)c(=O)n3C)CC1 ZINC000173748180 483265147 /nfs/dbraw/zinc/26/51/47/483265147.db2.gz ORYNDMHVBDGUDH-CYBMUJFWSA-N 0 3 364.450 -1.178 20 0 FAADHN Cn1cnc2c1c(=O)n(CCCN1CCC(NC(N)=O)CC1)c(=O)n2C ZINC000174918686 483265325 /nfs/dbraw/zinc/26/53/25/483265325.db2.gz XCRFSILWYRTHAT-UHFFFAOYSA-N 0 3 363.422 -1.044 20 0 FAADHN C[C@@H]1CN(CCCn2c(=O)c3c(ncn3C)n(C)c2=O)CCN1CCO ZINC000187698710 482540765 /nfs/dbraw/zinc/54/07/65/482540765.db2.gz SBZYTZUNGZRSLN-CYBMUJFWSA-N 0 3 364.450 -1.178 20 0 FAADHN C[C@H]1CN(CCCn2c(=O)c3c(ncn3C)n(C)c2=O)CCN1CCO ZINC000187698726 482541208 /nfs/dbraw/zinc/54/12/08/482541208.db2.gz SBZYTZUNGZRSLN-ZDUSSCGKSA-N 0 3 364.450 -1.178 20 0 FAADHN C[C@@H](O)CN1CCN(CCCn2c(=O)c3c(ncn3C)n(C)c2=O)CC1 ZINC000189343120 483122636 /nfs/dbraw/zinc/12/26/36/483122636.db2.gz WRUHSRGPYCRZTK-CYBMUJFWSA-N 0 3 364.450 -1.178 20 0 FAADHN C[C@H](O)CN1CCN(CCCn2c(=O)c3c(ncn3C)n(C)c2=O)CC1 ZINC000189351104 483271287 /nfs/dbraw/zinc/27/12/87/483271287.db2.gz WRUHSRGPYCRZTK-ZDUSSCGKSA-N 0 3 364.450 -1.178 20 0 FAADHN C[C@@H](O)CN1CCN(CCn2cnc3c2c(=O)n(C)c(=O)n3C)[C@H](C)C1 ZINC000191232404 483126165 /nfs/dbraw/zinc/12/61/65/483126165.db2.gz PBQNCURFJHCVLE-CHWSQXEVSA-N 0 3 364.450 -1.179 20 0 FAADHN C[C@@H](O)CN1CCN(CCn2cnc3c2c(=O)n(C)c(=O)n3C)[C@@H](C)C1 ZINC000191232417 483126028 /nfs/dbraw/zinc/12/60/28/483126028.db2.gz PBQNCURFJHCVLE-QWHCGFSZSA-N 0 3 364.450 -1.179 20 0 FAADHN CN(C)CCN1CCN(C(=O)c2cnc3c(c2)c(=O)n(C)c(=O)n3C)CC1 ZINC000192537605 483330542 /nfs/dbraw/zinc/33/05/42/483330542.db2.gz HXOFGMHHFJWLPP-UHFFFAOYSA-N 0 3 374.445 -1.048 20 0 FAADHN C[C@@H](O)CN1CCN(Cc2nc3c([nH]2)n(C)c(=O)n(C)c3=O)[C@H](C)C1 ZINC000192816653 482787040 /nfs/dbraw/zinc/78/70/40/482787040.db2.gz FRWLKBHFSNSCFD-GHMZBOCLSA-N 0 3 350.423 -1.153 20 0 FAADHN C[C@@H](O)CN1CCN(Cc2nc3c([nH]2)n(C)c(=O)n(C)c3=O)[C@@H](C)C1 ZINC000192816665 482786476 /nfs/dbraw/zinc/78/64/76/482786476.db2.gz FRWLKBHFSNSCFD-WDEREUQCSA-N 0 3 350.423 -1.153 20 0 FAADHN CN(C)CCN1CCN(C(=O)c2ccc3c(=O)n(C)c(=O)n(C)c3n2)CC1 ZINC000193082243 483530367 /nfs/dbraw/zinc/53/03/67/483530367.db2.gz VMXBVHFXHWJPQR-UHFFFAOYSA-N 0 3 374.445 -1.048 20 0 FAADHN O=C(Cn1cc(Br)c(=O)[n-]c1=O)NCCCN1CC[NH2+]CC1 ZINC000236641616 482918401 /nfs/dbraw/zinc/91/84/01/482918401.db2.gz XOTBNGPINYMNTK-UHFFFAOYSA-N 0 3 374.239 -1.289 20 0 FAADHN O=C(Cn1cc(Br)c(=O)[n-]c1=O)NCCN1CC[NH2+]CC1 ZINC000236641662 482917732 /nfs/dbraw/zinc/91/77/32/482917732.db2.gz JRVKWSAVLWGCML-UHFFFAOYSA-N 0 3 360.212 -1.680 20 0 FAADHN C[C@H](O)CN1CCN(CCn2cnc3c2c(=O)n(C)c(=O)n3C)C[C@H]1C ZINC000246957900 482693529 /nfs/dbraw/zinc/69/35/29/482693529.db2.gz BOZCRWAAJXURPN-OLZOCXBDSA-N 0 3 364.450 -1.179 20 0 FAADHN C[C@H](O)CN1CCN(CCn2cnc3c2c(=O)n(C)c(=O)n3C)C[C@@H]1C ZINC000246957919 482694031 /nfs/dbraw/zinc/69/40/31/482694031.db2.gz BOZCRWAAJXURPN-STQMWFEESA-N 0 3 364.450 -1.179 20 0 FAADHN C[C@H](O)CN1CCN(CCn2cnc3c2c(=O)n(C)c(=O)n3C)[C@H](C)C1 ZINC000249057373 482734416 /nfs/dbraw/zinc/73/44/16/482734416.db2.gz PBQNCURFJHCVLE-OLZOCXBDSA-N 0 3 364.450 -1.179 20 0 FAADHN C[C@H](O)CN1CCN(CCn2cnc3c2c(=O)n(C)c(=O)n3C)[C@@H](C)C1 ZINC000249057376 482735076 /nfs/dbraw/zinc/73/50/76/482735076.db2.gz PBQNCURFJHCVLE-STQMWFEESA-N 0 3 364.450 -1.179 20 0 FAADHN C[C@H](O)CN1CCN(Cc2nc3c([nH]2)n(C)c(=O)n(C)c3=O)[C@H](C)C1 ZINC000249219012 483609865 /nfs/dbraw/zinc/60/98/65/483609865.db2.gz FRWLKBHFSNSCFD-MNOVXSKESA-N 0 3 350.423 -1.153 20 0 FAADHN C[C@H](O)CN1CCN(Cc2nc3c([nH]2)n(C)c(=O)n(C)c3=O)[C@@H](C)C1 ZINC000249219014 483609770 /nfs/dbraw/zinc/60/97/70/483609770.db2.gz FRWLKBHFSNSCFD-QWRGUYRKSA-N 0 3 350.423 -1.153 20 0 FAADHN CS(=O)(=O)CCS(=O)(=O)[N-]C[C@@H](N1CC[NH2+]CC1)C(F)(F)F ZINC000261611123 657843016 /nfs/dbraw/zinc/84/30/16/657843016.db2.gz CBOAIMHPXXROQK-SECBINFHSA-N 0 3 367.415 -1.214 20 0 FAADHN CS(=O)(=O)CCS(=O)(=O)[N-]C[C@H](N1CC[NH2+]CC1)C(F)(F)F ZINC000261611131 272806077 /nfs/dbraw/zinc/80/60/77/272806077.db2.gz CBOAIMHPXXROQK-VIFPVBQESA-N 0 3 367.415 -1.214 20 0 FAADHN Cn1ccnc1[C@H]1CNCCN1CCn1cnc2c1c(=O)n(C)c(=O)n2C ZINC000261681443 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ZINC000265102847 482977424 /nfs/dbraw/zinc/97/74/24/482977424.db2.gz UCALLNGPESWUHJ-UHFFFAOYSA-N 0 3 360.436 -1.527 20 0 FAADHN CCN(CC)CC(=O)N1CCN(C(=O)NCCN2C(=O)CNC2=O)CC1 ZINC000265105603 482977808 /nfs/dbraw/zinc/97/78/08/482977808.db2.gz VIPGMBIBWUAMCK-UHFFFAOYSA-N 0 3 368.438 -1.266 20 0 FAADHN CN(C)C(=O)[C@H]1CCCN1CCCNC(=O)NCCN1C(=O)CNC1=O ZINC000265117082 482976435 /nfs/dbraw/zinc/97/64/35/482976435.db2.gz YIUBVPZOKQLQEU-GFCCVEGCSA-N 0 3 368.438 -1.220 20 0 FAADHN CN(C)C(=O)[C@@H]1CCCN1CCCNC(=O)NCCN1C(=O)CNC1=O ZINC000265117084 482977707 /nfs/dbraw/zinc/97/77/07/482977707.db2.gz YIUBVPZOKQLQEU-LBPRGKRZSA-N 0 3 368.438 -1.220 20 0 FAADHN CN(CCNC(=O)C(=O)Nc1cnc2c(c1)c(=O)n(C)c(=O)n2C)C1CC1 ZINC000265350255 482979201 /nfs/dbraw/zinc/97/92/01/482979201.db2.gz BEXLFCUTQKDXQY-UHFFFAOYSA-N 0 3 374.401 -1.219 20 0 FAADHN CN1C(=O)C(=O)N(CC(=O)N2CCN(CC3CCOCC3)CC2)C1=O ZINC000265454009 482979435 /nfs/dbraw/zinc/97/94/35/482979435.db2.gz PTOOUTLIPLYMLO-UHFFFAOYSA-N 0 3 352.391 -1.022 20 0 FAADHN CCN1CCCN(C(=O)CNS(=O)(=O)c2c[nH]c(C(N)=O)c2)CC1 ZINC000266088089 482981937 /nfs/dbraw/zinc/98/19/37/482981937.db2.gz CWZLLARLVQETJZ-UHFFFAOYSA-N 0 3 357.436 -1.054 20 0 FAADHN NC(=O)c1cc(S(=O)(=O)NCC(=O)NCCN2CCCCC2)c[nH]1 ZINC000266090515 482981582 /nfs/dbraw/zinc/98/15/82/482981582.db2.gz AREJLFPHTYCGBC-UHFFFAOYSA-N 0 3 357.436 -1.006 20 0 FAADHN CCN(CCNC(=O)CNS(=O)(=O)c1c[nH]c(C(N)=O)c1)C1CC1 ZINC000266146305 482980971 /nfs/dbraw/zinc/98/09/71/482980971.db2.gz MYOSWQKXMUFTQC-UHFFFAOYSA-N 0 3 357.436 -1.008 20 0 FAADHN COCCCN(C)CCNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C ZINC000266157816 482980905 /nfs/dbraw/zinc/98/09/05/482980905.db2.gz NJQZVANACQDPLT-UHFFFAOYSA-N 0 3 366.422 -1.482 20 0 FAADHN COCCCN(C)CCNC(=O)Cn1c(=O)c2c(ncn2C)n(C)c1=O ZINC000266175364 482982010 /nfs/dbraw/zinc/98/20/10/482982010.db2.gz VKSHBIJSXXBSLN-UHFFFAOYSA-N 0 3 366.422 -1.482 20 0 FAADHN CN1CCC(O)(CNC(=O)c2ccc3c(=O)n(C)c(=O)n(C)c3n2)CC1 ZINC000266704438 482982798 /nfs/dbraw/zinc/98/27/98/482982798.db2.gz HBRGGTKOYNZQCZ-UHFFFAOYSA-N 0 3 361.402 -1.181 20 0 FAADHN COC(=O)C[C@H]1C(=O)NCCN1C(=O)[C@@H]1CC(=O)N(CCN(C)C)C1 ZINC000266768976 482983011 /nfs/dbraw/zinc/98/30/11/482983011.db2.gz AFKGNAPITVLPPC-NEPJUHHUSA-N 0 3 354.407 -1.713 20 0 FAADHN COC(=O)C[C@@H]1C(=O)NCCN1C(=O)[C@H]1CC(=O)N(CCN(C)C)C1 ZINC000266768978 482982866 /nfs/dbraw/zinc/98/28/66/482982866.db2.gz AFKGNAPITVLPPC-NWDGAFQWSA-N 0 3 354.407 -1.713 20 0 FAADHN COC(=O)C[C@H]1C(=O)NCCN1C(=O)[C@H]1CC(=O)N(CCN(C)C)C1 ZINC000266768980 482983075 /nfs/dbraw/zinc/98/30/75/482983075.db2.gz AFKGNAPITVLPPC-RYUDHWBXSA-N 0 3 354.407 -1.713 20 0 FAADHN COC(=O)C[C@@H]1C(=O)NCCN1C(=O)[C@@H]1CC(=O)N(CCN(C)C)C1 ZINC000266768983 482983789 /nfs/dbraw/zinc/98/37/89/482983789.db2.gz AFKGNAPITVLPPC-VXGBXAGGSA-N 0 3 354.407 -1.713 20 0 FAADHN CCN1CCC[C@H]1CNC(=O)CNS(=O)(=O)c1c[nH]c(C(N)=O)c1 ZINC000266798434 482983598 /nfs/dbraw/zinc/98/35/98/482983598.db2.gz GKKZPQFRJGFTFS-JTQLQIEISA-N 0 3 357.436 -1.008 20 0 FAADHN CCN1CCC[C@@H]1CNC(=O)CNS(=O)(=O)c1c[nH]c(C(N)=O)c1 ZINC000266798437 482983204 /nfs/dbraw/zinc/98/32/04/482983204.db2.gz GKKZPQFRJGFTFS-SNVBAGLBSA-N 0 3 357.436 -1.008 20 0 FAADHN C[C@H](CNC(=O)CNS(=O)(=O)c1c[nH]c(C(N)=O)c1)N(C)C1CC1 ZINC000266867382 482984871 /nfs/dbraw/zinc/98/48/71/482984871.db2.gz WRCCYMFLJDNOFH-SECBINFHSA-N 0 3 357.436 -1.009 20 0 FAADHN C[C@@H](CNC(=O)CNS(=O)(=O)c1c[nH]c(C(N)=O)c1)N(C)C1CC1 ZINC000266867383 272810692 /nfs/dbraw/zinc/81/06/92/272810692.db2.gz WRCCYMFLJDNOFH-VIFPVBQESA-N 0 3 357.436 -1.009 20 0 FAADHN Cn1cnc(S(=O)(=O)[N-]CC(=O)NCC2([NH+](C)C)CCOCC2)c1 ZINC000268010882 482990012 /nfs/dbraw/zinc/99/00/12/482990012.db2.gz GPSFPTSBUCDCDP-UHFFFAOYSA-N 0 3 359.452 -1.075 20 0 FAADHN CCN1CCN(CCCNC(=O)CNS(=O)(=O)c2cn(C)cn2)CC1 ZINC000268034379 482990040 /nfs/dbraw/zinc/99/00/40/482990040.db2.gz NGFYJRQIDJUSND-UHFFFAOYSA-N 0 3 372.495 -1.158 20 0 FAADHN COCCN1CCC(NC(=O)CNS(=O)(=O)c2cn(C)cn2)CC1 ZINC000268043829 482989814 /nfs/dbraw/zinc/98/98/14/482989814.db2.gz REKNVLSATPNYSU-UHFFFAOYSA-N 0 3 359.452 -1.075 20 0 FAADHN CN(CCCN1CCN(C)CC1)C(=O)CNS(=O)(=O)c1cn(C)cn1 ZINC000268056828 482990787 /nfs/dbraw/zinc/99/07/87/482990787.db2.gz YOUHBNZPYOYYGZ-UHFFFAOYSA-N 0 3 372.495 -1.206 20 0 FAADHN Cn1cnc(S(=O)(=O)[N-]CC(=O)NCCN2CCC([NH+](C)C)CC2)c1 ZINC000268137705 482992911 /nfs/dbraw/zinc/99/29/11/482992911.db2.gz POUKIQFYLQBEDH-UHFFFAOYSA-N 0 3 372.495 -1.159 20 0 FAADHN CCN1CCN(CCNC(=O)CNS(=O)(=O)c2cn(C)cn2)CC1 ZINC000268142252 482993440 /nfs/dbraw/zinc/99/34/40/482993440.db2.gz QDWFBFAFPWQERL-UHFFFAOYSA-N 0 3 358.468 -1.548 20 0 FAADHN CN(C)C[C@@H]1CCCN1C(=O)CNS(=O)(=O)c1c[nH]c(C(N)=O)c1 ZINC000268181611 482992656 /nfs/dbraw/zinc/99/26/56/482992656.db2.gz RCSHEMCZGCUCMZ-JTQLQIEISA-N 0 3 357.436 -1.056 20 0 FAADHN CN(C)C[C@H]1CCCN1C(=O)CNS(=O)(=O)c1c[nH]c(C(N)=O)c1 ZINC000268181615 482993386 /nfs/dbraw/zinc/99/33/86/482993386.db2.gz RCSHEMCZGCUCMZ-SNVBAGLBSA-N 0 3 357.436 -1.056 20 0 FAADHN C[C@@H]1CN(C2CC2)C[C@H]1NC(=O)CNS(=O)(=O)c1c[nH]c(C(N)=O)c1 ZINC000268216095 482992815 /nfs/dbraw/zinc/99/28/15/482992815.db2.gz PMPOIUQXAUEFOM-NOZJJQNGSA-N 0 3 369.447 -1.009 20 0 FAADHN C[C@@H]1CN(C2CC2)C[C@@H]1NC(=O)CNS(=O)(=O)c1c[nH]c(C(N)=O)c1 ZINC000268216099 482992561 /nfs/dbraw/zinc/99/25/61/482992561.db2.gz PMPOIUQXAUEFOM-RNCFNFMXSA-N 0 3 369.447 -1.009 20 0 FAADHN C[C@H]1CN(C2CC2)C[C@H]1NC(=O)CNS(=O)(=O)c1c[nH]c(C(N)=O)c1 ZINC000268216103 482992232 /nfs/dbraw/zinc/99/22/32/482992232.db2.gz PMPOIUQXAUEFOM-TVQRCGJNSA-N 0 3 369.447 -1.009 20 0 FAADHN C[C@H]1CN(C2CC2)C[C@@H]1NC(=O)CNS(=O)(=O)c1c[nH]c(C(N)=O)c1 ZINC000268216107 482993566 /nfs/dbraw/zinc/99/35/66/482993566.db2.gz PMPOIUQXAUEFOM-ZANVPECISA-N 0 3 369.447 -1.009 20 0 FAADHN CN1CCC[C@@H]1C(=O)N1CCN(C(=O)CN2C(=O)C(=O)N(C)C2=O)CC1 ZINC000268902248 482997075 /nfs/dbraw/zinc/99/70/75/482997075.db2.gz GBIBLYVHIDVPJQ-LLVKDONJSA-N 0 3 365.390 -1.828 20 0 FAADHN CN1CCC[C@H]1C(=O)N1CCN(C(=O)CN2C(=O)C(=O)N(C)C2=O)CC1 ZINC000268902249 482996622 /nfs/dbraw/zinc/99/66/22/482996622.db2.gz GBIBLYVHIDVPJQ-NSHDSACASA-N 0 3 365.390 -1.828 20 0 FAADHN COC(=O)c1cn(CC(=O)N2CCN(C(=O)[C@H]3CCCN3C)CC2)nn1 ZINC000268905190 482997361 /nfs/dbraw/zinc/99/73/61/482997361.db2.gz GNIKLLCZIMSXAZ-CYBMUJFWSA-N 0 3 364.406 -1.170 20 0 FAADHN COC(=O)c1cn(CC(=O)N2CCN(C(=O)[C@@H]3CCCN3C)CC2)nn1 ZINC000268905193 482996808 /nfs/dbraw/zinc/99/68/08/482996808.db2.gz GNIKLLCZIMSXAZ-ZDUSSCGKSA-N 0 3 364.406 -1.170 20 0 FAADHN CN1CCC[C@@H]1C(=O)N1CCN(C(=O)NCCN2C(=O)CNC2=O)CC1 ZINC000268907120 482996524 /nfs/dbraw/zinc/99/65/24/482996524.db2.gz ZPZFCHZONODSRM-GFCCVEGCSA-N 0 3 366.422 -1.514 20 0 FAADHN CN1CCC[C@H]1C(=O)N1CCN(C(=O)NCCN2C(=O)CNC2=O)CC1 ZINC000268907124 482995965 /nfs/dbraw/zinc/99/59/65/482995965.db2.gz ZPZFCHZONODSRM-LBPRGKRZSA-N 0 3 366.422 -1.514 20 0 FAADHN CN1CCC[C@@H]1C(=O)N1CCN(C(=O)Cn2ccc(=O)n(C)c2=O)CC1 ZINC000268989223 482996270 /nfs/dbraw/zinc/99/62/70/482996270.db2.gz QZBGHTNUDOSWAK-CYBMUJFWSA-N 0 3 363.418 -1.688 20 0 FAADHN CN1CCC[C@H]1C(=O)N1CCN(C(=O)Cn2ccc(=O)n(C)c2=O)CC1 ZINC000268989226 482997126 /nfs/dbraw/zinc/99/71/26/482997126.db2.gz QZBGHTNUDOSWAK-ZDUSSCGKSA-N 0 3 363.418 -1.688 20 0 FAADHN CN1CCC[C@@H]1C(=O)N1CCN(C(=O)CN2CCC(=O)NC2=O)CC1 ZINC000269009368 483702476 /nfs/dbraw/zinc/70/24/76/483702476.db2.gz WYBVDAXHFNJMDZ-GFCCVEGCSA-N 0 3 351.407 -1.307 20 0 FAADHN CN1CCC[C@H]1C(=O)N1CCN(C(=O)CN2CCC(=O)NC2=O)CC1 ZINC000269009369 483702245 /nfs/dbraw/zinc/70/22/45/483702245.db2.gz WYBVDAXHFNJMDZ-LBPRGKRZSA-N 0 3 351.407 -1.307 20 0 FAADHN CN1C(=O)C(=O)N(CC(=O)NC[C@@H](O)CN2CCc3ccccc3C2)C1=O ZINC000269581515 483000478 /nfs/dbraw/zinc/00/04/78/483000478.db2.gz WILQEIQVRTZBPF-CQSZACIVSA-N 0 3 374.397 -1.058 20 0 FAADHN Cc1cc(C(=O)NC[C@](C)(O)CN(C)C)nc2c1c(=O)n(C)c(=O)n2C ZINC000269895495 483003686 /nfs/dbraw/zinc/00/36/86/483003686.db2.gz LKNSEWZJZYYHTB-KRWDZBQOSA-N 0 3 363.418 -1.017 20 0 FAADHN Cc1cc(C(=O)NC[C@@](C)(O)CN(C)C)nc2c1c(=O)n(C)c(=O)n2C ZINC000269895498 483004514 /nfs/dbraw/zinc/00/45/14/483004514.db2.gz LKNSEWZJZYYHTB-QGZVFWFLSA-N 0 3 363.418 -1.017 20 0 FAADHN CN(C)C[C@@](C)(O)CNC(=O)Cn1c(=O)c2c(ncn2C)n(C)c1=O ZINC000269919217 483003208 /nfs/dbraw/zinc/00/32/08/483003208.db2.gz PLEPDGPZAAZIBX-HNNXBMFYSA-N 0 3 352.395 -2.138 20 0 FAADHN CN(C)C[C@](C)(O)CNC(=O)Cn1c(=O)c2c(ncn2C)n(C)c1=O ZINC000269919220 483004781 /nfs/dbraw/zinc/00/47/81/483004781.db2.gz PLEPDGPZAAZIBX-OAHLLOKOSA-N 0 3 352.395 -2.138 20 0 FAADHN CC(=O)NCC(=O)NCC(=O)NCc1ccnc(OCCN(C)C)c1 ZINC000270648873 483005911 /nfs/dbraw/zinc/00/59/11/483005911.db2.gz OIPUFMJUOLNVJM-UHFFFAOYSA-N 0 3 351.407 -1.110 20 0 FAADHN CC(C)NC(=O)C(=O)N1CCN(C(=O)CNC(=O)[C@@H](N)C(C)C)CC1 ZINC000271095683 483008179 /nfs/dbraw/zinc/00/81/79/483008179.db2.gz LHFSZYJLYZDCLN-ZDUSSCGKSA-N 0 3 355.439 -1.719 20 0 FAADHN CC(C)[C@H](N)C(=O)NCC(=O)NCCCn1nc2n(c1=O)CCCC2 ZINC000271119110 483008206 /nfs/dbraw/zinc/00/82/06/483008206.db2.gz GSLYBJZBXCURDK-AWEZNQCLSA-N 0 3 352.439 -1.013 20 0 FAADHN 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NCCN(CCO)C(=O)C(=O)N[C@@H](CN1CCOCC1)c1ccccc1 ZINC000419004562 483289234 /nfs/dbraw/zinc/28/92/34/483289234.db2.gz FMIPSNRGXMJFQM-INIZCTEOSA-N 0 3 364.446 -1.044 20 0 FAADHN NCCN(CCO)C(=O)C(=O)N[C@H](CN1CCOCC1)c1ccccc1 ZINC000419004571 483289416 /nfs/dbraw/zinc/28/94/16/483289416.db2.gz FMIPSNRGXMJFQM-MRXNPFEDSA-N 0 3 364.446 -1.044 20 0 FAADHN COCCNCCNC(=O)C(=O)NCCN1C(=O)c2ccccc2C1=O ZINC000419013014 483289027 /nfs/dbraw/zinc/28/90/27/483289027.db2.gz AKYNKXSSWMBVLD-UHFFFAOYSA-N 0 3 362.386 -1.249 20 0 FAADHN NCCN(CCO)C(=O)C(=O)N[C@@H]1CCN(c2ccccc2F)C1=O ZINC000419028819 483289822 /nfs/dbraw/zinc/28/98/22/483289822.db2.gz FLZPIFHXMWLEPE-GFCCVEGCSA-N 0 3 352.366 -1.173 20 0 FAADHN NCCN(CCO)C(=O)C(=O)N[C@H]1CCN(c2ccccc2F)C1=O ZINC000419028822 483289072 /nfs/dbraw/zinc/28/90/72/483289072.db2.gz FLZPIFHXMWLEPE-LBPRGKRZSA-N 0 3 352.366 -1.173 20 0 FAADHN Cc1ccc(CN2CC[C@H](NC(=O)C(=O)N(CCN)CCO)C2=O)cc1 ZINC000419048117 483289008 /nfs/dbraw/zinc/28/90/08/483289008.db2.gz ARWXACXMSDFFFU-HNNXBMFYSA-N 0 3 362.430 -1.008 20 0 FAADHN Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)N(CCN)CCO)C2=O)cc1 ZINC000419048118 272853876 /nfs/dbraw/zinc/85/38/76/272853876.db2.gz ARWXACXMSDFFFU-OAHLLOKOSA-N 0 3 362.430 -1.008 20 0 FAADHN NCCN(CCO)C(=O)C(=O)N[C@@H]1CCN(c2c(F)cccc2F)C1=O ZINC000419049052 272853583 /nfs/dbraw/zinc/85/35/83/272853583.db2.gz BYYZXKDXNFDFHQ-GFCCVEGCSA-N 0 3 370.356 -1.034 20 0 FAADHN NCCN(CCO)C(=O)C(=O)N[C@H]1CCN(c2c(F)cccc2F)C1=O ZINC000419049057 483289598 /nfs/dbraw/zinc/28/95/98/483289598.db2.gz BYYZXKDXNFDFHQ-LBPRGKRZSA-N 0 3 370.356 -1.034 20 0 FAADHN NCCN(CCO)C(=O)C(=O)N[C@@H]1CCN(c2ccc(F)cc2)C1=O ZINC000419056006 483289519 /nfs/dbraw/zinc/28/95/19/483289519.db2.gz KMJFJXKLWJCGKX-CYBMUJFWSA-N 0 3 352.366 -1.173 20 0 FAADHN NCCN(CCO)C(=O)C(=O)N[C@H]1CCN(c2ccc(F)cc2)C1=O ZINC000419056008 483289533 /nfs/dbraw/zinc/28/95/33/483289533.db2.gz KMJFJXKLWJCGKX-ZDUSSCGKSA-N 0 3 352.366 -1.173 20 0 FAADHN COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N(CCN)CCO)C1=O ZINC000419071155 483288920 /nfs/dbraw/zinc/28/89/20/483288920.db2.gz WIVFKODNHQBSSR-GFCCVEGCSA-N 0 3 364.402 -1.304 20 0 FAADHN COc1ccccc1N1CC[C@H](NC(=O)C(=O)N(CCN)CCO)C1=O ZINC000419071160 483289390 /nfs/dbraw/zinc/28/93/90/483289390.db2.gz WIVFKODNHQBSSR-LBPRGKRZSA-N 0 3 364.402 -1.304 20 0 FAADHN CN(CCNC(=O)C(=O)N1CCC[C@H](C(=O)N2CCNCC2)C1)C1CC1 ZINC000419082903 483288751 /nfs/dbraw/zinc/28/87/51/483288751.db2.gz BERSUCGAXWFAPT-AWEZNQCLSA-N 0 3 365.478 -1.133 20 0 FAADHN CN(CCNC(=O)C(=O)N1CCC[C@@H](C(=O)N2CCNCC2)C1)C1CC1 ZINC000419082905 483289703 /nfs/dbraw/zinc/28/97/03/483289703.db2.gz BERSUCGAXWFAPT-CQSZACIVSA-N 0 3 365.478 -1.133 20 0 FAADHN CCc1cc(N2CCC[C@H](NC(=O)C(=O)N(CCN)CCO)C2)ncn1 ZINC000419094965 483288768 /nfs/dbraw/zinc/28/87/68/483288768.db2.gz KGJSGURZOVFZMA-AWEZNQCLSA-N 0 3 364.450 -1.096 20 0 FAADHN CCc1cc(N2CCC[C@@H](NC(=O)C(=O)N(CCN)CCO)C2)ncn1 ZINC000419094967 483288713 /nfs/dbraw/zinc/28/87/13/483288713.db2.gz KGJSGURZOVFZMA-CQSZACIVSA-N 0 3 364.450 -1.096 20 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CC(C)NS(=O)(=O)CCNC(=O)C(=O)NC[C@H]1NC(C)(C)O[C@@H]1C ZINC000419298925 483291248 /nfs/dbraw/zinc/29/12/48/483291248.db2.gz JAXXZGKEMDIETQ-GHMZBOCLSA-N 0 3 364.468 -1.340 20 0 FAADHN CC(C)NS(=O)(=O)CCNC(=O)C(=O)NC[C@@H]1NC(C)(C)O[C@@H]1C ZINC000419298926 483290307 /nfs/dbraw/zinc/29/03/07/483290307.db2.gz JAXXZGKEMDIETQ-MNOVXSKESA-N 0 3 364.468 -1.340 20 0 FAADHN CC(C)NS(=O)(=O)CCNC(=O)C(=O)NC[C@@H]1NC(C)(C)O[C@H]1C ZINC000419298927 483290540 /nfs/dbraw/zinc/29/05/40/483290540.db2.gz JAXXZGKEMDIETQ-QWRGUYRKSA-N 0 3 364.468 -1.340 20 0 FAADHN CC(C)NS(=O)(=O)CCNC(=O)C(=O)NC[C@H]1NC(C)(C)O[C@H]1C ZINC000419298928 272854174 /nfs/dbraw/zinc/85/41/74/272854174.db2.gz JAXXZGKEMDIETQ-WDEREUQCSA-N 0 3 364.468 -1.340 20 0 FAADHN C[C@@H]1CN(Cc2nc3c([nH]2)n(C)c(=O)n(C)c3=O)[C@H](C)CN1CCO ZINC000419335158 483290780 /nfs/dbraw/zinc/29/07/80/483290780.db2.gz JMUWCFAXINJBPH-GHMZBOCLSA-N 0 3 350.423 -1.153 20 0 FAADHN C[C@@H]1CN(Cc2nc3c([nH]2)n(C)c(=O)n(C)c3=O)[C@@H](C)CN1CCO ZINC000419335167 483290199 /nfs/dbraw/zinc/29/01/99/483290199.db2.gz JMUWCFAXINJBPH-MNOVXSKESA-N 0 3 350.423 -1.153 20 0 FAADHN C[C@H]1CN(Cc2nc3c([nH]2)n(C)c(=O)n(C)c3=O)[C@@H](C)CN1CCO ZINC000419335170 483290234 /nfs/dbraw/zinc/29/02/34/483290234.db2.gz JMUWCFAXINJBPH-QWRGUYRKSA-N 0 3 350.423 -1.153 20 0 FAADHN C[C@@H]1CN(CCO)[C@@H](C)CN1Cc1nc2c([nH]1)n(C)c(=O)n(C)c2=O ZINC000419335171 483291109 /nfs/dbraw/zinc/29/11/09/483291109.db2.gz JMUWCFAXINJBPH-WDEREUQCSA-N 0 3 350.423 -1.153 20 0 FAADHN COCCN(C)CCNC(=O)C(=O)N1CCC[C@H](N2CCNCC2=O)C1 ZINC000419349609 483290873 /nfs/dbraw/zinc/29/08/73/483290873.db2.gz DLJXSBWFXZSXOA-AWEZNQCLSA-N 0 3 369.466 -1.896 20 0 FAADHN COCCN(C)CCNC(=O)C(=O)N1CCC[C@@H](N2CCNCC2=O)C1 ZINC000419349611 483291221 /nfs/dbraw/zinc/29/12/21/483291221.db2.gz DLJXSBWFXZSXOA-CQSZACIVSA-N 0 3 369.466 -1.896 20 0 FAADHN C[C@H]1CCCN(C(=O)C(=O)NCCC(=O)N2CCN(C)CC2)[C@H]1CN ZINC000419367302 483290761 /nfs/dbraw/zinc/29/07/61/483290761.db2.gz DANAEECUWWWCRM-KBPBESRZSA-N 0 3 353.467 -1.148 20 0 FAADHN C[C@@H]1CCCN(C(=O)C(=O)NCCC(=O)N2CCN(C)CC2)[C@H]1CN ZINC000419367312 483290067 /nfs/dbraw/zinc/29/00/67/483290067.db2.gz DANAEECUWWWCRM-KGLIPLIRSA-N 0 3 353.467 -1.148 20 0 FAADHN C[C@H]1CCCN(C(=O)C(=O)NCCC(=O)N2CCN(C)CC2)[C@@H]1CN ZINC000419367316 483291062 /nfs/dbraw/zinc/29/10/62/483291062.db2.gz DANAEECUWWWCRM-UONOGXRCSA-N 0 3 353.467 -1.148 20 0 FAADHN C[C@@H]1CCCN(C(=O)C(=O)NCCC(=O)N2CCN(C)CC2)[C@@H]1CN ZINC000419367317 483290788 /nfs/dbraw/zinc/29/07/88/483290788.db2.gz DANAEECUWWWCRM-ZIAGYGMSSA-N 0 3 353.467 -1.148 20 0 FAADHN C[C@H]1OC(C)(C)N[C@@H]1CNC(=O)C(=O)NCCC(=O)N1CCN(C)CC1 ZINC000419369520 483291731 /nfs/dbraw/zinc/29/17/31/483291731.db2.gz HURSAJOHNRUQHX-CHWSQXEVSA-N 0 3 369.466 -1.504 20 0 FAADHN C[C@H]1OC(C)(C)N[C@H]1CNC(=O)C(=O)NCCC(=O)N1CCN(C)CC1 ZINC000419369525 483292225 /nfs/dbraw/zinc/29/22/25/483292225.db2.gz HURSAJOHNRUQHX-OLZOCXBDSA-N 0 3 369.466 -1.504 20 0 FAADHN C[C@@H]1OC(C)(C)N[C@@H]1CNC(=O)C(=O)NCCC(=O)N1CCN(C)CC1 ZINC000419369526 272854725 /nfs/dbraw/zinc/85/47/25/272854725.db2.gz HURSAJOHNRUQHX-QWHCGFSZSA-N 0 3 369.466 -1.504 20 0 FAADHN C[C@@H]1OC(C)(C)N[C@H]1CNC(=O)C(=O)NCCC(=O)N1CCN(C)CC1 ZINC000419369527 483292518 /nfs/dbraw/zinc/29/25/18/483292518.db2.gz HURSAJOHNRUQHX-STQMWFEESA-N 0 3 369.466 -1.504 20 0 FAADHN CN1CCN(C(=O)CCNC(=O)C(=O)N[C@@H](CN)C2CCCC2)CC1 ZINC000419378517 483292206 /nfs/dbraw/zinc/29/22/06/483292206.db2.gz VSRCGMDRSMERRN-AWEZNQCLSA-N 0 3 353.467 -1.100 20 0 FAADHN CN1CCN(C(=O)CCNC(=O)C(=O)N[C@H](CN)C2CCCC2)CC1 ZINC000419378518 483291675 /nfs/dbraw/zinc/29/16/75/483291675.db2.gz VSRCGMDRSMERRN-CQSZACIVSA-N 0 3 353.467 -1.100 20 0 FAADHN [NH3+]CCNC(=O)C(=O)NCC[N-]S(=O)(=O)c1ccc(Cl)s1 ZINC000419490081 483291713 /nfs/dbraw/zinc/29/17/13/483291713.db2.gz JBWFQXOCCJWQSM-UHFFFAOYSA-N 0 3 354.841 -1.129 20 0 FAADHN NC[C@H]1CCCCN1C(=O)C(=O)NCCNS(=O)(=O)c1cccnc1 ZINC000419490731 483292092 /nfs/dbraw/zinc/29/20/92/483292092.db2.gz FRFCEMVVQDQZET-GFCCVEGCSA-N 0 3 369.447 -1.184 20 0 FAADHN NC[C@@H]1CCCCN1C(=O)C(=O)NCCNS(=O)(=O)c1cccnc1 ZINC000419490732 483291878 /nfs/dbraw/zinc/29/18/78/483291878.db2.gz FRFCEMVVQDQZET-LBPRGKRZSA-N 0 3 369.447 -1.184 20 0 FAADHN NCCN(CCO)C(=O)C(=O)NC[C@@H](c1ccccc1)N1CCOCC1 ZINC000419498671 483292543 /nfs/dbraw/zinc/29/25/43/483292543.db2.gz ZPNLEKWDTYOOSS-INIZCTEOSA-N 0 3 364.446 -1.044 20 0 FAADHN NCCN(CCO)C(=O)C(=O)NC[C@H](c1ccccc1)N1CCOCC1 ZINC000419498672 483291964 /nfs/dbraw/zinc/29/19/64/483291964.db2.gz ZPNLEKWDTYOOSS-MRXNPFEDSA-N 0 3 364.446 -1.044 20 0 FAADHN O=C(NCC[N-]S(=O)(=O)c1cccs1)C(=O)N1CC[C@@H]2C[NH2+]C[C@@H]21 ZINC000419500964 483292083 /nfs/dbraw/zinc/29/20/83/483292083.db2.gz QYYHWYPRCBAINM-MNOVXSKESA-N 0 3 372.472 -1.037 20 0 FAADHN CC(C)C[C@H](CN)NC(=O)C(=O)NCCNS(=O)(=O)c1cccnc1 ZINC000419501673 483292140 /nfs/dbraw/zinc/29/21/40/483292140.db2.gz RMHUEZZSPBWCPF-GFCCVEGCSA-N 0 3 371.463 -1.034 20 0 FAADHN CC(C)C[C@@H](CN)NC(=O)C(=O)NCCNS(=O)(=O)c1cccnc1 ZINC000419501674 483292187 /nfs/dbraw/zinc/29/21/87/483292187.db2.gz RMHUEZZSPBWCPF-LBPRGKRZSA-N 0 3 371.463 -1.034 20 0 FAADHN C[C@@H]1CN(C(=O)C(=O)NCC[N-]S(=O)(=O)c2cccs2)C[C@H]1[NH3+] ZINC000419507978 483291794 /nfs/dbraw/zinc/29/17/94/483291794.db2.gz ZIIIKBNNMPGPKW-NXEZZACHSA-N 0 3 360.461 -1.052 20 0 FAADHN C[C@H]1CN(C(=O)C(=O)NCC[N-]S(=O)(=O)c2cccs2)C[C@@H]1[NH3+] ZINC000419508339 483292301 /nfs/dbraw/zinc/29/23/01/483292301.db2.gz ZIIIKBNNMPGPKW-UWVGGRQHSA-N 0 3 360.461 -1.052 20 0 FAADHN C[C@H]1CN(C(=O)C(=O)NCC[N-]S(=O)(=O)c2cccs2)C[C@H]1[NH3+] ZINC000419508340 483292237 /nfs/dbraw/zinc/29/22/37/483292237.db2.gz ZIIIKBNNMPGPKW-VHSXEESVSA-N 0 3 360.461 -1.052 20 0 FAADHN C[C@@H]1CN(C(=O)C(=O)NCC[N-]S(=O)(=O)c2cccs2)C[C@@H]1[NH3+] ZINC000419508341 483291912 /nfs/dbraw/zinc/29/19/12/483291912.db2.gz ZIIIKBNNMPGPKW-ZJUUUORDSA-N 0 3 360.461 -1.052 20 0 FAADHN CCS(=O)(=O)NCCNC(=O)C(=O)NC[C@H]1NC(C)(C)O[C@@H]1C ZINC000419511306 272854801 /nfs/dbraw/zinc/85/48/01/272854801.db2.gz IHWDLSRXDNIODD-NXEZZACHSA-N 0 3 350.441 -1.729 20 0 FAADHN CCS(=O)(=O)NCCNC(=O)C(=O)NC[C@@H]1NC(C)(C)O[C@H]1C ZINC000419511307 272854501 /nfs/dbraw/zinc/85/45/01/272854501.db2.gz IHWDLSRXDNIODD-UWVGGRQHSA-N 0 3 350.441 -1.729 20 0 FAADHN CCS(=O)(=O)NCCNC(=O)C(=O)NC[C@H]1NC(C)(C)O[C@H]1C ZINC000419511308 483291935 /nfs/dbraw/zinc/29/19/35/483291935.db2.gz IHWDLSRXDNIODD-VHSXEESVSA-N 0 3 350.441 -1.729 20 0 FAADHN CCS(=O)(=O)NCCNC(=O)C(=O)NC[C@@H]1NC(C)(C)O[C@@H]1C ZINC000419511621 483292575 /nfs/dbraw/zinc/29/25/75/483292575.db2.gz IHWDLSRXDNIODD-ZJUUUORDSA-N 0 3 350.441 -1.729 20 0 FAADHN C[C@H]1CNCCN1C(=O)C(=O)NCCCN1CCC[C@H]1C(=O)N(C)C ZINC000419521811 483291780 /nfs/dbraw/zinc/29/17/80/483291780.db2.gz KTNNVPCTCTVXPS-KBPBESRZSA-N 0 3 353.467 -1.134 20 0 FAADHN C[C@@H]1CNCCN1C(=O)C(=O)NCCCN1CCC[C@H]1C(=O)N(C)C ZINC000419521812 483291897 /nfs/dbraw/zinc/29/18/97/483291897.db2.gz KTNNVPCTCTVXPS-KGLIPLIRSA-N 0 3 353.467 -1.134 20 0 FAADHN C[C@H]1CNCCN1C(=O)C(=O)NCCCN1CCC[C@@H]1C(=O)N(C)C ZINC000419521813 483291763 /nfs/dbraw/zinc/29/17/63/483291763.db2.gz KTNNVPCTCTVXPS-UONOGXRCSA-N 0 3 353.467 -1.134 20 0 FAADHN C[C@@H]1CNCCN1C(=O)C(=O)NCCCN1CCC[C@@H]1C(=O)N(C)C ZINC000419521814 483291704 /nfs/dbraw/zinc/29/17/04/483291704.db2.gz KTNNVPCTCTVXPS-ZIAGYGMSSA-N 0 3 353.467 -1.134 20 0 FAADHN C[C@H]1CN(C(=O)C(=O)NCCCN2CCC[C@H]2C(=O)N(C)C)CCN1 ZINC000419530296 483292692 /nfs/dbraw/zinc/29/26/92/483292692.db2.gz YUXAASUSSKCVEJ-KBPBESRZSA-N 0 3 353.467 -1.134 20 0 FAADHN C[C@@H]1CN(C(=O)C(=O)NCCCN2CCC[C@H]2C(=O)N(C)C)CCN1 ZINC000419530297 483292035 /nfs/dbraw/zinc/29/20/35/483292035.db2.gz YUXAASUSSKCVEJ-KGLIPLIRSA-N 0 3 353.467 -1.134 20 0 FAADHN C[C@H]1CN(C(=O)C(=O)NCCCN2CCC[C@@H]2C(=O)N(C)C)CCN1 ZINC000419530298 483292729 /nfs/dbraw/zinc/29/27/29/483292729.db2.gz YUXAASUSSKCVEJ-UONOGXRCSA-N 0 3 353.467 -1.134 20 0 FAADHN C[C@@H]1CN(C(=O)C(=O)NCCCN2CCC[C@@H]2C(=O)N(C)C)CCN1 ZINC000419530299 483292621 /nfs/dbraw/zinc/29/26/21/483292621.db2.gz YUXAASUSSKCVEJ-ZIAGYGMSSA-N 0 3 353.467 -1.134 20 0 FAADHN COC(=O)CCN1CC[C@H](NC(=O)C(=O)N2CCCC[C@@H]2CN)C1=O ZINC000419566077 483293526 /nfs/dbraw/zinc/29/35/26/483293526.db2.gz ORQOPSKLCHJIAO-NEPJUHHUSA-N 0 3 354.407 -1.394 20 0 FAADHN COC(=O)CCN1CC[C@@H](NC(=O)C(=O)N2CCCC[C@H]2CN)C1=O ZINC000419566078 483293345 /nfs/dbraw/zinc/29/33/45/483293345.db2.gz ORQOPSKLCHJIAO-NWDGAFQWSA-N 0 3 354.407 -1.394 20 0 FAADHN COC(=O)CCN1CC[C@H](NC(=O)C(=O)N2CCCC[C@H]2CN)C1=O ZINC000419566079 483293756 /nfs/dbraw/zinc/29/37/56/483293756.db2.gz ORQOPSKLCHJIAO-RYUDHWBXSA-N 0 3 354.407 -1.394 20 0 FAADHN COC(=O)CCN1CC[C@@H](NC(=O)C(=O)N2CCCC[C@@H]2CN)C1=O ZINC000419566080 483293581 /nfs/dbraw/zinc/29/35/81/483293581.db2.gz ORQOPSKLCHJIAO-VXGBXAGGSA-N 0 3 354.407 -1.394 20 0 FAADHN COC(=O)CCN1CC[C@H](NC(=O)C(=O)N[C@@H](CN)CC(C)C)C1=O ZINC000419568114 483293610 /nfs/dbraw/zinc/29/36/10/483293610.db2.gz RPAVKPYORDXLGM-NEPJUHHUSA-N 0 3 356.423 -1.244 20 0 FAADHN COC(=O)CCN1CC[C@@H](NC(=O)C(=O)N[C@H](CN)CC(C)C)C1=O ZINC000419568115 483293237 /nfs/dbraw/zinc/29/32/37/483293237.db2.gz RPAVKPYORDXLGM-NWDGAFQWSA-N 0 3 356.423 -1.244 20 0 FAADHN COC(=O)CCN1CC[C@H](NC(=O)C(=O)N[C@H](CN)CC(C)C)C1=O ZINC000419568116 483293145 /nfs/dbraw/zinc/29/31/45/483293145.db2.gz RPAVKPYORDXLGM-RYUDHWBXSA-N 0 3 356.423 -1.244 20 0 FAADHN COC(=O)CCN1CC[C@@H](NC(=O)C(=O)N[C@@H](CN)CC(C)C)C1=O ZINC000419568117 483293831 /nfs/dbraw/zinc/29/38/31/483293831.db2.gz RPAVKPYORDXLGM-VXGBXAGGSA-N 0 3 356.423 -1.244 20 0 FAADHN COC(=O)CCN1CC[C@H](NC(=O)C(=O)N2CCC[C@@H](C)[C@@H]2CN)C1=O ZINC000419570101 483293921 /nfs/dbraw/zinc/29/39/21/483293921.db2.gz URBFMBMLDHGNPI-AGIUHOORSA-N 0 3 368.434 -1.148 20 0 FAADHN COC(=O)CCN1CC[C@H](NC(=O)C(=O)N2CCC[C@H](C)[C@@H]2CN)C1=O ZINC000419570102 483293293 /nfs/dbraw/zinc/29/32/93/483293293.db2.gz URBFMBMLDHGNPI-AVGNSLFASA-N 0 3 368.434 -1.148 20 0 FAADHN COC(=O)CCN1CC[C@H](NC(=O)C(=O)N2CCC[C@@H](C)[C@H]2CN)C1=O ZINC000419570103 272855241 /nfs/dbraw/zinc/85/52/41/272855241.db2.gz URBFMBMLDHGNPI-FRRDWIJNSA-N 0 3 368.434 -1.148 20 0 FAADHN COC(=O)CCN1CC[C@H](NC(=O)C(=O)N2CCC[C@H](C)[C@H]2CN)C1=O ZINC000419570104 272855233 /nfs/dbraw/zinc/85/52/33/272855233.db2.gz URBFMBMLDHGNPI-RWMBFGLXSA-N 0 3 368.434 -1.148 20 0 FAADHN COC(=O)CCN1CC[C@@H](NC(=O)C(=O)N[C@H](CN)C2CCCC2)C1=O ZINC000419573825 483293548 /nfs/dbraw/zinc/29/35/48/483293548.db2.gz YTLHGYKFRDMBOO-CHWSQXEVSA-N 0 3 368.434 -1.100 20 0 FAADHN COC(=O)CCN1CC[C@@H](NC(=O)C(=O)N[C@@H](CN)C2CCCC2)C1=O ZINC000419573827 483293852 /nfs/dbraw/zinc/29/38/52/483293852.db2.gz YTLHGYKFRDMBOO-OLZOCXBDSA-N 0 3 368.434 -1.100 20 0 FAADHN COC(=O)CCN1CC[C@H](NC(=O)C(=O)N[C@H](CN)C2CCCC2)C1=O ZINC000419573828 483293688 /nfs/dbraw/zinc/29/36/88/483293688.db2.gz YTLHGYKFRDMBOO-QWHCGFSZSA-N 0 3 368.434 -1.100 20 0 FAADHN COC(=O)CCN1CC[C@H](NC(=O)C(=O)N[C@@H](CN)C2CCCC2)C1=O ZINC000419573830 483293725 /nfs/dbraw/zinc/29/37/25/483293725.db2.gz YTLHGYKFRDMBOO-STQMWFEESA-N 0 3 368.434 -1.100 20 0 FAADHN NCCN(CCO)C(=O)C(=O)N[C@H]1CC(=O)N(c2c(F)cccc2F)C1 ZINC000419638763 483293544 /nfs/dbraw/zinc/29/35/44/483293544.db2.gz UCLPYYAADCHMDE-JTQLQIEISA-N 0 3 370.356 -1.034 20 0 FAADHN NCCN(CCO)C(=O)C(=O)N[C@@H]1CC(=O)N(c2c(F)cccc2F)C1 ZINC000419638765 483293112 /nfs/dbraw/zinc/29/31/12/483293112.db2.gz UCLPYYAADCHMDE-SNVBAGLBSA-N 0 3 370.356 -1.034 20 0 FAADHN C[C@@H]1OC(C)(C)N[C@@H]1CNC(=O)C(=O)NCCNC(=O)c1ccn[nH]1 ZINC000419646714 483293620 /nfs/dbraw/zinc/29/36/20/483293620.db2.gz NRLOUWWMVSFEKC-GXSJLCMTSA-N 0 3 352.395 -1.515 20 0 FAADHN C[C@H]1OC(C)(C)N[C@H]1CNC(=O)C(=O)NCCNC(=O)c1ccn[nH]1 ZINC000419646715 483293428 /nfs/dbraw/zinc/29/34/28/483293428.db2.gz NRLOUWWMVSFEKC-KOLCDFICSA-N 0 3 352.395 -1.515 20 0 FAADHN C[C@H]1OC(C)(C)N[C@@H]1CNC(=O)C(=O)NCCNC(=O)c1ccn[nH]1 ZINC000419646719 483293530 /nfs/dbraw/zinc/29/35/30/483293530.db2.gz NRLOUWWMVSFEKC-MWLCHTKSSA-N 0 3 352.395 -1.515 20 0 FAADHN C[C@@H]1OC(C)(C)N[C@H]1CNC(=O)C(=O)NCCNC(=O)c1ccn[nH]1 ZINC000419646721 483293535 /nfs/dbraw/zinc/29/35/35/483293535.db2.gz NRLOUWWMVSFEKC-ONGXEEELSA-N 0 3 352.395 -1.515 20 0 FAADHN CCS(=O)(=O)N1CC(CNC(=O)C(=O)N2CCC[C@H](C)[C@@H]2CN)C1 ZINC000419723328 483293473 /nfs/dbraw/zinc/29/34/73/483293473.db2.gz CREJLBKIBRCYRP-AAEUAGOBSA-N 0 3 360.480 -1.030 20 0 FAADHN CCS(=O)(=O)N1CC(CNC(=O)C(=O)N2CCC[C@@H](C)[C@H]2CN)C1 ZINC000419723329 483293822 /nfs/dbraw/zinc/29/38/22/483293822.db2.gz CREJLBKIBRCYRP-DGCLKSJQSA-N 0 3 360.480 -1.030 20 0 FAADHN CCS(=O)(=O)N1CC(CNC(=O)C(=O)N2CCC[C@H](C)[C@H]2CN)C1 ZINC000419723332 483293806 /nfs/dbraw/zinc/29/38/06/483293806.db2.gz CREJLBKIBRCYRP-WCQYABFASA-N 0 3 360.480 -1.030 20 0 FAADHN CCS(=O)(=O)N1CC(CNC(=O)C(=O)N2CCC[C@@H](C)[C@@H]2CN)C1 ZINC000419723333 483293945 /nfs/dbraw/zinc/29/39/45/483293945.db2.gz CREJLBKIBRCYRP-YPMHNXCESA-N 0 3 360.480 -1.030 20 0 FAADHN CCN(CC)CCNC(=O)C(=O)N1CCC[C@H](N2CCNCC2=O)C1 ZINC000419739203 483293636 /nfs/dbraw/zinc/29/36/36/483293636.db2.gz VUKJIKWIULKUEO-AWEZNQCLSA-N 0 3 353.467 -1.133 20 0 FAADHN CCN(CC)CCNC(=O)C(=O)N1CCC[C@@H](N2CCNCC2=O)C1 ZINC000419739206 483293899 /nfs/dbraw/zinc/29/38/99/483293899.db2.gz VUKJIKWIULKUEO-CQSZACIVSA-N 0 3 353.467 -1.133 20 0 FAADHN NCCNC(=O)C(=O)NCCN1CCN(C(=O)C2CCCCC2)CC1 ZINC000419741224 483293085 /nfs/dbraw/zinc/29/30/85/483293085.db2.gz IECQJDOLGKFHCV-UHFFFAOYSA-N 0 3 353.467 -1.098 20 0 FAADHN CC[C@H](NC(=O)C(=O)NC[C@@H]1NC(C)(C)O[C@@H]1C)C(=O)N1CCOCC1 ZINC000419764943 483293702 /nfs/dbraw/zinc/29/37/02/483293702.db2.gz PYMFKQGAHGAEAS-AGIUHOORSA-N 0 3 370.450 -1.031 20 0 FAADHN CC[C@H](NC(=O)C(=O)NC[C@@H]1NC(C)(C)O[C@H]1C)C(=O)N1CCOCC1 ZINC000419764947 483293388 /nfs/dbraw/zinc/29/33/88/483293388.db2.gz PYMFKQGAHGAEAS-AVGNSLFASA-N 0 3 370.450 -1.031 20 0 FAADHN CC[C@H](NC(=O)C(=O)NC[C@H]1NC(C)(C)O[C@@H]1C)C(=O)N1CCOCC1 ZINC000419764950 483293517 /nfs/dbraw/zinc/29/35/17/483293517.db2.gz PYMFKQGAHGAEAS-FRRDWIJNSA-N 0 3 370.450 -1.031 20 0 FAADHN CC[C@H](NC(=O)C(=O)NC[C@H]1NC(C)(C)O[C@H]1C)C(=O)N1CCOCC1 ZINC000419765093 483293479 /nfs/dbraw/zinc/29/34/79/483293479.db2.gz PYMFKQGAHGAEAS-RWMBFGLXSA-N 0 3 370.450 -1.031 20 0 FAADHN CCCC[C@H](CN)NC(=O)C(=O)NCCNS(=O)(=O)NC(C)C ZINC000419768375 483294310 /nfs/dbraw/zinc/29/43/10/483294310.db2.gz FQQWYRTXDSRNLP-LLVKDONJSA-N 0 3 351.473 -1.431 20 0 FAADHN CCCC[C@@H](CN)NC(=O)C(=O)NCCNS(=O)(=O)NC(C)C ZINC000419768384 483294873 /nfs/dbraw/zinc/29/48/73/483294873.db2.gz FQQWYRTXDSRNLP-NSHDSACASA-N 0 3 351.473 -1.431 20 0 FAADHN CC(C)NS(=O)(=O)NCCNC(=O)C(=O)NC[C@@H](N)c1ccccc1 ZINC000419770166 483294601 /nfs/dbraw/zinc/29/46/01/483294601.db2.gz GZPFWLKADQAIMQ-CYBMUJFWSA-N 0 3 371.463 -1.249 20 0 FAADHN CC(C)NS(=O)(=O)NCCNC(=O)C(=O)NC[C@H](N)c1ccccc1 ZINC000419770172 483294545 /nfs/dbraw/zinc/29/45/45/483294545.db2.gz GZPFWLKADQAIMQ-ZDUSSCGKSA-N 0 3 371.463 -1.249 20 0 FAADHN CC(C)NS(=O)(=O)NCCNC(=O)C(=O)N1CCC[C@@H](C)[C@@H]1CN ZINC000419773968 483294922 /nfs/dbraw/zinc/29/49/22/483294922.db2.gz JCRMAYFSXRRBLQ-NEPJUHHUSA-N 0 3 363.484 -1.479 20 0 FAADHN 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ZINC000423527836 483323623 /nfs/dbraw/zinc/32/36/23/483323623.db2.gz WASUXOZQZURNCH-GFCCVEGCSA-N 0 3 374.397 -1.073 20 0 FAADHN CN(CCN)C(=O)C(=O)N1CCO[C@H](CN2C(=O)c3ccccc3C2=O)C1 ZINC000423527839 483323358 /nfs/dbraw/zinc/32/33/58/483323358.db2.gz WASUXOZQZURNCH-LBPRGKRZSA-N 0 3 374.397 -1.073 20 0 FAADHN CC(C)OCCS(=O)(=O)N1CCN(C(=O)C(=O)N(C)CCN)CC1 ZINC000423533033 483323391 /nfs/dbraw/zinc/32/33/91/483323391.db2.gz WLLSZGGMHLXBKJ-UHFFFAOYSA-N 0 3 364.468 -1.698 20 0 FAADHN COCC(=O)NC1CN(C(=O)C(=O)N2C[C@@H](c3ccccc3)[C@H](N)C2)C1 ZINC000423568961 483323490 /nfs/dbraw/zinc/32/34/90/483323490.db2.gz LWKAKUUXTXVRAX-LSDHHAIUSA-N 0 3 360.414 -1.087 20 0 FAADHN CCN(CC)C(=O)CN1CCN(C(=O)C(=O)N2CCCNCC2)CC1 ZINC000423601838 483324331 /nfs/dbraw/zinc/32/43/31/483324331.db2.gz CNVULHSGGHMWRT-UHFFFAOYSA-N 0 3 353.467 -1.179 20 0 FAADHN NC[C@@H]1CCCCN1C(=O)C(=O)N1CCN(CC(=O)NC2CC2)CC1 ZINC000423601945 483325041 /nfs/dbraw/zinc/32/50/41/483325041.db2.gz FIAPXESGOREKTJ-AWEZNQCLSA-N 0 3 351.451 -1.251 20 0 FAADHN NC[C@H]1CCCCN1C(=O)C(=O)N1CCN(CC(=O)NC2CC2)CC1 ZINC000423601953 483325033 /nfs/dbraw/zinc/32/50/33/483325033.db2.gz FIAPXESGOREKTJ-CQSZACIVSA-N 0 3 351.451 -1.251 20 0 FAADHN CCN(CC)CC(=O)N1CCN(C(=O)C(=O)N2CCNC[C@@H]2C)CC1 ZINC000423607527 483324631 /nfs/dbraw/zinc/32/46/31/483324631.db2.gz MVTBQLZNNMFDDT-AWEZNQCLSA-N 0 3 353.467 -1.181 20 0 FAADHN CCN(CC)CC(=O)N1CCN(C(=O)C(=O)N2CCNC[C@H]2C)CC1 ZINC000423607528 483324382 /nfs/dbraw/zinc/32/43/82/483324382.db2.gz MVTBQLZNNMFDDT-CQSZACIVSA-N 0 3 353.467 -1.181 20 0 FAADHN CC(C)NC(=O)CN1CCN(C(=O)C(=O)N2CCCC[C@H]2CN)CC1 ZINC000423610487 483324986 /nfs/dbraw/zinc/32/49/86/483324986.db2.gz RAFPUJHHLSNKSY-AWEZNQCLSA-N 0 3 353.467 -1.005 20 0 FAADHN CC(C)NC(=O)CN1CCN(C(=O)C(=O)N2CCCC[C@@H]2CN)CC1 ZINC000423610490 483324854 /nfs/dbraw/zinc/32/48/54/483324854.db2.gz RAFPUJHHLSNKSY-CQSZACIVSA-N 0 3 353.467 -1.005 20 0 FAADHN CC[C@H](C)NC(=O)CN1CCN(C(=O)C(=O)N2CCCNCC2)CC1 ZINC000423615139 483325215 /nfs/dbraw/zinc/32/52/15/483325215.db2.gz UICSAKMPTMCBBK-AWEZNQCLSA-N 0 3 353.467 -1.133 20 0 FAADHN CC[C@@H](C)NC(=O)CN1CCN(C(=O)C(=O)N2CCCNCC2)CC1 ZINC000423615140 483325294 /nfs/dbraw/zinc/32/52/94/483325294.db2.gz UICSAKMPTMCBBK-CQSZACIVSA-N 0 3 353.467 -1.133 20 0 FAADHN CCN(CC)CC(=O)N1CCN(C(=O)C(=O)N2CCCNCC2)CC1 ZINC000423619211 483325625 /nfs/dbraw/zinc/32/56/25/483325625.db2.gz ZYJDIVLNDJETCL-UHFFFAOYSA-N 0 3 353.467 -1.179 20 0 FAADHN CN(C)CCN(C)C(=O)C(=O)N1CC(S(=O)(=O)N2CCNCC2)C1 ZINC000423620745 483325546 /nfs/dbraw/zinc/32/55/46/483325546.db2.gz WULGBRLSYJDTER-UHFFFAOYSA-N 0 3 361.468 -2.548 20 0 FAADHN CC(C)NC(=O)C(=O)N1CCN(C(=O)C(=O)N2CCCC[C@@H]2CN)CC1 ZINC000423627606 483326075 /nfs/dbraw/zinc/32/60/75/483326075.db2.gz UWWMLTMMCQKFAG-CYBMUJFWSA-N 0 3 367.450 -1.478 20 0 FAADHN CC(C)NC(=O)C(=O)N1CCN(C(=O)C(=O)N2CCCC[C@H]2CN)CC1 ZINC000423627607 483325847 /nfs/dbraw/zinc/32/58/47/483325847.db2.gz UWWMLTMMCQKFAG-ZDUSSCGKSA-N 0 3 367.450 -1.478 20 0 FAADHN NC[C@H]1CCCN1C(=O)C(=O)N1CC[C@@H](S(=O)(=O)N2CCCC2)C1 ZINC000423637028 483325946 /nfs/dbraw/zinc/32/59/46/483325946.db2.gz BWDDFVBKNGSKPW-CHWSQXEVSA-N 0 3 358.464 -1.037 20 0 FAADHN NC[C@H]1CCCN1C(=O)C(=O)N1CC[C@H](S(=O)(=O)N2CCCC2)C1 ZINC000423637031 483325226 /nfs/dbraw/zinc/32/52/26/483325226.db2.gz BWDDFVBKNGSKPW-OLZOCXBDSA-N 0 3 358.464 -1.037 20 0 FAADHN NC[C@@H]1CCCN1C(=O)C(=O)N1CC[C@@H](S(=O)(=O)N2CCCC2)C1 ZINC000423637033 483325914 /nfs/dbraw/zinc/32/59/14/483325914.db2.gz BWDDFVBKNGSKPW-QWHCGFSZSA-N 0 3 358.464 -1.037 20 0 FAADHN NC[C@@H]1CCCN1C(=O)C(=O)N1CC[C@H](S(=O)(=O)N2CCCC2)C1 ZINC000423637035 483325925 /nfs/dbraw/zinc/32/59/25/483325925.db2.gz BWDDFVBKNGSKPW-STQMWFEESA-N 0 3 358.464 -1.037 20 0 FAADHN NC(=O)CN1CCN(C(=O)C(=O)N2C[C@@H](c3ccccc3)[C@H](N)C2)CC1=O ZINC000423650113 483326693 /nfs/dbraw/zinc/32/66/93/483326693.db2.gz KBTCQGVIKSDKGQ-UONOGXRCSA-N 0 3 373.413 -1.904 20 0 FAADHN C[C@@H](C(=O)NC1CC1)N1CCN(C(=O)C(=O)N2CCC[C@@H]2CN)CC1 ZINC000423656249 483326733 /nfs/dbraw/zinc/32/67/33/483326733.db2.gz CKLHTCOUZMQKQQ-GXTWGEPZSA-N 0 3 351.451 -1.253 20 0 FAADHN C[C@H](C(=O)NC1CC1)N1CCN(C(=O)C(=O)N2CCC[C@@H]2CN)CC1 ZINC000423656252 483326526 /nfs/dbraw/zinc/32/65/26/483326526.db2.gz CKLHTCOUZMQKQQ-TZMCWYRMSA-N 0 3 351.451 -1.253 20 0 FAADHN CC[C@H](C)NC(=O)CN1CCN(C(=O)C(=O)N2CCC[C@@H]2CN)CC1 ZINC000423661021 483326703 /nfs/dbraw/zinc/32/67/03/483326703.db2.gz GNPFTMDQAKWASA-UONOGXRCSA-N 0 3 353.467 -1.005 20 0 FAADHN CC[C@@H](C)NC(=O)CN1CCN(C(=O)C(=O)N2CCC[C@@H]2CN)CC1 ZINC000423661022 483326454 /nfs/dbraw/zinc/32/64/54/483326454.db2.gz GNPFTMDQAKWASA-ZIAGYGMSSA-N 0 3 353.467 -1.005 20 0 FAADHN NCCN(Cc1ccccc1)C(=O)C(=O)N1CCN(CC(N)=O)C(=O)C1 ZINC000423670829 483326574 /nfs/dbraw/zinc/32/65/74/483326574.db2.gz VQKQETNYGPPMAP-UHFFFAOYSA-N 0 3 361.402 -1.870 20 0 FAADHN CCN(CC)C(=O)CN1CCN(C(=O)C(=O)N2CCC[C@@H]2CN)CC1 ZINC000423679424 483326844 /nfs/dbraw/zinc/32/68/44/483326844.db2.gz RKQJJLJDVMSDIV-CQSZACIVSA-N 0 3 353.467 -1.051 20 0 FAADHN COCCCS(=O)(=O)N1CCN(C(=O)C(=O)N(C)[C@H](C)CN)CC1 ZINC000423704426 483327239 /nfs/dbraw/zinc/32/72/39/483327239.db2.gz MMJOPODWTXTVIR-GFCCVEGCSA-N 0 3 364.468 -1.698 20 0 FAADHN COCCCS(=O)(=O)N1CCN(C(=O)C(=O)N(C)[C@@H](C)CN)CC1 ZINC000423704427 483327184 /nfs/dbraw/zinc/32/71/84/483327184.db2.gz MMJOPODWTXTVIR-LBPRGKRZSA-N 0 3 364.468 -1.698 20 0 FAADHN C[C@@H](CN)N(C)C(=O)C(=O)N1CCN([C@@H](C)C(=O)N2CCCC2)CC1 ZINC000423713684 483327760 /nfs/dbraw/zinc/32/77/60/483327760.db2.gz FKANGRSZNIZBQP-KBPBESRZSA-N 0 3 353.467 -1.053 20 0 FAADHN C[C@H](CN)N(C)C(=O)C(=O)N1CCN([C@@H](C)C(=O)N2CCCC2)CC1 ZINC000423713685 483327592 /nfs/dbraw/zinc/32/75/92/483327592.db2.gz FKANGRSZNIZBQP-KGLIPLIRSA-N 0 3 353.467 -1.053 20 0 FAADHN C[C@H](C(=O)N1CCCC1)N1CCN(C(=O)C(=O)N(C)[C@@H](C)CN)CC1 ZINC000423713686 483327754 /nfs/dbraw/zinc/32/77/54/483327754.db2.gz FKANGRSZNIZBQP-UONOGXRCSA-N 0 3 353.467 -1.053 20 0 FAADHN C[C@H](CN)N(C)C(=O)C(=O)N1CCN([C@H](C)C(=O)N2CCCC2)CC1 ZINC000423713687 483327417 /nfs/dbraw/zinc/32/74/17/483327417.db2.gz FKANGRSZNIZBQP-ZIAGYGMSSA-N 0 3 353.467 -1.053 20 0 FAADHN C[C@@H](CN)N(C)C(=O)C(=O)N1CCN(CC(=O)N2CCCCC2)CC1 ZINC000423719908 483328548 /nfs/dbraw/zinc/32/85/48/483328548.db2.gz NJNPEJZZFMPNCC-AWEZNQCLSA-N 0 3 353.467 -1.051 20 0 FAADHN C[C@H](CN)N(C)C(=O)C(=O)N1CCN(CC(=O)N2CCCCC2)CC1 ZINC000423719911 483328488 /nfs/dbraw/zinc/32/84/88/483328488.db2.gz NJNPEJZZFMPNCC-CQSZACIVSA-N 0 3 353.467 -1.051 20 0 FAADHN C[C@@H]1CCCN(C(=O)C(=O)N2CCN(C(C)(C)C(N)=O)CC2)[C@@H]1CN ZINC000423725635 483328567 /nfs/dbraw/zinc/32/85/67/483328567.db2.gz HXARQLRLKKNFNQ-CHWSQXEVSA-N 0 3 353.467 -1.020 20 0 FAADHN C[C@@H]1CCCN(C(=O)C(=O)N2CCN(C(C)(C)C(N)=O)CC2)[C@H]1CN ZINC000423725636 483328245 /nfs/dbraw/zinc/32/82/45/483328245.db2.gz HXARQLRLKKNFNQ-OLZOCXBDSA-N 0 3 353.467 -1.020 20 0 FAADHN C[C@H]1CCCN(C(=O)C(=O)N2CCN(C(C)(C)C(N)=O)CC2)[C@@H]1CN ZINC000423725637 483328400 /nfs/dbraw/zinc/32/84/00/483328400.db2.gz HXARQLRLKKNFNQ-QWHCGFSZSA-N 0 3 353.467 -1.020 20 0 FAADHN C[C@H]1CCCN(C(=O)C(=O)N2CCN(C(C)(C)C(N)=O)CC2)[C@H]1CN ZINC000423725638 483328516 /nfs/dbraw/zinc/32/85/16/483328516.db2.gz HXARQLRLKKNFNQ-STQMWFEESA-N 0 3 353.467 -1.020 20 0 FAADHN CCNC(=O)CN1CCN(C(=O)C(=O)N2CCC[C@H](C)[C@@H]2CN)CC1 ZINC000423730797 483328093 /nfs/dbraw/zinc/32/80/93/483328093.db2.gz LPNCXHWGTJOYKK-KBPBESRZSA-N 0 3 353.467 -1.148 20 0 FAADHN CCNC(=O)CN1CCN(C(=O)C(=O)N2CCC[C@@H](C)[C@@H]2CN)CC1 ZINC000423730800 483328627 /nfs/dbraw/zinc/32/86/27/483328627.db2.gz LPNCXHWGTJOYKK-KGLIPLIRSA-N 0 3 353.467 -1.148 20 0 FAADHN CCNC(=O)CN1CCN(C(=O)C(=O)N2CCC[C@H](C)[C@H]2CN)CC1 ZINC000423730804 483328179 /nfs/dbraw/zinc/32/81/79/483328179.db2.gz LPNCXHWGTJOYKK-UONOGXRCSA-N 0 3 353.467 -1.148 20 0 FAADHN CCNC(=O)CN1CCN(C(=O)C(=O)N2CCC[C@@H](C)[C@H]2CN)CC1 ZINC000423730807 483328637 /nfs/dbraw/zinc/32/86/37/483328637.db2.gz LPNCXHWGTJOYKK-ZIAGYGMSSA-N 0 3 353.467 -1.148 20 0 FAADHN COCCCNC(=O)[C@H](C)N1CCN(C(=O)C(=O)N(C)[C@@H](C)CN)CC1 ZINC000423731255 483328152 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ZINC000423748060 483328543 /nfs/dbraw/zinc/32/85/43/483328543.db2.gz ZFGVCOUFEJOAHD-ZFWWWQNUSA-N 0 3 365.478 -1.005 20 0 FAADHN COC(=O)CN(CCN1CCOCC1)C(=O)CNC(=O)[C@@H](N)C(C)C ZINC000423761613 483328355 /nfs/dbraw/zinc/32/83/55/483328355.db2.gz RTCMDZUAZZEYBH-HNNXBMFYSA-N 0 3 358.439 -1.580 20 0 FAADHN N[C@@H]1C[C@@H]1C(=O)NCCS(=O)(=O)N1CCN(c2ccccn2)CC1 ZINC000424129693 483330300 /nfs/dbraw/zinc/33/03/00/483330300.db2.gz GNCKWMNBHFUJFV-QWHCGFSZSA-N 0 3 353.448 -1.003 20 0 FAADHN Cc1cc(CN)cc(NC(=O)C(=O)N2CCN3C(=O)C(=O)NC[C@@H]3C2)c1 ZINC000424473954 483336497 /nfs/dbraw/zinc/33/64/97/483336497.db2.gz XETWLNTXRRLHOY-CYBMUJFWSA-N 0 3 359.386 -1.439 20 0 FAADHN Cc1cc(CN)cc(NC(=O)C(=O)N2CCN3C(=O)C(=O)NC[C@H]3C2)c1 ZINC000424473958 483336666 /nfs/dbraw/zinc/33/66/66/483336666.db2.gz XETWLNTXRRLHOY-ZDUSSCGKSA-N 0 3 359.386 -1.439 20 0 FAADHN CC(C)NS(=O)(=O)NCCNC(=O)N1C[C@@H](c2cnn(C)c2)[C@H](N)C1 ZINC000424482895 483336727 /nfs/dbraw/zinc/33/67/27/483336727.db2.gz VWYUAPMERDAWHF-QWHCGFSZSA-N 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CO[C@@H]1CN(C(=O)C(=O)N2C[C@@H](c3cnn(C)c3)[C@H](N)C2)C[C@@H]1OC ZINC000424491529 483337356 /nfs/dbraw/zinc/33/73/56/483337356.db2.gz DTIGWUDRCWEGBA-RFQIPJPRSA-N 0 3 351.407 -1.455 20 0 FAADHN Cn1cc([C@@H]2CN(C(=O)C(=O)N3CCSC[C@H]3CCO)C[C@H]2N)cn1 ZINC000424492884 483337599 /nfs/dbraw/zinc/33/75/99/483337599.db2.gz JEGWYJKFDFIDPX-HZSPNIEDSA-N 0 3 367.475 -1.000 20 0 FAADHN Cn1cc([C@@H]2CN(C(=O)C(=O)N3CCSC[C@@H]3CCO)C[C@H]2N)cn1 ZINC000424492889 483337608 /nfs/dbraw/zinc/33/76/08/483337608.db2.gz JEGWYJKFDFIDPX-MELADBBJSA-N 0 3 367.475 -1.000 20 0 FAADHN Cn1cc([C@@H]2CN(C(=O)C(=O)N3CC(NC(=O)C4CCC4)C3)C[C@H]2N)cn1 ZINC000424494463 483337341 /nfs/dbraw/zinc/33/73/41/483337341.db2.gz NMIYMDFHHJMXRG-LSDHHAIUSA-N 0 3 374.445 -1.200 20 0 FAADHN COC[C@@H]1CN(C(=O)C(=O)N2C[C@@H](c3cnn(C)c3)[C@H](N)C2)C[C@H](C)O1 ZINC000424494979 483337723 /nfs/dbraw/zinc/33/77/23/483337723.db2.gz OVYIPBIJMHXBHD-CYUUQNCZSA-N 0 3 365.434 -1.065 20 0 FAADHN COC[C@H]1CN(C(=O)C(=O)N2C[C@@H](c3cnn(C)c3)[C@H](N)C2)C[C@H](C)O1 ZINC000424494984 483337746 /nfs/dbraw/zinc/33/77/46/483337746.db2.gz OVYIPBIJMHXBHD-PMOUVXMZSA-N 0 3 365.434 -1.065 20 0 FAADHN COC[C@H]1CN(C(=O)C(=O)N2C[C@@H](c3cnn(C)c3)[C@H](N)C2)C[C@@H](C)O1 ZINC000424494986 483337304 /nfs/dbraw/zinc/33/73/04/483337304.db2.gz OVYIPBIJMHXBHD-REBRKWNGSA-N 0 3 365.434 -1.065 20 0 FAADHN COC[C@@H]1CN(C(=O)C(=O)N2C[C@@H](c3cnn(C)c3)[C@H](N)C2)C[C@@H](C)O1 ZINC000424494988 483337320 /nfs/dbraw/zinc/33/73/20/483337320.db2.gz OVYIPBIJMHXBHD-UQOMUDLDSA-N 0 3 365.434 -1.065 20 0 FAADHN C[C@H]1CN(C(=O)C(=O)N2C[C@@H](c3cnn(C)c3)[C@H](N)C2)C[C@H](CO)O1 ZINC000424495156 483337632 /nfs/dbraw/zinc/33/76/32/483337632.db2.gz POZQQJPYOPKYAB-AHLTXXRQSA-N 0 3 351.407 -1.719 20 0 FAADHN C[C@H]1CN(C(=O)C(=O)N2C[C@@H](c3cnn(C)c3)[C@H](N)C2)C[C@@H](CO)O1 ZINC000424495160 483337542 /nfs/dbraw/zinc/33/75/42/483337542.db2.gz POZQQJPYOPKYAB-DOERSZECSA-N 0 3 351.407 -1.719 20 0 FAADHN C[C@@H]1CN(C(=O)C(=O)N2C[C@@H](c3cnn(C)c3)[C@H](N)C2)C[C@H](CO)O1 ZINC000424495162 483337391 /nfs/dbraw/zinc/33/73/91/483337391.db2.gz POZQQJPYOPKYAB-RUZUBIRVSA-N 0 3 351.407 -1.719 20 0 FAADHN C[C@@H]1CN(C(=O)C(=O)N2C[C@@H](c3cnn(C)c3)[C@H](N)C2)C[C@@H](CO)O1 ZINC000424495165 483337519 /nfs/dbraw/zinc/33/75/19/483337519.db2.gz POZQQJPYOPKYAB-VZZFWQQMSA-N 0 3 351.407 -1.719 20 0 FAADHN C[C@H](O)C[C@H]1COCCN1C(=O)C(=O)N1C[C@@H](c2cnn(C)c2)[C@H](N)C1 ZINC000424495534 483337379 /nfs/dbraw/zinc/33/73/79/483337379.db2.gz QNMJSWYJGNDCIQ-CYUUQNCZSA-N 0 3 365.434 -1.329 20 0 FAADHN C[C@H](O)C[C@@H]1COCCN1C(=O)C(=O)N1C[C@@H](c2cnn(C)c2)[C@H](N)C1 ZINC000424495538 483337572 /nfs/dbraw/zinc/33/75/72/483337572.db2.gz QNMJSWYJGNDCIQ-PMOUVXMZSA-N 0 3 365.434 -1.329 20 0 FAADHN C[C@@H](O)C[C@@H]1COCCN1C(=O)C(=O)N1C[C@@H](c2cnn(C)c2)[C@H](N)C1 ZINC000424495541 483337460 /nfs/dbraw/zinc/33/74/60/483337460.db2.gz QNMJSWYJGNDCIQ-REBRKWNGSA-N 0 3 365.434 -1.329 20 0 FAADHN C[C@@H](O)C[C@H]1COCCN1C(=O)C(=O)N1C[C@@H](c2cnn(C)c2)[C@H](N)C1 ZINC000424495543 483337646 /nfs/dbraw/zinc/33/76/46/483337646.db2.gz QNMJSWYJGNDCIQ-UQOMUDLDSA-N 0 3 365.434 -1.329 20 0 FAADHN COCC(=O)NC1CN(C(=O)C(=O)N2C[C@@H](c3cnn(C)c3)[C@H](N)C2)C1 ZINC000424496042 483337831 /nfs/dbraw/zinc/33/78/31/483337831.db2.gz SCRBFHRLKQKNMQ-QWHCGFSZSA-N 0 3 364.406 -2.353 20 0 FAADHN Cn1cc([C@@H]2CN(C(=O)C(=O)N3CC(NC(=O)C4CC4)C3)C[C@H]2N)cn1 ZINC000424498541 483337563 /nfs/dbraw/zinc/33/75/63/483337563.db2.gz ZWUPFKLRGSGMPN-UONOGXRCSA-N 0 3 360.418 -1.590 20 0 FAADHN COC[C@@H](NC(=O)C(=O)N1C[C@@H](c2cnn(C)c2)[C@H](N)C1)[C@H]1CCCO1 ZINC000424518194 483338106 /nfs/dbraw/zinc/33/81/06/483338106.db2.gz HLLPAIKYQVVGFS-GBJTYRQASA-N 0 3 365.434 -1.017 20 0 FAADHN COC[C@H](NC(=O)C(=O)N1C[C@@H](c2cnn(C)c2)[C@H](N)C1)[C@H]1CCCO1 ZINC000424518195 483338364 /nfs/dbraw/zinc/33/83/64/483338364.db2.gz HLLPAIKYQVVGFS-LJISPDSOSA-N 0 3 365.434 -1.017 20 0 FAADHN COC[C@H](NC(=O)C(=O)N1C[C@@H](c2cnn(C)c2)[C@H](N)C1)[C@@H]1CCCO1 ZINC000424518197 483338142 /nfs/dbraw/zinc/33/81/42/483338142.db2.gz HLLPAIKYQVVGFS-XGUBFFRZSA-N 0 3 365.434 -1.017 20 0 FAADHN COC[C@@H](NC(=O)C(=O)N1C[C@@H](c2cnn(C)c2)[C@H](N)C1)[C@@H]1CCCO1 ZINC000424518198 483338261 /nfs/dbraw/zinc/33/82/61/483338261.db2.gz HLLPAIKYQVVGFS-YJNKXOJESA-N 0 3 365.434 -1.017 20 0 FAADHN CC(C)N1C[C@H](NC(=O)C(=O)N2C[C@@H](c3cnn(C)c3)[C@H](N)C2)CC1=O ZINC000424519583 483338508 /nfs/dbraw/zinc/33/85/08/483338508.db2.gz JUHPYTSKPYLLBY-HZSPNIEDSA-N 0 3 362.434 -1.201 20 0 FAADHN CC(C)N1C[C@@H](NC(=O)C(=O)N2C[C@@H](c3cnn(C)c3)[C@H](N)C2)CC1=O ZINC000424519588 483338295 /nfs/dbraw/zinc/33/82/95/483338295.db2.gz JUHPYTSKPYLLBY-MELADBBJSA-N 0 3 362.434 -1.201 20 0 FAADHN C[C@@H](CN1CCOCC1)NC(=O)C(=O)N1C[C@@H](c2cnn(C)c2)[C@H](N)C1 ZINC000424520575 483338654 /nfs/dbraw/zinc/33/86/54/483338654.db2.gz KTGRNDUQHRGVQG-AEGPPILISA-N 0 3 364.450 -1.490 20 0 FAADHN C[C@H](CN1CCOCC1)NC(=O)C(=O)N1C[C@@H](c2cnn(C)c2)[C@H](N)C1 ZINC000424520576 483338560 /nfs/dbraw/zinc/33/85/60/483338560.db2.gz KTGRNDUQHRGVQG-VHDGCEQUSA-N 0 3 364.450 -1.490 20 0 FAADHN COCCN1CC[C@@H](NC(=O)C(=O)N2C[C@@H](c3cnn(C)c3)[C@H](N)C2)C1 ZINC000424522133 483338545 /nfs/dbraw/zinc/33/85/45/483338545.db2.gz MQSQYPUHRSMMGC-QLFBSQMISA-N 0 3 364.450 -1.490 20 0 FAADHN COCCN1CC[C@H](NC(=O)C(=O)N2C[C@@H](c3cnn(C)c3)[C@H](N)C2)C1 ZINC000424522135 483338463 /nfs/dbraw/zinc/33/84/63/483338463.db2.gz MQSQYPUHRSMMGC-SOUVJXGZSA-N 0 3 364.450 -1.490 20 0 FAADHN Cn1cc([C@@H]2CN(C(=O)C(=O)NCC(=O)N3CCCCC3)C[C@H]2N)cn1 ZINC000424523486 483338324 /nfs/dbraw/zinc/33/83/24/483338324.db2.gz OHLKOPRKTKHOEY-UONOGXRCSA-N 0 3 362.434 -1.198 20 0 FAADHN CCO[C@@H]1C[C@@H](NC(=O)C(=O)N2C[C@@H](c3cnn(C)c3)[C@H](N)C2)[C@@H]1OC ZINC000424534829 483339468 /nfs/dbraw/zinc/33/94/68/483339468.db2.gz ZQOJBIAXUJLKDY-JARUQAPTSA-N 0 3 365.434 -1.018 20 0 FAADHN CCO[C@@H]1C[C@@H](NC(=O)C(=O)N2C[C@@H](c3cnn(C)c3)[C@H](N)C2)[C@H]1OC ZINC000424534841 483339150 /nfs/dbraw/zinc/33/91/50/483339150.db2.gz ZQOJBIAXUJLKDY-NJVJYBDUSA-N 0 3 365.434 -1.018 20 0 FAADHN CCO[C@@H]1C[C@H](NC(=O)C(=O)N2C[C@@H](c3cnn(C)c3)[C@H](N)C2)[C@H]1OC ZINC000424534846 483339157 /nfs/dbraw/zinc/33/91/57/483339157.db2.gz ZQOJBIAXUJLKDY-XPABHHOTSA-N 0 3 365.434 -1.018 20 0 FAADHN CCO[C@@H]1C[C@H](NC(=O)C(=O)N2C[C@@H](c3cnn(C)c3)[C@H](N)C2)[C@@H]1OC ZINC000424534850 483339529 /nfs/dbraw/zinc/33/95/29/483339529.db2.gz ZQOJBIAXUJLKDY-ZQNQSHIBSA-N 0 3 365.434 -1.018 20 0 FAADHN CO[C@H]1CN(C(=O)C(=O)N2C[C@@H](c3cnn(C)c3)[C@H](N)C2)C[C@@H]1OC ZINC000424538858 483339604 /nfs/dbraw/zinc/33/96/04/483339604.db2.gz DTIGWUDRCWEGBA-CRWXNKLISA-N 0 3 351.407 -1.455 20 0 FAADHN CO[C@@H]1CN(C(=O)C(=O)N2C[C@@H](c3cnn(C)c3)[C@H](N)C2)C[C@H]1OC ZINC000424538861 483339644 /nfs/dbraw/zinc/33/96/44/483339644.db2.gz DTIGWUDRCWEGBA-REWJHTLYSA-N 0 3 351.407 -1.455 20 0 FAADHN 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ZINC000557236796 482580888 /nfs/dbraw/zinc/58/08/88/482580888.db2.gz CLOYOGCCYICJDG-LLVKDONJSA-N 0 3 367.422 -1.388 20 0 FAADHN O=C(N[C@H]1CNCCC1(F)F)N1CC(S(=O)(=O)N2CCNCC2)C1 ZINC000557236797 482579955 /nfs/dbraw/zinc/57/99/55/482579955.db2.gz CLOYOGCCYICJDG-NSHDSACASA-N 0 3 367.422 -1.388 20 0 FAADHN C[C@H](CNC(=O)C(=O)NC[C@H]1CN(C)CCN1C)CN1CCOCC1 ZINC000557245624 482580720 /nfs/dbraw/zinc/58/07/20/482580720.db2.gz DPAZEZIDRPJHQR-CABCVRRESA-N 0 3 355.483 -1.567 20 0 FAADHN C[C@@H](CNC(=O)C(=O)NC[C@H]1CN(C)CCN1C)CN1CCOCC1 ZINC000557245640 482580852 /nfs/dbraw/zinc/58/08/52/482580852.db2.gz DPAZEZIDRPJHQR-GJZGRUSLSA-N 0 3 355.483 -1.567 20 0 FAADHN C[C@H](CNC(=O)C(=O)NC[C@@H]1CN(C)CCN1C)CN1CCOCC1 ZINC000557245642 482579751 /nfs/dbraw/zinc/57/97/51/482579751.db2.gz DPAZEZIDRPJHQR-HUUCEWRRSA-N 0 3 355.483 -1.567 20 0 FAADHN C[C@@H](CNC(=O)C(=O)NC[C@@H]1CN(C)CCN1C)CN1CCOCC1 ZINC000557245644 482579735 /nfs/dbraw/zinc/57/97/35/482579735.db2.gz DPAZEZIDRPJHQR-LSDHHAIUSA-N 0 3 355.483 -1.567 20 0 FAADHN CC[C@H]1CCCCN1CCNC(=O)C(=O)NCC(=O)N1CCNCC1 ZINC000557265279 482582821 /nfs/dbraw/zinc/58/28/21/482582821.db2.gz VGJUDMBXOYOOKU-AWEZNQCLSA-N 0 3 353.467 -1.085 20 0 FAADHN CC[C@@H]1CCCCN1CCNC(=O)C(=O)NCC(=O)N1CCNCC1 ZINC000557265283 482581477 /nfs/dbraw/zinc/58/14/77/482581477.db2.gz VGJUDMBXOYOOKU-CQSZACIVSA-N 0 3 353.467 -1.085 20 0 FAADHN CN(C)[C@@H](CNC(=O)C(=O)NCC(=O)N1CCNCC1)c1ccccc1 ZINC000557277201 482582399 /nfs/dbraw/zinc/58/23/99/482582399.db2.gz UQGLDLWRKJSQRT-HNNXBMFYSA-N 0 3 361.446 -1.047 20 0 FAADHN CN(C)[C@H](CNC(=O)C(=O)NCC(=O)N1CCNCC1)c1ccccc1 ZINC000557277204 482582856 /nfs/dbraw/zinc/58/28/56/482582856.db2.gz UQGLDLWRKJSQRT-OAHLLOKOSA-N 0 3 361.446 -1.047 20 0 FAADHN C[C@H](C(=O)N1CCOCC1)N1CCN(C(=O)C(=O)NC2CNC2)CC1 ZINC000557297298 482581929 /nfs/dbraw/zinc/58/19/29/482581929.db2.gz HXRSVMJAQRLPSC-GFCCVEGCSA-N 0 3 353.423 -2.534 20 0 FAADHN C[C@@H](C(=O)N1CCOCC1)N1CCN(C(=O)C(=O)NC2CNC2)CC1 ZINC000557297299 482582641 /nfs/dbraw/zinc/58/26/41/482582641.db2.gz HXRSVMJAQRLPSC-LBPRGKRZSA-N 0 3 353.423 -2.534 20 0 FAADHN COCCN(C)CCNC(=O)C(=O)NCCN1CCN(C)C(C)(C)C1 ZINC000557302422 482581750 /nfs/dbraw/zinc/58/17/50/482581750.db2.gz QJIXJOLJCRZUKB-UHFFFAOYSA-N 0 3 357.499 -1.177 20 0 FAADHN CC[C@@H](C)N(C)CCNC(=O)C(=O)N(C)C[C@H](O)CN1CCOCC1 ZINC000557380998 482583952 /nfs/dbraw/zinc/58/39/52/482583952.db2.gz DMVAXSYWXCKUDW-CABCVRRESA-N 0 3 358.483 -1.016 20 0 FAADHN CC[C@H](C)N(C)CCNC(=O)C(=O)N(C)C[C@H](O)CN1CCOCC1 ZINC000557380999 482583904 /nfs/dbraw/zinc/58/39/04/482583904.db2.gz DMVAXSYWXCKUDW-GJZGRUSLSA-N 0 3 358.483 -1.016 20 0 FAADHN CC[C@@H](C)N(C)CCNC(=O)C(=O)N(C)C[C@@H](O)CN1CCOCC1 ZINC000557381000 482584586 /nfs/dbraw/zinc/58/45/86/482584586.db2.gz DMVAXSYWXCKUDW-HUUCEWRRSA-N 0 3 358.483 -1.016 20 0 FAADHN CC[C@H](C)N(C)CCNC(=O)C(=O)N(C)C[C@@H](O)CN1CCOCC1 ZINC000557381001 482584307 /nfs/dbraw/zinc/58/43/07/482584307.db2.gz DMVAXSYWXCKUDW-LSDHHAIUSA-N 0 3 358.483 -1.016 20 0 FAADHN CC(C)Nc1nc(NCCO)nc(N2CCN(C(=O)N(C)C)CC2)n1 ZINC000557418499 482584807 /nfs/dbraw/zinc/58/48/07/482584807.db2.gz CWKNQQCDKMAXPQ-UHFFFAOYSA-N 0 3 352.443 -1.257 20 0 FAADHN CC(C)Nc1nc(NCCO)nc(NC2CCN(S(C)(=O)=O)CC2)n1 ZINC000557476323 482583739 /nfs/dbraw/zinc/58/37/39/482583739.db2.gz MGFAUIUFUJPOMM-UHFFFAOYSA-N 0 3 373.483 -1.802 20 0 FAADHN CCN1CCN([C@@H](C)CNc2nc(NCCO)nc(NC(C)C)n2)CC1 ZINC000557492199 482583644 /nfs/dbraw/zinc/58/36/44/482583644.db2.gz AAVJCMPZHKHKTP-AWEZNQCLSA-N 0 3 366.514 -1.200 20 0 FAADHN CCN1CCN([C@H](C)CNc2nc(NCCO)nc(NC(C)C)n2)CC1 ZINC000557492202 482584386 /nfs/dbraw/zinc/58/43/86/482584386.db2.gz AAVJCMPZHKHKTP-CQSZACIVSA-N 0 3 366.514 -1.200 20 0 FAADHN CC(C)Nc1nc(NCCO)nc(N[C@@H]2CCCN(S(C)(=O)=O)C2)n1 ZINC000557519514 482584634 /nfs/dbraw/zinc/58/46/34/482584634.db2.gz OHYNLRHEVDOXAG-LLVKDONJSA-N 0 3 373.483 -1.802 20 0 FAADHN CC(C)Nc1nc(NCCO)nc(N[C@H]2CCCN(S(C)(=O)=O)C2)n1 ZINC000557519515 482584048 /nfs/dbraw/zinc/58/40/48/482584048.db2.gz OHYNLRHEVDOXAG-NSHDSACASA-N 0 3 373.483 -1.802 20 0 FAADHN COCCN1CCC(Nc2nc(NCCO)nc(NC(C)C)n2)CC1 ZINC000557539284 482583791 /nfs/dbraw/zinc/58/37/91/482583791.db2.gz VOTFSJJQKAUDHA-UHFFFAOYSA-N 0 3 353.471 -1.116 20 0 FAADHN CCNC(=O)CN1CCN(C(=O)C(=O)NC[C@@H](C)N(C)C2CC2)CC1 ZINC000557561162 482585029 /nfs/dbraw/zinc/58/50/29/482585029.db2.gz GBAWIRRYWLCJME-CYBMUJFWSA-N 0 3 353.467 -1.134 20 0 FAADHN CCNC(=O)CN1CCN(C(=O)C(=O)NC[C@H](C)N(C)C2CC2)CC1 ZINC000557561163 482583579 /nfs/dbraw/zinc/58/35/79/482583579.db2.gz GBAWIRRYWLCJME-ZDUSSCGKSA-N 0 3 353.467 -1.134 20 0 FAADHN CC(C)Nc1nc(NCCO)nc(NCC2CCS(=O)(=O)CC2)n1 ZINC000557624607 482585901 /nfs/dbraw/zinc/58/59/01/482585901.db2.gz FRGYTRGNUWLPMW-UHFFFAOYSA-N 0 3 358.468 -1.402 20 0 FAADHN CC(C)Nc1nc(NCCO)nc(N[C@@H](C)CCN2CCN(C)CC2)n1 ZINC000557636609 482585549 /nfs/dbraw/zinc/58/55/49/482585549.db2.gz FMFSYQIIJUELRQ-AWEZNQCLSA-N 0 3 366.514 -1.200 20 0 FAADHN CC(C)Nc1nc(NCCO)nc(N[C@H](C)CCN2CCN(C)CC2)n1 ZINC000557636612 482585807 /nfs/dbraw/zinc/58/58/07/482585807.db2.gz FMFSYQIIJUELRQ-CQSZACIVSA-N 0 3 366.514 -1.200 20 0 FAADHN NC(=O)[C@H]1CN(C(=O)C(=O)NCC2(N3CCCC3)CCOCC2)CCO1 ZINC000557690684 482586425 /nfs/dbraw/zinc/58/64/25/482586425.db2.gz AINZCAAVGLNALT-CYBMUJFWSA-N 0 3 368.434 -1.540 20 0 FAADHN NC(=O)[C@@H]1CN(C(=O)C(=O)NCC2(N3CCCC3)CCOCC2)CCO1 ZINC000557690685 482586158 /nfs/dbraw/zinc/58/61/58/482586158.db2.gz AINZCAAVGLNALT-ZDUSSCGKSA-N 0 3 368.434 -1.540 20 0 FAADHN COCCN1CC[C@H](NC(=O)C(=O)NCCN2CCN(C)C(C)(C)C2)C1 ZINC000557766617 482586821 /nfs/dbraw/zinc/58/68/21/482586821.db2.gz GPJWGJRVYBTHBV-HNNXBMFYSA-N 0 3 369.510 -1.035 20 0 FAADHN COCCN1CC[C@@H](NC(=O)C(=O)NCCN2CCN(C)C(C)(C)C2)C1 ZINC000557766622 482586701 /nfs/dbraw/zinc/58/67/01/482586701.db2.gz GPJWGJRVYBTHBV-OAHLLOKOSA-N 0 3 369.510 -1.035 20 0 FAADHN COC1CCN(C(C)(C)CNC(=O)C(=O)N2CCO[C@@H](C(N)=O)C2)CC1 ZINC000557877319 482589318 /nfs/dbraw/zinc/58/93/18/482589318.db2.gz JIYHNIYJHRYIJC-CYBMUJFWSA-N 0 3 370.450 -1.295 20 0 FAADHN COC1CCN(C(C)(C)CNC(=O)C(=O)N2CCO[C@H](C(N)=O)C2)CC1 ZINC000557877322 482589611 /nfs/dbraw/zinc/58/96/11/482589611.db2.gz JIYHNIYJHRYIJC-ZDUSSCGKSA-N 0 3 370.450 -1.295 20 0 FAADHN C[C@H](CNC(=O)C(=O)NC[C@H](O)CN1CCC(C)CC1)S(N)(=O)=O ZINC000557905772 482589293 /nfs/dbraw/zinc/58/92/93/482589293.db2.gz PZYMEKQPZPFTKY-NEPJUHHUSA-N 0 3 364.468 -2.011 20 0 FAADHN C[C@@H](CNC(=O)C(=O)NC[C@@H](O)CN1CCC(C)CC1)S(N)(=O)=O ZINC000557905785 482588914 /nfs/dbraw/zinc/58/89/14/482588914.db2.gz PZYMEKQPZPFTKY-NWDGAFQWSA-N 0 3 364.468 -2.011 20 0 FAADHN C[C@@H](CNC(=O)C(=O)NC[C@H](O)CN1CCC(C)CC1)S(N)(=O)=O ZINC000557905787 482588925 /nfs/dbraw/zinc/58/89/25/482588925.db2.gz PZYMEKQPZPFTKY-RYUDHWBXSA-N 0 3 364.468 -2.011 20 0 FAADHN C[C@H](CNC(=O)C(=O)NC[C@@H](O)CN1CCC(C)CC1)S(N)(=O)=O ZINC000557905788 482589649 /nfs/dbraw/zinc/58/96/49/482589649.db2.gz PZYMEKQPZPFTKY-VXGBXAGGSA-N 0 3 364.468 -2.011 20 0 FAADHN CC(C)Nc1nc(NCCO)nc(NC[C@H]2CCCN(C(N)=O)C2)n1 ZINC000558028731 482589701 /nfs/dbraw/zinc/58/97/01/482589701.db2.gz GXGYHMYIOOXTMI-LLVKDONJSA-N 0 3 352.443 -1.436 20 0 FAADHN CC(C)Nc1nc(NCCO)nc(NC[C@@H]2CCCN(C(N)=O)C2)n1 ZINC000558028732 482589202 /nfs/dbraw/zinc/58/92/02/482589202.db2.gz GXGYHMYIOOXTMI-NSHDSACASA-N 0 3 352.443 -1.436 20 0 FAADHN CCNC(=O)CN1CCN(C(=O)C(=O)N[C@H]2CCN(C)[C@@H](C)C2)CC1 ZINC000558208039 482592944 /nfs/dbraw/zinc/59/29/44/482592944.db2.gz FBSAHNPKGCRLPI-KBPBESRZSA-N 0 3 353.467 -1.134 20 0 FAADHN CCNC(=O)CN1CCN(C(=O)C(=O)N[C@H]2CCN(C)[C@H](C)C2)CC1 ZINC000558208040 482592789 /nfs/dbraw/zinc/59/27/89/482592789.db2.gz FBSAHNPKGCRLPI-KGLIPLIRSA-N 0 3 353.467 -1.134 20 0 FAADHN CCNC(=O)CN1CCN(C(=O)C(=O)N[C@@H]2CCN(C)[C@@H](C)C2)CC1 ZINC000558208041 482593273 /nfs/dbraw/zinc/59/32/73/482593273.db2.gz FBSAHNPKGCRLPI-UONOGXRCSA-N 0 3 353.467 -1.134 20 0 FAADHN CCNC(=O)CN1CCN(C(=O)C(=O)N[C@@H]2CCN(C)[C@H](C)C2)CC1 ZINC000558208042 482592309 /nfs/dbraw/zinc/59/23/09/482592309.db2.gz FBSAHNPKGCRLPI-ZIAGYGMSSA-N 0 3 353.467 -1.134 20 0 FAADHN CN(C)CCN(C[C@@H]1CCCO1)C(=O)C(=O)NC[C@@H]1CN(C)CCN1C ZINC000558216654 482592291 /nfs/dbraw/zinc/59/22/91/482592291.db2.gz GOJRKJOXSPKMNJ-CVEARBPZSA-N 0 3 369.510 -1.082 20 0 FAADHN CN(C)CCN(C[C@@H]1CCCO1)C(=O)C(=O)NC[C@H]1CN(C)CCN1C ZINC000558216655 482591999 /nfs/dbraw/zinc/59/19/99/482591999.db2.gz GOJRKJOXSPKMNJ-HOTGVXAUSA-N 0 3 369.510 -1.082 20 0 FAADHN CN(C)CCN(C[C@H]1CCCO1)C(=O)C(=O)NC[C@@H]1CN(C)CCN1C ZINC000558216656 482592666 /nfs/dbraw/zinc/59/26/66/482592666.db2.gz GOJRKJOXSPKMNJ-HZPDHXFCSA-N 0 3 369.510 -1.082 20 0 FAADHN CN(C)CCN(C[C@H]1CCCO1)C(=O)C(=O)NC[C@H]1CN(C)CCN1C ZINC000558216657 482593152 /nfs/dbraw/zinc/59/31/52/482593152.db2.gz GOJRKJOXSPKMNJ-JKSUJKDBSA-N 0 3 369.510 -1.082 20 0 FAADHN C[C@@H]1CN(C(=O)C(=O)NC[C@H]2CN(C)CCN2C)CCN1CC(C)(C)O ZINC000558217721 482593194 /nfs/dbraw/zinc/59/31/94/482593194.db2.gz PGDZBGBWRWTGNW-CABCVRRESA-N 0 3 369.510 -1.348 20 0 FAADHN C[C@H]1CN(C(=O)C(=O)NC[C@H]2CN(C)CCN2C)CCN1CC(C)(C)O ZINC000558217727 482592380 /nfs/dbraw/zinc/59/23/80/482592380.db2.gz PGDZBGBWRWTGNW-GJZGRUSLSA-N 0 3 369.510 -1.348 20 0 FAADHN C[C@@H]1CN(C(=O)C(=O)NC[C@@H]2CN(C)CCN2C)CCN1CC(C)(C)O ZINC000558217730 482592050 /nfs/dbraw/zinc/59/20/50/482592050.db2.gz PGDZBGBWRWTGNW-HUUCEWRRSA-N 0 3 369.510 -1.348 20 0 FAADHN C[C@H]1CN(C(=O)C(=O)NC[C@@H]2CN(C)CCN2C)CCN1CC(C)(C)O ZINC000558217733 482592557 /nfs/dbraw/zinc/59/25/57/482592557.db2.gz PGDZBGBWRWTGNW-LSDHHAIUSA-N 0 3 369.510 -1.348 20 0 FAADHN CN1CCN(C)[C@@H](CNC(=O)C(=O)N2CCN(C[C@H]3CCOC3)CC2)C1 ZINC000558218314 482592966 /nfs/dbraw/zinc/59/29/66/482592966.db2.gz NPFRCZVSJYHEFV-CVEARBPZSA-N 0 3 367.494 -1.471 20 0 FAADHN CN1CCN(C)[C@@H](CNC(=O)C(=O)N2CCN(C[C@@H]3CCOC3)CC2)C1 ZINC000558218315 482593613 /nfs/dbraw/zinc/59/36/13/482593613.db2.gz NPFRCZVSJYHEFV-HOTGVXAUSA-N 0 3 367.494 -1.471 20 0 FAADHN CN1CCN(C)[C@H](CNC(=O)C(=O)N2CCN(C[C@H]3CCOC3)CC2)C1 ZINC000558218317 482593297 /nfs/dbraw/zinc/59/32/97/482593297.db2.gz NPFRCZVSJYHEFV-HZPDHXFCSA-N 0 3 367.494 -1.471 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CN(C)C(=O)[C@H]1CCCN1CCCNC(=O)C(=O)N1CCN(C)C(=O)C1 ZINC000566411172 483644178 /nfs/dbraw/zinc/64/41/78/483644178.db2.gz AOMGERSCMGUGSM-CYBMUJFWSA-N 0 3 367.450 -1.654 20 0 FAADHN CN(C)C(=O)[C@@H]1CCCN1CCCNC(=O)C(=O)N1CCN(C)C(=O)C1 ZINC000566411173 483644125 /nfs/dbraw/zinc/64/41/25/483644125.db2.gz AOMGERSCMGUGSM-ZDUSSCGKSA-N 0 3 367.450 -1.654 20 0 FAADHN CS(=O)(=O)N1CCN(CC(=O)NC[C@]2(O)CN3CCC2CC3)CC1 ZINC000566454426 483644228 /nfs/dbraw/zinc/64/42/28/483644228.db2.gz ACEHHIVLGVPKBS-HNNXBMFYSA-N 0 3 360.480 -1.864 20 0 FAADHN CS(=O)(=O)N1CCN(CC(=O)NC[C@@]2(O)CN3CCC2CC3)CC1 ZINC000566454427 483644030 /nfs/dbraw/zinc/64/40/30/483644030.db2.gz ACEHHIVLGVPKBS-OAHLLOKOSA-N 0 3 360.480 -1.864 20 0 FAADHN Cc1ncc(S(N)(=O)=O)cc1C(=O)N[C@@H](C)C(=O)NCCN(C)C ZINC000566463123 483643362 /nfs/dbraw/zinc/64/33/62/483643362.db2.gz UHJHXIOWVBOFPS-JTQLQIEISA-N 0 3 357.436 -1.166 20 0 FAADHN Cc1ncc(S(N)(=O)=O)cc1C(=O)N[C@H](C)C(=O)NCCN(C)C ZINC000566463124 483643958 /nfs/dbraw/zinc/64/39/58/483643958.db2.gz UHJHXIOWVBOFPS-SNVBAGLBSA-N 0 3 357.436 -1.166 20 0 FAADHN CC1(C)NC(=O)N(CCCC(=O)N2CCN3C(=O)[C@H](N)C[C@@H]3C2)C1=O ZINC000566494582 483643923 /nfs/dbraw/zinc/64/39/23/483643923.db2.gz AJJAOVQJFOBXAZ-GHMZBOCLSA-N 0 3 351.407 -1.133 20 0 FAADHN CC1(C)NC(=O)N(CCCC(=O)N2CCN3C(=O)[C@@H](N)C[C@@H]3C2)C1=O ZINC000566494583 483643772 /nfs/dbraw/zinc/64/37/72/483643772.db2.gz AJJAOVQJFOBXAZ-MNOVXSKESA-N 0 3 351.407 -1.133 20 0 FAADHN CC1(C)NC(=O)N(CCCC(=O)N2CCN3C(=O)[C@@H](N)C[C@H]3C2)C1=O ZINC000566494584 483643687 /nfs/dbraw/zinc/64/36/87/483643687.db2.gz AJJAOVQJFOBXAZ-QWRGUYRKSA-N 0 3 351.407 -1.133 20 0 FAADHN CC1(C)NC(=O)N(CCCC(=O)N2CCN3C(=O)[C@H](N)C[C@H]3C2)C1=O ZINC000566494585 483643949 /nfs/dbraw/zinc/64/39/49/483643949.db2.gz AJJAOVQJFOBXAZ-WDEREUQCSA-N 0 3 351.407 -1.133 20 0 FAADHN CC(C)[C@H](C(=O)N1CCN2C(=O)[C@@H](N)C[C@@H]2C1)N1CCCS1(=O)=O ZINC000566496488 483643453 /nfs/dbraw/zinc/64/34/53/483643453.db2.gz RUIKQGLFGLHJRW-FRRDWIJNSA-N 0 3 358.464 -1.183 20 0 FAADHN CC(C)[C@H](C(=O)N1CCN2C(=O)[C@H](N)C[C@@H]2C1)N1CCCS1(=O)=O ZINC000566496489 483643296 /nfs/dbraw/zinc/64/32/96/483643296.db2.gz RUIKQGLFGLHJRW-JHJVBQTASA-N 0 3 358.464 -1.183 20 0 FAADHN CC(C)[C@H](C(=O)N1CCN2C(=O)[C@@H](N)C[C@H]2C1)N1CCCS1(=O)=O ZINC000566496490 483643326 /nfs/dbraw/zinc/64/33/26/483643326.db2.gz RUIKQGLFGLHJRW-RWMBFGLXSA-N 0 3 358.464 -1.183 20 0 FAADHN CC(C)[C@H](C(=O)N1CCN2C(=O)[C@H](N)C[C@H]2C1)N1CCCS1(=O)=O ZINC000566496491 483644002 /nfs/dbraw/zinc/64/40/02/483644002.db2.gz RUIKQGLFGLHJRW-YNEHKIRRSA-N 0 3 358.464 -1.183 20 0 FAADHN CCOC(=O)[C@@H]1CCCN(S(=O)(=O)N2CCN3C(=O)[C@@H](N)C[C@H]3C2)C1 ZINC000566497004 483643466 /nfs/dbraw/zinc/64/34/66/483643466.db2.gz WKAAQSUZDCPAHS-AGIUHOORSA-N 0 3 374.463 -1.250 20 0 FAADHN CCOC(=O)[C@@H]1CCCN(S(=O)(=O)N2CCN3C(=O)[C@H](N)C[C@H]3C2)C1 ZINC000566497008 483643430 /nfs/dbraw/zinc/64/34/30/483643430.db2.gz WKAAQSUZDCPAHS-FRRDWIJNSA-N 0 3 374.463 -1.250 20 0 FAADHN CCOC(=O)[C@@H]1CCCN(S(=O)(=O)N2CCN3C(=O)[C@H](N)C[C@@H]3C2)C1 ZINC000566497010 483643983 /nfs/dbraw/zinc/64/39/83/483643983.db2.gz WKAAQSUZDCPAHS-JHJVBQTASA-N 0 3 374.463 -1.250 20 0 FAADHN CCOC(=O)[C@@H]1CCCN(S(=O)(=O)N2CCN3C(=O)[C@@H](N)C[C@@H]3C2)C1 ZINC000566497011 483643765 /nfs/dbraw/zinc/64/37/65/483643765.db2.gz WKAAQSUZDCPAHS-UPJWGTAASA-N 0 3 374.463 -1.250 20 0 FAADHN COC(=O)c1cncc(S(=O)(=O)N2CCN3C(=O)[C@H](N)C[C@H]3C2)c1 ZINC000566497461 483643735 /nfs/dbraw/zinc/64/37/35/483643735.db2.gz ZRRLUGMIAOGZMZ-CMPLNLGQSA-N 0 3 354.388 -1.199 20 0 FAADHN COC(=O)c1cncc(S(=O)(=O)N2CCN3C(=O)[C@@H](N)C[C@H]3C2)c1 ZINC000566497465 483643837 /nfs/dbraw/zinc/64/38/37/483643837.db2.gz ZRRLUGMIAOGZMZ-JQWIXIFHSA-N 0 3 354.388 -1.199 20 0 FAADHN COC(=O)c1cncc(S(=O)(=O)N2CCN3C(=O)[C@@H](N)C[C@@H]3C2)c1 ZINC000566497467 483643710 /nfs/dbraw/zinc/64/37/10/483643710.db2.gz ZRRLUGMIAOGZMZ-PWSUYJOCSA-N 0 3 354.388 -1.199 20 0 FAADHN COC(=O)c1cncc(S(=O)(=O)N2CCN3C(=O)[C@H](N)C[C@@H]3C2)c1 ZINC000566497469 483643874 /nfs/dbraw/zinc/64/38/74/483643874.db2.gz ZRRLUGMIAOGZMZ-ZYHUDNBSSA-N 0 3 354.388 -1.199 20 0 FAADHN CC(C)(C)c1nnc(NC(=O)C(=O)N2CCN3C(=O)[C@@H](N)C[C@@H]3C2)s1 ZINC000566504271 483759430 /nfs/dbraw/zinc/75/94/30/483759430.db2.gz AVZHIUSRABOMSK-BDAKNGLRSA-N 0 3 366.447 -0.456 20 0 FAADHN CC(C)(C)c1nnc(NC(=O)C(=O)N2CCN3C(=O)[C@H](N)C[C@H]3C2)s1 ZINC000566504273 483759073 /nfs/dbraw/zinc/75/90/73/483759073.db2.gz AVZHIUSRABOMSK-DTWKUNHWSA-N 0 3 366.447 -0.456 20 0 FAADHN CC(C)(C)c1nnc(NC(=O)C(=O)N2CCN3C(=O)[C@@H](N)C[C@H]3C2)s1 ZINC000566504275 483759477 /nfs/dbraw/zinc/75/94/77/483759477.db2.gz AVZHIUSRABOMSK-IUCAKERBSA-N 0 3 366.447 -0.456 20 0 FAADHN CC(C)(C)c1nnc(NC(=O)C(=O)N2CCN3C(=O)[C@H](N)C[C@@H]3C2)s1 ZINC000566504276 483759484 /nfs/dbraw/zinc/75/94/84/483759484.db2.gz AVZHIUSRABOMSK-RKDXNWHRSA-N 0 3 366.447 -0.456 20 0 FAADHN N[C@H]1C[C@@H]2CN(C(=O)C(=O)Nc3ccccc3-n3ccnn3)CCN2C1=O ZINC000566504455 483645209 /nfs/dbraw/zinc/64/52/09/483645209.db2.gz CYSCTYSNPWCPPJ-NEPJUHHUSA-N 0 3 369.385 -1.024 20 0 FAADHN N[C@@H]1C[C@H]2CN(C(=O)C(=O)Nc3ccccc3-n3ccnn3)CCN2C1=O ZINC000566504459 483645520 /nfs/dbraw/zinc/64/55/20/483645520.db2.gz CYSCTYSNPWCPPJ-NWDGAFQWSA-N 0 3 369.385 -1.024 20 0 FAADHN N[C@H]1C[C@H]2CN(C(=O)C(=O)Nc3ccccc3-n3ccnn3)CCN2C1=O ZINC000566504461 483644911 /nfs/dbraw/zinc/64/49/11/483644911.db2.gz CYSCTYSNPWCPPJ-RYUDHWBXSA-N 0 3 369.385 -1.024 20 0 FAADHN N[C@@H]1C[C@@H]2CN(C(=O)C(=O)Nc3ccccc3-n3ccnn3)CCN2C1=O ZINC000566504463 483644688 /nfs/dbraw/zinc/64/46/88/483644688.db2.gz CYSCTYSNPWCPPJ-VXGBXAGGSA-N 0 3 369.385 -1.024 20 0 FAADHN Cc1nc(CCNC(=O)C(=O)N2CCN3C(=O)[C@@H](N)C[C@@H]3C2)cs1 ZINC000566511380 483645411 /nfs/dbraw/zinc/64/54/11/483645411.db2.gz QMOWRZIHWTWHND-NEPJUHHUSA-N 0 3 351.432 -1.119 20 0 FAADHN Cc1nc(CCNC(=O)C(=O)N2CCN3C(=O)[C@H](N)C[C@H]3C2)cs1 ZINC000566511381 483644765 /nfs/dbraw/zinc/64/47/65/483644765.db2.gz QMOWRZIHWTWHND-NWDGAFQWSA-N 0 3 351.432 -1.119 20 0 FAADHN Cc1nc(CCNC(=O)C(=O)N2CCN3C(=O)[C@@H](N)C[C@H]3C2)cs1 ZINC000566511382 483645380 /nfs/dbraw/zinc/64/53/80/483645380.db2.gz QMOWRZIHWTWHND-RYUDHWBXSA-N 0 3 351.432 -1.119 20 0 FAADHN Cc1nc(CCNC(=O)C(=O)N2CCN3C(=O)[C@H](N)C[C@@H]3C2)cs1 ZINC000566511383 483645566 /nfs/dbraw/zinc/64/55/66/483645566.db2.gz QMOWRZIHWTWHND-VXGBXAGGSA-N 0 3 351.432 -1.119 20 0 FAADHN CC(C)(CNC(=O)C(=O)N1CCN2C(=O)[C@H](N)C[C@@H]2C1)N1CCOCC1 ZINC000566511445 483645131 /nfs/dbraw/zinc/64/51/31/483645131.db2.gz SDCNRYSKVWCOJI-CHWSQXEVSA-N 0 3 367.450 -2.016 20 0 FAADHN CC(C)(CNC(=O)C(=O)N1CCN2C(=O)[C@@H](N)C[C@@H]2C1)N1CCOCC1 ZINC000566511446 483644983 /nfs/dbraw/zinc/64/49/83/483644983.db2.gz SDCNRYSKVWCOJI-OLZOCXBDSA-N 0 3 367.450 -2.016 20 0 FAADHN CC(C)(CNC(=O)C(=O)N1CCN2C(=O)[C@H](N)C[C@H]2C1)N1CCOCC1 ZINC000566511447 483645263 /nfs/dbraw/zinc/64/52/63/483645263.db2.gz SDCNRYSKVWCOJI-QWHCGFSZSA-N 0 3 367.450 -2.016 20 0 FAADHN CC(C)(CNC(=O)C(=O)N1CCN2C(=O)[C@@H](N)C[C@H]2C1)N1CCOCC1 ZINC000566511448 483645034 /nfs/dbraw/zinc/64/50/34/483645034.db2.gz SDCNRYSKVWCOJI-STQMWFEESA-N 0 3 367.450 -2.016 20 0 FAADHN N[C@@H]1C[C@H]2CN(C(=O)C(=O)NCCCOC[C@H]3CCCO3)CCN2C1=O ZINC000566511561 483645628 /nfs/dbraw/zinc/64/56/28/483645628.db2.gz VNXDAUJSJLROJY-BFHYXJOUSA-N 0 3 368.434 -1.541 20 0 FAADHN N[C@@H]1C[C@@H]2CN(C(=O)C(=O)NCCCOC[C@@H]3CCCO3)CCN2C1=O ZINC000566511562 483645554 /nfs/dbraw/zinc/64/55/54/483645554.db2.gz VNXDAUJSJLROJY-HZSPNIEDSA-N 0 3 368.434 -1.541 20 0 FAADHN N[C@@H]1C[C@H]2CN(C(=O)C(=O)NCCCOC[C@@H]3CCCO3)CCN2C1=O ZINC000566511563 483645078 /nfs/dbraw/zinc/64/50/78/483645078.db2.gz VNXDAUJSJLROJY-MELADBBJSA-N 0 3 368.434 -1.541 20 0 FAADHN N[C@@H]1C[C@@H]2CN(C(=O)C(=O)NCCCOC[C@H]3CCCO3)CCN2C1=O ZINC000566511564 483645724 /nfs/dbraw/zinc/64/57/24/483645724.db2.gz VNXDAUJSJLROJY-MGPQQGTHSA-N 0 3 368.434 -1.541 20 0 FAADHN COCCNCCNC(=O)[C@@H](C)NS(=O)(=O)c1ccc(C(N)=O)cc1 ZINC000566620878 483645103 /nfs/dbraw/zinc/64/51/03/483645103.db2.gz DHVUMTCOJCUTGV-LLVKDONJSA-N 0 3 372.447 -1.196 20 0 FAADHN COCCNCCNC(=O)[C@H](C)NS(=O)(=O)c1ccc(C(N)=O)cc1 ZINC000566620879 483645471 /nfs/dbraw/zinc/64/54/71/483645471.db2.gz DHVUMTCOJCUTGV-NSHDSACASA-N 0 3 372.447 -1.196 20 0 FAADHN CNS(=O)(=O)NCC(=O)NCc1cccc(C(=O)NCCN(C)C)c1 ZINC000566627064 483645509 /nfs/dbraw/zinc/64/55/09/483645509.db2.gz DMGRREIWDCSSPV-UHFFFAOYSA-N 0 3 371.463 -1.352 20 0 FAADHN O=C(NC[C@]1(O)CN2CCC1CC2)[C@@H]1CC[C@H](C(=O)N2CCOCC2)O1 ZINC000566628415 483645675 /nfs/dbraw/zinc/64/56/75/483645675.db2.gz FGOAHAUTNRWMBN-DAYGRLMNSA-N 0 3 367.446 -1.034 20 0 FAADHN O=C(NC[C@@]1(O)CN2CCC1CC2)[C@@H]1CC[C@H](C(=O)N2CCOCC2)O1 ZINC000566628418 483644929 /nfs/dbraw/zinc/64/49/29/483644929.db2.gz FGOAHAUTNRWMBN-HDMKZQKVSA-N 0 3 367.446 -1.034 20 0 FAADHN COCC(=O)N1CCN(C(=O)C(=O)N(CCN(C)C)CCN(C)C)CC1 ZINC000566724307 483645154 /nfs/dbraw/zinc/64/51/54/483645154.db2.gz PEBKQGMHYJWEPY-UHFFFAOYSA-N 0 3 371.482 -1.745 20 0 FAADHN C[C@H]1C[C@H](C)CN(C(=O)CN2CCN(C(=O)C(=O)NC3CNC3)CC2)C1 ZINC000566728816 483644541 /nfs/dbraw/zinc/64/45/41/483644541.db2.gz XKBBCIKFBAGACU-KBPBESRZSA-N 0 3 365.478 -1.277 20 0 FAADHN C[C@@H]1C[C@H](C)CN(C(=O)CN2CCN(C(=O)C(=O)NC3CNC3)CC2)C1 ZINC000566728817 483645771 /nfs/dbraw/zinc/64/57/71/483645771.db2.gz XKBBCIKFBAGACU-OKILXGFUSA-N 0 3 365.478 -1.277 20 0 FAADHN C[C@@H]1C[C@@H](C)CN(C(=O)CN2CCN(C(=O)C(=O)NC3CNC3)CC2)C1 ZINC000566728818 483644594 /nfs/dbraw/zinc/64/45/94/483644594.db2.gz XKBBCIKFBAGACU-ZIAGYGMSSA-N 0 3 365.478 -1.277 20 0 FAADHN CN(C)CCN1C[C@H](C(=O)NCCOCCS(N)(=O)=O)CC1=O ZINC000566758860 483645608 /nfs/dbraw/zinc/64/56/08/483645608.db2.gz OVZZZZJNRXUUHD-LLVKDONJSA-N 0 3 350.441 -2.182 20 0 FAADHN CN(C)CCN1C[C@@H](C(=O)NCCOCCS(N)(=O)=O)CC1=O ZINC000566758863 483644948 /nfs/dbraw/zinc/64/49/48/483644948.db2.gz OVZZZZJNRXUUHD-NSHDSACASA-N 0 3 350.441 -2.182 20 0 FAADHN CN1CCN(C(=O)C(=O)N2CCN(C3CCOCC3)CC2)[C@@H](CN)C1 ZINC000566791210 483644622 /nfs/dbraw/zinc/64/46/22/483644622.db2.gz HDCPFNKCIUAFJW-HNNXBMFYSA-N 0 3 353.467 -1.589 20 0 FAADHN CN1CCN(C(=O)C(=O)N2CCN(C3CCOCC3)CC2)[C@H](CN)C1 ZINC000566791211 483645703 /nfs/dbraw/zinc/64/57/03/483645703.db2.gz HDCPFNKCIUAFJW-OAHLLOKOSA-N 0 3 353.467 -1.589 20 0 FAADHN Cc1nn(CCN(C)C)c(C)c1S(=O)(=O)N[C@@]1(C(N)=O)CCOC1 ZINC000566807671 482698393 /nfs/dbraw/zinc/69/83/93/482698393.db2.gz SQFGQCURGIFBED-AWEZNQCLSA-N 0 3 359.452 -1.016 20 0 FAADHN Cc1nn(CCN(C)C)c(C)c1S(=O)(=O)N[C@]1(C(N)=O)CCOC1 ZINC000566807674 482697202 /nfs/dbraw/zinc/69/72/02/482697202.db2.gz SQFGQCURGIFBED-CQSZACIVSA-N 0 3 359.452 -1.016 20 0 FAADHN N[C@@H]1C[C@@H]2CN(C(=O)C(=O)N[C@@H]3[C@H]4CCO[C@H]4C34CCC4)CCN2C1=O ZINC000566808675 483646931 /nfs/dbraw/zinc/64/69/31/483646931.db2.gz WYXWODCKANFLEV-DHGKCCLASA-N 0 3 362.430 -1.169 20 0 FAADHN N[C@@H]1C[C@@H]2CN(C(=O)C(=O)N[C@@H]3[C@@H]4CCO[C@@H]4C34CCC4)CCN2C1=O ZINC000566808676 483646362 /nfs/dbraw/zinc/64/63/62/483646362.db2.gz WYXWODCKANFLEV-ITGHMWBKSA-N 0 3 362.430 -1.169 20 0 FAADHN N[C@@H]1C[C@@H]2CN(C(=O)C(=O)N[C@@H]3[C@H]4CCO[C@@H]4C34CCC4)CCN2C1=O 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FAADHN Nc1nc(C(=O)NC[C@]2(O)CN3CCC2CC3)nc(N2CCOCC2)n1 ZINC000570938984 483782126 /nfs/dbraw/zinc/78/21/26/483782126.db2.gz AVAUMLSPHGISAD-INIZCTEOSA-N 0 3 363.422 -1.523 20 0 FAADHN Nc1nc(C(=O)NC[C@@]2(O)CN3CCC2CC3)nc(N2CCOCC2)n1 ZINC000570938985 483782096 /nfs/dbraw/zinc/78/20/96/483782096.db2.gz AVAUMLSPHGISAD-MRXNPFEDSA-N 0 3 363.422 -1.523 20 0 FAADHN N[C@@H]1C[C@@H]2CN(S(=O)(=O)c3cccc(S(N)(=O)=O)c3)CCN2C1=O ZINC000570941991 482734938 /nfs/dbraw/zinc/73/49/38/482734938.db2.gz FZQQPYKKXUNMPF-BXKDBHETSA-N 0 3 374.444 -1.734 20 0 FAADHN N[C@H]1C[C@H]2CN(S(=O)(=O)c3cccc(S(N)(=O)=O)c3)CCN2C1=O ZINC000570941992 482734581 /nfs/dbraw/zinc/73/45/81/482734581.db2.gz FZQQPYKKXUNMPF-CABZTGNLSA-N 0 3 374.444 -1.734 20 0 FAADHN N[C@@H]1C[C@H]2CN(S(=O)(=O)c3cccc(S(N)(=O)=O)c3)CCN2C1=O ZINC000570941993 482734203 /nfs/dbraw/zinc/73/42/03/482734203.db2.gz FZQQPYKKXUNMPF-JOYOIKCWSA-N 0 3 374.444 -1.734 20 0 FAADHN N[C@H]1C[C@@H]2CN(S(=O)(=O)c3cccc(S(N)(=O)=O)c3)CCN2C1=O ZINC000570941994 482733817 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CCOC(=O)Cn1cnc(NC(=O)C(=O)NCCN2CC[C@@H](C)C2)n1 ZINC000591872853 483772713 /nfs/dbraw/zinc/77/27/13/483772713.db2.gz UIRLBNBHZRYHNC-LLVKDONJSA-N 0 3 352.395 -0.762 20 0 FAADHN CCOC(=O)Cn1cnc(NC(=O)C(=O)NCCN2CC[C@H](C)C2)n1 ZINC000591872854 483772522 /nfs/dbraw/zinc/77/25/22/483772522.db2.gz UIRLBNBHZRYHNC-NSHDSACASA-N 0 3 352.395 -0.762 20 0 FAADHN CCOC(=O)Cn1cnc(NC(=O)C(=O)N2CC[C@@H]3CN(C)C[C@H]32)n1 ZINC000591874291 483772209 /nfs/dbraw/zinc/77/22/09/483772209.db2.gz BBDYNBRBLJZIOD-GHMZBOCLSA-N 0 3 350.379 -1.058 20 0 FAADHN CCOC(=O)Cn1cnc(NC(=O)C(=O)N2CC[C@@H]3CN(C)C[C@@H]32)n1 ZINC000591874292 483771800 /nfs/dbraw/zinc/77/18/00/483771800.db2.gz BBDYNBRBLJZIOD-MNOVXSKESA-N 0 3 350.379 -1.058 20 0 FAADHN CCOC(=O)Cn1cnc(NC(=O)C(=O)N2CC[C@H]3CN(C)C[C@@H]32)n1 ZINC000591874293 483771851 /nfs/dbraw/zinc/77/18/51/483771851.db2.gz BBDYNBRBLJZIOD-QWRGUYRKSA-N 0 3 350.379 -1.058 20 0 FAADHN CCOC(=O)Cn1cnc(NC(=O)C(=O)N2CC[C@H]3CN(C)C[C@H]32)n1 ZINC000591874294 483771986 /nfs/dbraw/zinc/77/19/86/483771986.db2.gz BBDYNBRBLJZIOD-WDEREUQCSA-N 0 3 350.379 -1.058 20 0 FAADHN COC(=O)C[C@H](N)C(=O)NCCCN1CCN(c2ncccn2)CC1 ZINC000591973840 482804088 /nfs/dbraw/zinc/80/40/88/482804088.db2.gz ZDPQNCJAFDEAPT-ZDUSSCGKSA-N 0 3 350.423 -1.005 20 0 FAADHN COC(=O)c1cn(CCNC(=O)N2CN(CCN(C)C)C(=O)[C@H]2C)nn1 ZINC000591990058 482804450 /nfs/dbraw/zinc/80/44/50/482804450.db2.gz RJCJIWWWXGTLID-LLVKDONJSA-N 0 3 367.410 -1.174 20 0 FAADHN COC(=O)c1cn(CCNC(=O)N2CN(CCN(C)C)C(=O)[C@@H]2C)nn1 ZINC000591990059 482804949 /nfs/dbraw/zinc/80/49/49/482804949.db2.gz RJCJIWWWXGTLID-NSHDSACASA-N 0 3 367.410 -1.174 20 0 FAADHN COC(=O)[C@@H]1C[C@@H](O)CN(c2nc(NCCO)nc(NC(C)C)n2)C1 ZINC000591997742 482804525 /nfs/dbraw/zinc/80/45/25/482804525.db2.gz CTRNPTMWHNHOFF-GHMZBOCLSA-N 0 3 354.411 -1.700 20 0 FAADHN COC(=O)[C@@H]1C[C@H](O)CN(c2nc(NCCO)nc(NC(C)C)n2)C1 ZINC000591997749 482804072 /nfs/dbraw/zinc/80/40/72/482804072.db2.gz CTRNPTMWHNHOFF-MNOVXSKESA-N 0 3 354.411 -1.700 20 0 FAADHN COC(=O)[C@H]1C[C@H](O)CN(c2nc(NCCO)nc(NC(C)C)n2)C1 ZINC000591997751 482804721 /nfs/dbraw/zinc/80/47/21/482804721.db2.gz CTRNPTMWHNHOFF-QWRGUYRKSA-N 0 3 354.411 -1.700 20 0 FAADHN COC(=O)[C@H]1C[C@@H](O)CN(c2nc(NCCO)nc(NC(C)C)n2)C1 ZINC000591997753 482804784 /nfs/dbraw/zinc/80/47/84/482804784.db2.gz CTRNPTMWHNHOFF-WDEREUQCSA-N 0 3 354.411 -1.700 20 0 FAADHN COC(=O)Cn1cc(S(=O)(=O)N2CN(CCN(C)C)C(=O)[C@H]2C)cn1 ZINC000592081979 482807083 /nfs/dbraw/zinc/80/70/83/482807083.db2.gz GKUJXXDVXQKZKW-LLVKDONJSA-N 0 3 373.435 -1.203 20 0 FAADHN COC(=O)Cn1cc(S(=O)(=O)N2CN(CCN(C)C)C(=O)[C@@H]2C)cn1 ZINC000592081980 482805741 /nfs/dbraw/zinc/80/57/41/482805741.db2.gz GKUJXXDVXQKZKW-NSHDSACASA-N 0 3 373.435 -1.203 20 0 FAADHN COC(=O)CCN(C)S(=O)(=O)N1CN(CCN(C)C)C(=O)[C@H]1C ZINC000592082265 482806054 /nfs/dbraw/zinc/80/60/54/482806054.db2.gz JKJGUXBQYFGYSG-LLVKDONJSA-N 0 3 350.441 -1.222 20 0 FAADHN COC(=O)CCN(C)S(=O)(=O)N1CN(CCN(C)C)C(=O)[C@@H]1C ZINC000592082266 482807044 /nfs/dbraw/zinc/80/70/44/482807044.db2.gz JKJGUXBQYFGYSG-NSHDSACASA-N 0 3 350.441 -1.222 20 0 FAADHN COCCN1CCC[C@@H](NC(=O)CNS(=O)(=O)c2cnn(C)c2)C1 ZINC000592095138 482805997 /nfs/dbraw/zinc/80/59/97/482805997.db2.gz IWIIKTNJAJKHIG-GFCCVEGCSA-N 0 3 359.452 -1.075 20 0 FAADHN COCCN1CCC[C@H](NC(=O)CNS(=O)(=O)c2cnn(C)c2)C1 ZINC000592095139 482805886 /nfs/dbraw/zinc/80/58/86/482805886.db2.gz IWIIKTNJAJKHIG-LBPRGKRZSA-N 0 3 359.452 -1.075 20 0 FAADHN COC(=O)[C@@H]1C[C@H](O)CN(C[C@@H](O)CN2C[C@@H](O)C[C@H](C(=O)OC)C2)C1 ZINC000592203805 482807758 /nfs/dbraw/zinc/80/77/58/482807758.db2.gz HPOWBKXSMVAXEY-AICCOOGYSA-N 0 3 374.434 -1.941 20 0 FAADHN COC(=O)[C@@H]1C[C@H](O)CN(C[C@@H](O)CN2C[C@H](O)C[C@H](C(=O)OC)C2)C1 ZINC000592203810 482807629 /nfs/dbraw/zinc/80/76/29/482807629.db2.gz HPOWBKXSMVAXEY-AZOBVAEKSA-N 0 3 374.434 -1.941 20 0 FAADHN COC(=O)[C@@H]1C[C@H](O)CN(CC(O)CN2C[C@H](C(=O)OC)C[C@H](O)C2)C1 ZINC000592203812 482808769 /nfs/dbraw/zinc/80/87/69/482808769.db2.gz 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COC(=O)[C@H]1C[C@@H](O)CN(C(=O)C(=O)Nc2cnn(CCN(C)C)c2)C1 ZINC000592324257 482810056 /nfs/dbraw/zinc/81/00/56/482810056.db2.gz ANBBZLYKAGFVIX-WCQYABFASA-N 0 3 367.406 -1.234 20 0 FAADHN COC(=O)[C@@H]1C[C@H](O)CN(C(=O)C(=O)Nc2cnn(CCN(C)C)c2)C1 ZINC000592324258 482810564 /nfs/dbraw/zinc/81/05/64/482810564.db2.gz ANBBZLYKAGFVIX-YPMHNXCESA-N 0 3 367.406 -1.234 20 0 FAADHN COC(=O)[C@@H]1C[C@H](O)CN(C(=O)C(=O)Nc2ccn(CCN(C)C)n2)C1 ZINC000592333362 483766091 /nfs/dbraw/zinc/76/60/91/483766091.db2.gz ZOWDOMZFBVWCHW-NEPJUHHUSA-N 0 3 367.406 -1.234 20 0 FAADHN COC(=O)[C@H]1C[C@@H](O)CN(C(=O)C(=O)Nc2ccn(CCN(C)C)n2)C1 ZINC000592333370 483766808 /nfs/dbraw/zinc/76/68/08/483766808.db2.gz ZOWDOMZFBVWCHW-NWDGAFQWSA-N 0 3 367.406 -1.234 20 0 FAADHN COC(=O)[C@H]1C[C@H](O)CN(C(=O)C(=O)Nc2ccn(CCN(C)C)n2)C1 ZINC000592333371 483766517 /nfs/dbraw/zinc/76/65/17/483766517.db2.gz ZOWDOMZFBVWCHW-RYUDHWBXSA-N 0 3 367.406 -1.234 20 0 FAADHN COC(=O)[C@@H]1C[C@@H](O)CN(C(=O)C(=O)Nc2ccn(CCN(C)C)n2)C1 ZINC000592333372 483766066 /nfs/dbraw/zinc/76/60/66/483766066.db2.gz ZOWDOMZFBVWCHW-VXGBXAGGSA-N 0 3 367.406 -1.234 20 0 FAADHN COC(=O)C1CCN(S(=O)(=O)N2CCCNC[C@@H]2C(=O)OC)CC1 ZINC000592387979 482810592 /nfs/dbraw/zinc/81/05/92/482810592.db2.gz DKCASFAACCMBMV-GFCCVEGCSA-N 0 3 363.436 -1.047 20 0 FAADHN COC(=O)C1CCN(S(=O)(=O)N2CCCNC[C@H]2C(=O)OC)CC1 ZINC000592387980 482809914 /nfs/dbraw/zinc/80/99/14/482809914.db2.gz DKCASFAACCMBMV-LBPRGKRZSA-N 0 3 363.436 -1.047 20 0 FAADHN COCCN(CCOC)S(=O)(=O)N1CCCNC[C@@H]1C(=O)OC ZINC000592388372 482810279 /nfs/dbraw/zinc/81/02/79/482810279.db2.gz FWYRBUGSTWCWCX-GFCCVEGCSA-N 0 3 353.441 -1.337 20 0 FAADHN COCCN(CCOC)S(=O)(=O)N1CCCNC[C@H]1C(=O)OC ZINC000592388374 482810388 /nfs/dbraw/zinc/81/03/88/482810388.db2.gz FWYRBUGSTWCWCX-LBPRGKRZSA-N 0 3 353.441 -1.337 20 0 FAADHN COC(=O)[C@H]1CNCCCN1CC(=O)c1c(N)n(C)c(=O)n(C)c1=O ZINC000592487067 482811774 /nfs/dbraw/zinc/81/17/74/482811774.db2.gz ADLFCEBJPNKGAR-SECBINFHSA-N 0 3 353.379 -2.314 20 0 FAADHN COC(=O)[C@@H]1CNCCCN1CC(=O)c1c(N)n(C)c(=O)n(C)c1=O ZINC000592487070 482811595 /nfs/dbraw/zinc/81/15/95/482811595.db2.gz ADLFCEBJPNKGAR-VIFPVBQESA-N 0 3 353.379 -2.314 20 0 FAADHN COC(=O)[C@@H]1CNCCCN1CC(=O)N1CCN(c2cnccn2)CC1 ZINC000592488186 482811812 /nfs/dbraw/zinc/81/18/12/482811812.db2.gz JGMJZYFCWNJBKZ-AWEZNQCLSA-N 0 3 362.434 -1.038 20 0 FAADHN COC(=O)[C@H]1CNCCCN1CC(=O)N1CCN(c2cnccn2)CC1 ZINC000592488187 482811734 /nfs/dbraw/zinc/81/17/34/482811734.db2.gz JGMJZYFCWNJBKZ-CQSZACIVSA-N 0 3 362.434 -1.038 20 0 FAADHN COC(=O)[C@@H]1CNCCCN1CC(=O)N1CCN(C(=O)C2CC2)CC1 ZINC000592488905 482812131 /nfs/dbraw/zinc/81/21/31/482812131.db2.gz NMARBMCYQRJDQT-AWEZNQCLSA-N 0 3 352.435 -1.096 20 0 FAADHN COC(=O)[C@H]1CNCCCN1CC(=O)N1CCN(C(=O)C2CC2)CC1 ZINC000592488906 482812084 /nfs/dbraw/zinc/81/20/84/482812084.db2.gz NMARBMCYQRJDQT-CQSZACIVSA-N 0 3 352.435 -1.096 20 0 FAADHN COC(=O)[C@H]1CNCCCN1CCn1cnc2c1c(=O)n(C)c(=O)n2C ZINC000592489972 482811394 /nfs/dbraw/zinc/81/13/94/482811394.db2.gz 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ZINC000592491532 482812288 /nfs/dbraw/zinc/81/22/88/482812288.db2.gz LZDCMOCREDNGKI-QWHCGFSZSA-N 0 3 361.464 -1.141 20 0 FAADHN CCN(C(=O)CN1CCCNC[C@H]1C(=O)OC)[C@H]1CCS(=O)(=O)C1 ZINC000592491533 482812242 /nfs/dbraw/zinc/81/22/42/482812242.db2.gz LZDCMOCREDNGKI-STQMWFEESA-N 0 3 361.464 -1.141 20 0 FAADHN CC(C)NC(=O)CN1CCN([C@H]2CC(=O)N(CCN(C)C)C2=O)CC1 ZINC000592825116 482813258 /nfs/dbraw/zinc/81/32/58/482813258.db2.gz PWIIIPKGYNHJMB-AWEZNQCLSA-N 0 3 353.467 -1.182 20 0 FAADHN CC(C)NC(=O)CN1CCN([C@@H]2CC(=O)N(CCN(C)C)C2=O)CC1 ZINC000592825117 482812959 /nfs/dbraw/zinc/81/29/59/482812959.db2.gz PWIIIPKGYNHJMB-CQSZACIVSA-N 0 3 353.467 -1.182 20 0 FAADHN CN(C)CCN1C(=O)C[C@@H](N2CCN(S(=O)(=O)N(C)C)CC2)C1=O ZINC000592825477 482814001 /nfs/dbraw/zinc/81/40/01/482814001.db2.gz ZYLRZKYMKVSYAQ-GFCCVEGCSA-N 0 3 361.468 -1.901 20 0 FAADHN CN(C)CCN1C(=O)C[C@H](N2CCN(S(=O)(=O)N(C)C)CC2)C1=O ZINC000592825478 482813855 /nfs/dbraw/zinc/81/38/55/482813855.db2.gz ZYLRZKYMKVSYAQ-LBPRGKRZSA-N 0 3 361.468 -1.901 20 0 FAADHN COC(=O)[C@@H]1CNCCCN1CC(=O)N1CCN(CC(=O)N(C)C)CC1 ZINC000592982601 482814915 /nfs/dbraw/zinc/81/49/15/482814915.db2.gz LEIZGAIANHLYRT-AWEZNQCLSA-N 0 3 369.466 -1.944 20 0 FAADHN COC(=O)[C@H]1CNCCCN1CC(=O)N1CCN(CC(=O)N(C)C)CC1 ZINC000592982618 482815204 /nfs/dbraw/zinc/81/52/04/482815204.db2.gz LEIZGAIANHLYRT-CQSZACIVSA-N 0 3 369.466 -1.944 20 0 FAADHN COC(=O)c1ccc(NC(=O)N2CCN(CCN(C)C)C(=O)C2)nn1 ZINC000593205413 483766632 /nfs/dbraw/zinc/76/66/32/483766632.db2.gz NQSKVOQVTXILLN-UHFFFAOYSA-N 0 3 350.379 -0.499 20 0 FAADHN CCOC(=O)Cn1cnc(NC(=O)N2CCN(CCN(C)C)C(=O)C2)n1 ZINC000593225775 483772539 /nfs/dbraw/zinc/77/25/39/483772539.db2.gz YZMMCYCDBKTYRN-UHFFFAOYSA-N 0 3 367.410 -0.921 20 0 FAADHN COC(=O)c1cn(CCNC(=O)N2CCN(CCN(C)C)C(=O)C2)nn1 ZINC000593403528 482817222 /nfs/dbraw/zinc/81/72/22/482817222.db2.gz VRKMVJMNTYYDHN-UHFFFAOYSA-N 0 3 367.410 -1.520 20 0 FAADHN COC(=O)c1coc(CNc2nc(NCCO)nc(NC(C)C)n2)n1 ZINC000593502317 482816414 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ZINC000595980736 482835505 /nfs/dbraw/zinc/83/55/05/482835505.db2.gz JSZWUXHIOXRYOX-QWRGUYRKSA-N 0 3 359.377 -1.834 20 0 FAADHN N[C@@H]1C[C@H]2CN(C(=O)C(=O)N3CCN(CC(F)F)CC3)CCN2C1=O ZINC000595980737 482835495 /nfs/dbraw/zinc/83/54/95/482835495.db2.gz JSZWUXHIOXRYOX-WDEREUQCSA-N 0 3 359.377 -1.834 20 0 FAADHN N[C@@H]1C[C@H]2CN(C(=O)C(=O)N3CCC[C@H](OC(F)F)C3)CCN2C1=O ZINC000595980750 482835812 /nfs/dbraw/zinc/83/58/12/482835812.db2.gz JVAYKZKSNWDUBO-GARJFASQSA-N 0 3 360.361 -1.013 20 0 FAADHN N[C@@H]1C[C@@H]2CN(C(=O)C(=O)N3CCC[C@@H](OC(F)F)C3)CCN2C1=O ZINC000595980751 482835606 /nfs/dbraw/zinc/83/56/06/482835606.db2.gz JVAYKZKSNWDUBO-GMTAPVOTSA-N 0 3 360.361 -1.013 20 0 FAADHN N[C@@H]1C[C@H]2CN(C(=O)C(=O)N3CCC[C@@H](OC(F)F)C3)CCN2C1=O ZINC000595980752 482835352 /nfs/dbraw/zinc/83/53/52/482835352.db2.gz JVAYKZKSNWDUBO-HBNTYKKESA-N 0 3 360.361 -1.013 20 0 FAADHN N[C@@H]1C[C@@H]2CN(C(=O)C(=O)N3CCC[C@H](OC(F)F)C3)CCN2C1=O ZINC000595980753 482835473 /nfs/dbraw/zinc/83/54/73/482835473.db2.gz 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CC(C)CN1CCN(C(=O)C(=O)N2CCN3C(=O)[C@@H](N)C[C@@H]3C2)CC1=O ZINC000595980842 482836041 /nfs/dbraw/zinc/83/60/41/482836041.db2.gz LMRQHKOBWAWJMV-OLZOCXBDSA-N 0 3 365.434 -1.916 20 0 FAADHN CC(C)CN1CCN(C(=O)C(=O)N2CCN3C(=O)[C@H](N)C[C@H]3C2)CC1=O ZINC000595980843 482834988 /nfs/dbraw/zinc/83/49/88/482834988.db2.gz LMRQHKOBWAWJMV-QWHCGFSZSA-N 0 3 365.434 -1.916 20 0 FAADHN CC(C)CN1CCN(C(=O)C(=O)N2CCN3C(=O)[C@@H](N)C[C@H]3C2)CC1=O ZINC000595980844 482835105 /nfs/dbraw/zinc/83/51/05/482835105.db2.gz LMRQHKOBWAWJMV-STQMWFEESA-N 0 3 365.434 -1.916 20 0 FAADHN N[C@@H]1C[C@H]2CN(C(=O)C(=O)N3CC[C@@H](Nc4ncccn4)C3)CCN2C1=O ZINC000595981182 482836078 /nfs/dbraw/zinc/83/60/78/482836078.db2.gz AGIOJLCOVDPIGR-FRRDWIJNSA-N 0 3 373.417 -1.740 20 0 FAADHN N[C@@H]1C[C@@H]2CN(C(=O)C(=O)N3CC[C@@H](Nc4ncccn4)C3)CCN2C1=O ZINC000595981183 482835153 /nfs/dbraw/zinc/83/51/53/482835153.db2.gz AGIOJLCOVDPIGR-JHJVBQTASA-N 0 3 373.417 -1.740 20 0 FAADHN N[C@@H]1C[C@H]2CN(C(=O)C(=O)N3CC[C@H](Nc4ncccn4)C3)CCN2C1=O 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ZINC000649073237 483561678 /nfs/dbraw/zinc/56/16/78/483561678.db2.gz RKPPJKHFGCBJMA-JTQLQIEISA-N 0 3 355.420 -1.079 20 0 FAADHN C[C@@H]1C(=O)N(CCN(C)C)CN1C(=O)c1ccc(S(N)(=O)=O)cn1 ZINC000649073238 483562157 /nfs/dbraw/zinc/56/21/57/483562157.db2.gz RKPPJKHFGCBJMA-SNVBAGLBSA-N 0 3 355.420 -1.079 20 0 FAADHN CCOCCS(=O)(=O)NCC(=O)N1CN(CCN(C)C)C(=O)[C@H]1C ZINC000649074813 483561122 /nfs/dbraw/zinc/56/11/22/483561122.db2.gz QBGYAWSDLVKBBS-GFCCVEGCSA-N 0 3 364.468 -1.479 20 0 FAADHN CCOCCS(=O)(=O)NCC(=O)N1CN(CCN(C)C)C(=O)[C@@H]1C ZINC000649074814 483561914 /nfs/dbraw/zinc/56/19/14/483561914.db2.gz QBGYAWSDLVKBBS-LBPRGKRZSA-N 0 3 364.468 -1.479 20 0 FAADHN C[C@@H]1C(=O)N(CCN(C)C)CN1C(=O)CNS(=O)(=O)c1cn(C)cn1 ZINC000649074891 483561900 /nfs/dbraw/zinc/56/19/00/483561900.db2.gz RNMIEVKREBIIDW-LLVKDONJSA-N 0 3 372.451 -1.723 20 0 FAADHN C[C@H]1C(=O)N(CCN(C)C)CN1C(=O)CNS(=O)(=O)c1cn(C)cn1 ZINC000649074892 483562168 /nfs/dbraw/zinc/56/21/68/483562168.db2.gz RNMIEVKREBIIDW-NSHDSACASA-N 0 3 372.451 -1.723 20 0 FAADHN CC(=O)NCCNC(=O)CCC(=O)N1CN(CCN(C)C)C(=O)[C@H]1C ZINC000649075345 483561758 /nfs/dbraw/zinc/56/17/58/483561758.db2.gz BIZJSJDSSHZMIO-GFCCVEGCSA-N 0 3 355.439 -1.403 20 0 FAADHN CC(=O)NCCNC(=O)CCC(=O)N1CN(CCN(C)C)C(=O)[C@@H]1C ZINC000649075346 483561259 /nfs/dbraw/zinc/56/12/59/483561259.db2.gz BIZJSJDSSHZMIO-LBPRGKRZSA-N 0 3 355.439 -1.403 20 0 FAADHN CC(=O)NCC(=O)N1CCC[C@@H]1C(=O)N1CN(CCN(C)C)C(=O)[C@@H]1C ZINC000649075395 483560998 /nfs/dbraw/zinc/56/09/98/483560998.db2.gz CCXVYFSTFAORRU-GXTWGEPZSA-N 0 3 367.450 -1.308 20 0 FAADHN CC(=O)NCC(=O)N1CCC[C@H]1C(=O)N1CN(CCN(C)C)C(=O)[C@@H]1C ZINC000649075396 483561314 /nfs/dbraw/zinc/56/13/14/483561314.db2.gz CCXVYFSTFAORRU-JSGCOSHPSA-N 0 3 367.450 -1.308 20 0 FAADHN CC(=O)NCC(=O)N1CCC[C@H]1C(=O)N1CN(CCN(C)C)C(=O)[C@H]1C ZINC000649075397 483561387 /nfs/dbraw/zinc/56/13/87/483561387.db2.gz CCXVYFSTFAORRU-OCCSQVGLSA-N 0 3 367.450 -1.308 20 0 FAADHN CC(=O)NCC(=O)N1CCC[C@@H]1C(=O)N1CN(CCN(C)C)C(=O)[C@H]1C ZINC000649075398 483563303 /nfs/dbraw/zinc/56/33/03/483563303.db2.gz CCXVYFSTFAORRU-TZMCWYRMSA-N 0 3 367.450 -1.308 20 0 FAADHN C[C@@H]1C(=O)N(CCN(C)C)CN1C(=O)CCn1cc(S(N)(=O)=O)cn1 ZINC000649076437 483562935 /nfs/dbraw/zinc/56/29/35/483562935.db2.gz YGHPCBWHQYDFLI-LLVKDONJSA-N 0 3 372.451 -1.501 20 0 FAADHN C[C@H]1C(=O)N(CCN(C)C)CN1C(=O)CCn1cc(S(N)(=O)=O)cn1 ZINC000649076438 483563420 /nfs/dbraw/zinc/56/34/20/483563420.db2.gz YGHPCBWHQYDFLI-NSHDSACASA-N 0 3 372.451 -1.501 20 0 FAADHN C[C@H]1C(=O)N(CCN(C)C)CN1C(=O)Cn1cc(S(N)(=O)=O)cn1 ZINC000649076750 483562426 /nfs/dbraw/zinc/56/24/26/483562426.db2.gz CHWPDJJOIXNIAX-JTQLQIEISA-N 0 3 358.424 -1.891 20 0 FAADHN C[C@@H]1C(=O)N(CCN(C)C)CN1C(=O)Cn1cc(S(N)(=O)=O)cn1 ZINC000649076751 483563130 /nfs/dbraw/zinc/56/31/30/483563130.db2.gz CHWPDJJOIXNIAX-SNVBAGLBSA-N 0 3 358.424 -1.891 20 0 FAADHN CCN1CCN(CC(=O)N2CN(CCN(C)C)C(=O)[C@H]2C)C(=O)C1=O ZINC000649077686 483563673 /nfs/dbraw/zinc/56/36/73/483563673.db2.gz XTLHPRWAXUSHOB-GFCCVEGCSA-N 0 3 353.423 -1.745 20 0 FAADHN CCN1CCN(CC(=O)N2CN(CCN(C)C)C(=O)[C@@H]2C)C(=O)C1=O ZINC000649077687 483562871 /nfs/dbraw/zinc/56/28/71/483562871.db2.gz XTLHPRWAXUSHOB-LBPRGKRZSA-N 0 3 353.423 -1.745 20 0 FAADHN C[C@@H]1C(=O)N(CCN(C)C)CN1C(=O)c1cn(CC(=O)N(C)C)nn1 ZINC000649077820 483563501 /nfs/dbraw/zinc/56/35/01/483563501.db2.gz ZXBSOMDALUUYCQ-LLVKDONJSA-N 0 3 351.411 -1.442 20 0 FAADHN C[C@H]1C(=O)N(CCN(C)C)CN1C(=O)c1cn(CC(=O)N(C)C)nn1 ZINC000649077821 483562780 /nfs/dbraw/zinc/56/27/80/483562780.db2.gz ZXBSOMDALUUYCQ-NSHDSACASA-N 0 3 351.411 -1.442 20 0 FAADHN C[C@H]1C(=O)N(CCN(C)C)CN1C(=O)c1cc(S(N)(=O)=O)cn1C ZINC000649078430 483562988 /nfs/dbraw/zinc/56/29/88/483562988.db2.gz JERWYJKARZOOOV-JTQLQIEISA-N 0 3 357.436 -1.136 20 0 FAADHN C[C@@H]1C(=O)N(CCN(C)C)CN1C(=O)c1cc(S(N)(=O)=O)cn1C ZINC000649078431 483563384 /nfs/dbraw/zinc/56/33/84/483563384.db2.gz JERWYJKARZOOOV-SNVBAGLBSA-N 0 3 357.436 -1.136 20 0 FAADHN C[C@@H]1C(=O)N(CCN(C)C)CN1C(=O)Cn1cnc2c(cnn2C)c1=O ZINC000649078662 483562921 /nfs/dbraw/zinc/56/29/21/483562921.db2.gz NTCKWVCVVVVSCO-LLVKDONJSA-N 0 3 361.406 -1.292 20 0 FAADHN C[C@H]1C(=O)N(CCN(C)C)CN1C(=O)Cn1cnc2c(cnn2C)c1=O ZINC000649078663 483563603 /nfs/dbraw/zinc/56/36/03/483563603.db2.gz NTCKWVCVVVVSCO-NSHDSACASA-N 0 3 361.406 -1.292 20 0 FAADHN C[C@@H]1C(=O)N(CCN(C)C)CN1C(=O)C1CCN(S(N)(=O)=O)CC1 ZINC000649078970 483562837 /nfs/dbraw/zinc/56/28/37/483562837.db2.gz VGQNLWAVIXJHFI-LLVKDONJSA-N 0 3 361.468 -1.520 20 0 FAADHN C[C@H]1C(=O)N(CCN(C)C)CN1C(=O)C1CCN(S(N)(=O)=O)CC1 ZINC000649078971 483563583 /nfs/dbraw/zinc/56/35/83/483563583.db2.gz VGQNLWAVIXJHFI-NSHDSACASA-N 0 3 361.468 -1.520 20 0 FAADHN C[C@@H]1C(=O)N(CCN(C)C)CN1C(=O)CNS(=O)(=O)c1cnn(C)c1 ZINC000649079064 483563081 /nfs/dbraw/zinc/56/30/81/483563081.db2.gz WASVVSCWUXHTMR-LLVKDONJSA-N 0 3 372.451 -1.723 20 0 FAADHN C[C@H]1C(=O)N(CCN(C)C)CN1C(=O)CNS(=O)(=O)c1cnn(C)c1 ZINC000649079065 483562691 /nfs/dbraw/zinc/56/26/91/483562691.db2.gz WASVVSCWUXHTMR-NSHDSACASA-N 0 3 372.451 -1.723 20 0 FAADHN CN1CCC2(CC1)CN(C(=O)CN1CCN(S(C)(=O)=O)CC1)CCO2 ZINC000649131396 483567878 /nfs/dbraw/zinc/56/78/78/483567878.db2.gz JWQYJRWHEUEMRU-UHFFFAOYSA-N 0 3 374.507 -1.113 20 0 FAADHN C[C@@H]1C(=O)N(CCN(C)C)CN1C(=O)CNS(=O)(=O)c1cccnc1 ZINC000649234990 483580875 /nfs/dbraw/zinc/58/08/75/483580875.db2.gz YOTUBEMFVJPSFQ-GFCCVEGCSA-N 0 3 369.447 -1.062 20 0 FAADHN C[C@H]1C(=O)N(CCN(C)C)CN1C(=O)CNS(=O)(=O)c1cccnc1 ZINC000649234991 483580475 /nfs/dbraw/zinc/58/04/75/483580475.db2.gz YOTUBEMFVJPSFQ-LBPRGKRZSA-N 0 3 369.447 -1.062 20 0 FAADHN CC(C)NC(=O)CN1CCN(C(=O)CN2CCCC[C@H](N)C2=O)CC1 ZINC000649279934 483587770 /nfs/dbraw/zinc/58/77/70/483587770.db2.gz KGXJEEWHBSLGKF-AWEZNQCLSA-N 0 3 353.467 -1.005 20 0 FAADHN Cc1cc(NC(=O)CN2CCN(C(=O)COC3(C)CNC3)CC2)no1 ZINC000649283672 483767228 /nfs/dbraw/zinc/76/72/28/483767228.db2.gz YOMUVRADLNMNJX-UHFFFAOYSA-N 0 3 351.407 -0.556 20 0 FAADHN CC(C)[C@H](N)C(=O)NCC(=O)NCCN1CCN(S(C)(=O)=O)CC1 ZINC000649303226 483594021 /nfs/dbraw/zinc/59/40/21/483594021.db2.gz KPZZXLDTBAYQJY-ZDUSSCGKSA-N 0 3 363.484 -2.221 20 0 FAADHN CS(=O)(=O)N1CCN(CCNC(=O)[C@H]2CNCCC2(F)F)CC1 ZINC000649303516 483593657 /nfs/dbraw/zinc/59/36/57/483593657.db2.gz CWEVTELABZUERI-LLVKDONJSA-N 0 3 354.423 -1.075 20 0 FAADHN CS(=O)(=O)N1CCN(CCNC(=O)[C@@H]2CNCCC2(F)F)CC1 ZINC000649303517 483593272 /nfs/dbraw/zinc/59/32/72/483593272.db2.gz CWEVTELABZUERI-NSHDSACASA-N 0 3 354.423 -1.075 20 0 FAADHN CC(C)[C@H](N)C(=O)NCC(=O)N[C@H]1CCN(CCN2CCOCC2)C1 ZINC000649335447 483601317 /nfs/dbraw/zinc/60/13/17/483601317.db2.gz AUCUEPBLKCUQSA-HOCLYGCPSA-N 0 3 355.483 -1.391 20 0 FAADHN CC(C)[C@H](N)C(=O)NCC(=O)N[C@@H]1CCN(CCN2CCOCC2)C1 ZINC000649335448 483601837 /nfs/dbraw/zinc/60/18/37/483601837.db2.gz AUCUEPBLKCUQSA-ZBFHGGJFSA-N 0 3 355.483 -1.391 20 0 FAADHN N[C@H]1CCCCN(CC(=O)N[C@@H]2CCN(CCN3CCOCC3)C2)C1=O ZINC000649335732 483601913 /nfs/dbraw/zinc/60/19/13/483601913.db2.gz VQBWWOPMQOYTTR-CVEARBPZSA-N 0 3 367.494 -1.151 20 0 FAADHN N[C@H]1CCCCN(CC(=O)N[C@H]2CCN(CCN3CCOCC3)C2)C1=O ZINC000649335733 483602599 /nfs/dbraw/zinc/60/25/99/483602599.db2.gz VQBWWOPMQOYTTR-HOTGVXAUSA-N 0 3 367.494 -1.151 20 0 FAADHN N[C@@H]1CCCCN(CC(=O)N[C@@H]2CCN(CCN3CCOCC3)C2)C1=O ZINC000649335734 483602656 /nfs/dbraw/zinc/60/26/56/483602656.db2.gz VQBWWOPMQOYTTR-HZPDHXFCSA-N 0 3 367.494 -1.151 20 0 FAADHN N[C@@H]1CCCCN(CC(=O)N[C@H]2CCN(CCN3CCOCC3)C2)C1=O ZINC000649335735 483601540 /nfs/dbraw/zinc/60/15/40/483601540.db2.gz VQBWWOPMQOYTTR-JKSUJKDBSA-N 0 3 367.494 -1.151 20 0 FAADHN CN(C)CCNC(=O)Cn1cc(NC(=O)c2nc3n(n2)CCCN3)cn1 ZINC000649340154 483604144 /nfs/dbraw/zinc/60/41/44/483604144.db2.gz FGLKTTYUIPYWIO-UHFFFAOYSA-N 0 3 361.410 -1.522 20 0 FAADHN CN1CCN(C[C@@H]2CN(C(=O)CN3CCCC[C@H](N)C3=O)CCO2)CC1 ZINC000649352447 483605315 /nfs/dbraw/zinc/60/53/15/483605315.db2.gz SGSKOAGSIJCCNC-CVEARBPZSA-N 0 3 367.494 -1.199 20 0 FAADHN CN1CCN(C[C@H]2CN(C(=O)CN3CCCC[C@H](N)C3=O)CCO2)CC1 ZINC000649352448 483604772 /nfs/dbraw/zinc/60/47/72/483604772.db2.gz SGSKOAGSIJCCNC-HOTGVXAUSA-N 0 3 367.494 -1.199 20 0 FAADHN CN1CCN(C[C@@H]2CN(C(=O)CN3CCCC[C@@H](N)C3=O)CCO2)CC1 ZINC000649352449 483605665 /nfs/dbraw/zinc/60/56/65/483605665.db2.gz SGSKOAGSIJCCNC-HZPDHXFCSA-N 0 3 367.494 -1.199 20 0 FAADHN CN1CCN(C[C@H]2CN(C(=O)CN3CCCC[C@@H](N)C3=O)CCO2)CC1 ZINC000649352450 483605370 /nfs/dbraw/zinc/60/53/70/483605370.db2.gz SGSKOAGSIJCCNC-JKSUJKDBSA-N 0 3 367.494 -1.199 20 0 FAADHN CN1CCN(S(=O)(=O)c2cnc3c(c2)c(=O)[nH]c(=O)n3C)[C@H](CN)C1 ZINC000649422823 483610180 /nfs/dbraw/zinc/61/01/80/483610180.db2.gz AAKHRVZDOSMLPO-SECBINFHSA-N 0 3 368.419 -1.703 20 0 FAADHN CN1CCN(S(=O)(=O)c2cnc3c(c2)c(=O)[nH]c(=O)n3C)[C@@H](CN)C1 ZINC000649422824 483609651 /nfs/dbraw/zinc/60/96/51/483609651.db2.gz AAKHRVZDOSMLPO-VIFPVBQESA-N 0 3 368.419 -1.703 20 0 FAADHN COCCOCCN1C(=O)C[C@H](N2CCN(CCN(C)C)C(=O)C2)C1=O ZINC000649482265 483616782 /nfs/dbraw/zinc/61/67/82/483616782.db2.gz HKJBSFRMSLCSAJ-AWEZNQCLSA-N 0 3 370.450 -1.517 20 0 FAADHN COCCOCCN1C(=O)C[C@@H](N2CCN(CCN(C)C)C(=O)C2)C1=O ZINC000649482266 483616976 /nfs/dbraw/zinc/61/69/76/483616976.db2.gz HKJBSFRMSLCSAJ-CQSZACIVSA-N 0 3 370.450 -1.517 20 0 FAADHN CN(C)CCN1CCN(Cc2nc3c([nH]2)n(C)c(=O)n(C)c3=O)CC1=O ZINC000649685915 483632497 /nfs/dbraw/zinc/63/24/97/483632497.db2.gz RKTDOHZRHMBQJT-UHFFFAOYSA-N 0 3 363.422 -1.834 20 0 FAADHN CN(C)CCN1CCN(CCN2CCN(CCN(C)C)C(=O)C2)CC1=O ZINC000649686412 483632415 /nfs/dbraw/zinc/63/24/15/483632415.db2.gz GYMMUWRQWAJZBF-UHFFFAOYSA-N 0 3 368.526 -1.602 20 0 FAADHN CC(=O)N[C@H]1CCCN(C(=O)CN2CCN(CCN(C)C)C(=O)C2)C1 ZINC000649687121 483633334 /nfs/dbraw/zinc/63/33/34/483633334.db2.gz JWQNHFFGNCSLLD-HNNXBMFYSA-N 0 3 353.467 -1.181 20 0 FAADHN CC(=O)N[C@@H]1CCCN(C(=O)CN2CCN(CCN(C)C)C(=O)C2)C1 ZINC000649687122 483633238 /nfs/dbraw/zinc/63/32/38/483633238.db2.gz JWQNHFFGNCSLLD-OAHLLOKOSA-N 0 3 353.467 -1.181 20 0 FAADHN COCCCS(=O)(=O)NCCN1CCN(CCN(C)C)C(=O)C1 ZINC000649687143 483632925 /nfs/dbraw/zinc/63/29/25/483632925.db2.gz KOCUWMCMUKDIQJ-UHFFFAOYSA-N 0 3 350.485 -1.352 20 0 FAADHN C[C@H](C(=O)N(C)CC(=O)NC1CC1)N1CCN(CCN(C)C)C(=O)C1 ZINC000649687318 483633148 /nfs/dbraw/zinc/63/31/48/483633148.db2.gz MLISEOYYMPSWRL-CYBMUJFWSA-N 0 3 353.467 -1.182 20 0 FAADHN C[C@@H](C(=O)N(C)CC(=O)NC1CC1)N1CCN(CCN(C)C)C(=O)C1 ZINC000649687319 483633273 /nfs/dbraw/zinc/63/32/73/483633273.db2.gz MLISEOYYMPSWRL-ZDUSSCGKSA-N 0 3 353.467 -1.182 20 0 FAADHN CN(C)CCN1CCN(CC(=O)NCC(C)(C)N2CCOCC2)CC1=O ZINC000649687360 483633173 /nfs/dbraw/zinc/63/31/73/483633173.db2.gz NOCAPLNOWGOAPJ-UHFFFAOYSA-N 0 3 369.510 -1.081 20 0 FAADHN CN(C)CCN1CCN(CCNS(=O)(=O)c2cnn(C)c2)CC1=O ZINC000649687390 483632846 /nfs/dbraw/zinc/63/28/46/483632846.db2.gz ONXNAKMWUYYJKR-UHFFFAOYSA-N 0 3 358.468 -1.596 20 0 FAADHN CC(=O)N1CCN(C(=O)[C@H](C)N2CCN(CCN(C)C)C(=O)C2)CC1 ZINC000649687744 483633534 /nfs/dbraw/zinc/63/35/34/483633534.db2.gz CYJLCSNKEPVSIQ-AWEZNQCLSA-N 0 3 353.467 -1.229 20 0 FAADHN CC(=O)N1CCN(C(=O)[C@@H](C)N2CCN(CCN(C)C)C(=O)C2)CC1 ZINC000649687745 483632967 /nfs/dbraw/zinc/63/29/67/483632967.db2.gz CYJLCSNKEPVSIQ-CQSZACIVSA-N 0 3 353.467 -1.229 20 0 FAADHN C[C@@H](C(=O)N1CCC[C@H](C(N)=O)C1)N1CCN(CCN(C)C)C(=O)C1 ZINC000649688132 483632760 /nfs/dbraw/zinc/63/27/60/483632760.db2.gz SHMDDCLBQKGATJ-KBPBESRZSA-N 0 3 353.467 -1.195 20 0 FAADHN C[C@H](C(=O)N1CCC[C@H](C(N)=O)C1)N1CCN(CCN(C)C)C(=O)C1 ZINC000649688133 483632351 /nfs/dbraw/zinc/63/23/51/483632351.db2.gz SHMDDCLBQKGATJ-KGLIPLIRSA-N 0 3 353.467 -1.195 20 0 FAADHN C[C@@H](C(=O)N1CCC[C@@H](C(N)=O)C1)N1CCN(CCN(C)C)C(=O)C1 ZINC000649688134 483632336 /nfs/dbraw/zinc/63/23/36/483632336.db2.gz SHMDDCLBQKGATJ-UONOGXRCSA-N 0 3 353.467 -1.195 20 0 FAADHN C[C@H](C(=O)N1CCC[C@@H](C(N)=O)C1)N1CCN(CCN(C)C)C(=O)C1 ZINC000649688135 483632674 /nfs/dbraw/zinc/63/26/74/483632674.db2.gz SHMDDCLBQKGATJ-ZIAGYGMSSA-N 0 3 353.467 -1.195 20 0 FAADHN C[C@H](C(=O)N1CCC(C(N)=O)CC1)N1CCN(CCN(C)C)C(=O)C1 ZINC000649688165 483633364 /nfs/dbraw/zinc/63/33/64/483633364.db2.gz TVXCYFCPMGPQOJ-CYBMUJFWSA-N 0 3 353.467 -1.195 20 0 FAADHN 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O=C(CN1C(=O)CCC1=O)N1CCN(C[C@@H]2CCC3(CNC3)O2)CC1 ZINC000662276805 483745306 /nfs/dbraw/zinc/74/53/06/483745306.db2.gz MOLBPCLMSJHSQF-ZDUSSCGKSA-N 0 3 350.419 -1.199 20 0 FAADHN CN(C)C(=O)Cn1nc2n(c1=O)CCN(C[C@H]1CCC3(CNC3)O1)C2 ZINC000662279192 483745778 /nfs/dbraw/zinc/74/57/78/483745778.db2.gz GWIGQEZSJZQQSD-GFCCVEGCSA-N 0 3 350.423 -1.530 20 0 FAADHN CN(C)C(=O)Cn1nc2n(c1=O)CCN(C[C@@H]1CCC3(CNC3)O1)C2 ZINC000662279193 483745637 /nfs/dbraw/zinc/74/56/37/483745637.db2.gz GWIGQEZSJZQQSD-LBPRGKRZSA-N 0 3 350.423 -1.530 20 0 FAADHN CC(C)CN(C(=O)CN(CCN)C[C@H](O)CO)[C@H]1CCS(=O)(=O)C1 ZINC000662288110 483745279 /nfs/dbraw/zinc/74/52/79/483745279.db2.gz DJFNTWYMJGTUNT-KBPBESRZSA-N 0 3 365.496 -1.728 20 0 FAADHN CC(C)CN(C(=O)CN(CCN)C[C@H](O)CO)[C@@H]1CCS(=O)(=O)C1 ZINC000662288111 483745448 /nfs/dbraw/zinc/74/54/48/483745448.db2.gz DJFNTWYMJGTUNT-KGLIPLIRSA-N 0 3 365.496 -1.728 20 0 FAADHN CC(C)CN(C(=O)CN(CCN)C[C@@H](O)CO)[C@H]1CCS(=O)(=O)C1 ZINC000662288112 483745695 /nfs/dbraw/zinc/74/56/95/483745695.db2.gz DJFNTWYMJGTUNT-UONOGXRCSA-N 0 3 365.496 -1.728 20 0 FAADHN CC(C)CN(C(=O)CN(CCN)C[C@@H](O)CO)[C@@H]1CCS(=O)(=O)C1 ZINC000662288113 483745283 /nfs/dbraw/zinc/74/52/83/483745283.db2.gz DJFNTWYMJGTUNT-ZIAGYGMSSA-N 0 3 365.496 -1.728 20 0 FAADHN N[C@@H]1CN(CC(=O)N2CCN([C@H]3CCS(=O)(=O)C3)CC2)CC[C@H]1F ZINC000662326006 483745703 /nfs/dbraw/zinc/74/57/03/483745703.db2.gz SVXFAYQTTGPWOL-BFHYXJOUSA-N 0 3 362.471 -1.311 20 0 FAADHN N[C@@H]1CN(CC(=O)N2CCN([C@@H]3CCS(=O)(=O)C3)CC2)CC[C@H]1F ZINC000662326007 483745668 /nfs/dbraw/zinc/74/56/68/483745668.db2.gz SVXFAYQTTGPWOL-MGPQQGTHSA-N 0 3 362.471 -1.311 20 0 FAADHN O=C(CC1(n2cnnn2)CCOCC1)Nc1nc(N2CCNCC2)n[nH]1 ZINC000662426650 483746655 /nfs/dbraw/zinc/74/66/55/483746655.db2.gz YNZCKOITZCXMNJ-UHFFFAOYSA-N 0 3 362.398 -1.265 20 0 FAADHN O=C(N1CCN(S(=O)(=O)c2c[n-]c3ncccc23)CC1)C1(O)C[NH2+]C1 ZINC000662526133 483746064 /nfs/dbraw/zinc/74/60/64/483746064.db2.gz SBHFXQZIXKQIAK-UHFFFAOYSA-N 0 3 365.415 -1.270 20 0 FAADHN Cn1c2ncc(C(=O)NCc3nc(C[NH3+])cc(=O)[n-]3)cc2c(=O)n(C)c1=O ZINC000662751703 483746268 /nfs/dbraw/zinc/74/62/68/483746268.db2.gz CBWABSCJHNYXHD-UHFFFAOYSA-N 0 3 371.357 -1.484 20 0 FAADHN Cn1c2nc(C(=O)NCc3nc(C[NH3+])cc(=O)[n-]3)ccc2c(=O)n(C)c1=O ZINC000662752957 483746337 /nfs/dbraw/zinc/74/63/37/483746337.db2.gz MAOFIUKDKUYBOY-UHFFFAOYSA-N 0 3 371.357 -1.484 20 0 FAADHN CN(C(=O)C1(O)CNC1)C1CCN(CC(=O)N2CCN(C)CC2)CC1 ZINC000662792500 483746617 /nfs/dbraw/zinc/74/66/17/483746617.db2.gz WARYNAZRAPQZJT-UHFFFAOYSA-N 0 3 353.467 -1.983 20 0 FAADHN CC(C)(N)c1cc(C(=O)N2CC(S(=O)(=O)N3CCNCC3)C2)on1 ZINC000662817978 483747132 /nfs/dbraw/zinc/74/71/32/483747132.db2.gz ZAKAHAIBWSCFNX-UHFFFAOYSA-N 0 3 357.436 -1.072 20 0 FAADHN CN(C)CCN(CC[NH+](C)C)C(=O)C(=O)N1C[C@@H]2COC[C@]2(C(=O)[O-])C1 ZINC000662904699 483746915 /nfs/dbraw/zinc/74/69/15/483746915.db2.gz QKKRJCLDQNRULD-CXAGYDPISA-N 0 3 370.450 -1.502 20 0 FAADHN NCC12CC(C1)CN2C(=O)C(=O)N1CCN(C(=O)[C@@H]2CCCO2)CC1 ZINC000662919315 483747937 /nfs/dbraw/zinc/74/79/37/483747937.db2.gz TUYNIVTXQFEWMU-JZLYGMAVSA-N 0 3 350.419 -1.214 20 0 FAADHN NCC12CC(C1)CN2C(=O)C(=O)N1CCN(C(=O)[C@H]2CCCO2)CC1 ZINC000662919320 483747942 /nfs/dbraw/zinc/74/79/42/483747942.db2.gz TUYNIVTXQFEWMU-UIORMTCPSA-N 0 3 350.419 -1.214 20 0 FAADHN C[C@H](C(=O)NC1CC1)N1CCN(C(=O)C(=O)N2CC3CC2(CN)C3)CC1 ZINC000662921196 483747926 /nfs/dbraw/zinc/74/79/26/483747926.db2.gz GCPGTTBCUHNXNT-WHENESEISA-N 0 3 363.462 -1.253 20 0 FAADHN C[C@@H](C(=O)NC1CC1)N1CCN(C(=O)C(=O)N2CC3CC2(CN)C3)CC1 ZINC000662921197 483748017 /nfs/dbraw/zinc/74/80/17/483748017.db2.gz GCPGTTBCUHNXNT-ZVLZOBCMSA-N 0 3 363.462 -1.253 20 0 FAADHN CCN(CC)C(=O)CN1CCN(C(=O)C(=O)N2CC3CC2(CN)C3)CC1 ZINC000662921896 483748200 /nfs/dbraw/zinc/74/82/00/483748200.db2.gz DUIRBWLEAAAAKV-UHFFFAOYSA-N 0 3 365.478 -1.051 20 0 FAADHN NCC12CC(C1)CN2C(=O)C(=O)N1CCN(CC(=O)N2CCCC2)CC1 ZINC000662922864 483748064 /nfs/dbraw/zinc/74/80/64/483748064.db2.gz FBAPNNFPBHFEMR-UHFFFAOYSA-N 0 3 363.462 -1.297 20 0 FAADHN CC(C)NC(=O)CN1CCN(C(=O)C(=O)N2CC3CC2(CN)C3)CC1 ZINC000662923548 483748112 /nfs/dbraw/zinc/74/81/12/483748112.db2.gz OJSSXRBCRZKONK-UHFFFAOYSA-N 0 3 351.451 -1.395 20 0 FAADHN CC[C@H](C)NC(=O)CN1CCN(C(=O)C(=O)N2CC3CC2(CN)C3)CC1 ZINC000662924112 483748326 /nfs/dbraw/zinc/74/83/26/483748326.db2.gz PVKPFURJQMWIEU-VNSJNIRKSA-N 0 3 365.478 -1.005 20 0 FAADHN CC[C@@H](C)NC(=O)CN1CCN(C(=O)C(=O)N2CC3CC2(CN)C3)CC1 ZINC000662924113 483747903 /nfs/dbraw/zinc/74/79/03/483747903.db2.gz PVKPFURJQMWIEU-WRSVWVKZSA-N 0 3 365.478 -1.005 20 0 FAADHN NCC12CC(C1)CN2C(=O)C(=O)N1CCN(c2ncccc2C(N)=O)CC1 ZINC000662924488 483748091 /nfs/dbraw/zinc/74/80/91/483748091.db2.gz CWGLZZFRNZZYBH-UHFFFAOYSA-N 0 3 372.429 -1.221 20 0 FAADHN NCC12CC(C1)CN2C(=O)C(=O)N1CCN(C(=O)Cn2cnnn2)CC1 ZINC000662925286 483748106 /nfs/dbraw/zinc/74/81/06/483748106.db2.gz LRJHBMHQVOBYCJ-UHFFFAOYSA-N 0 3 362.394 -2.706 20 0 FAADHN NCC12CC(C1)CN2C(=O)C(=O)N1CCN(C(=O)C(=O)NC2CC2)CC1 ZINC000662926236 483748191 /nfs/dbraw/zinc/74/81/91/483748191.db2.gz JXIQGWXAWSDVLF-UHFFFAOYSA-N 0 3 363.418 -2.115 20 0 FAADHN NCC12CC(C1)CN2C(=O)C(=O)N1CCN(c2ccc(C(N)=O)cn2)CC1 ZINC000662926819 483748246 /nfs/dbraw/zinc/74/82/46/483748246.db2.gz SNRRNEPDEKHEOU-UHFFFAOYSA-N 0 3 372.429 -1.221 20 0 FAADHN CCN(CC)CC(=O)N1CCN(C(=O)C(=O)N2CC[C@@H](F)[C@H](N)C2)CC1 ZINC000662929474 483748321 /nfs/dbraw/zinc/74/83/21/483748321.db2.gz BHPZBGHFJHTPMT-ZIAGYGMSSA-N 0 3 371.457 -1.103 20 0 FAADHN N[C@@H]1CN(C(=O)C(=O)N2CCN(C(=O)CN3CCCC3)CC2)CC[C@H]1F ZINC000662930752 483748006 /nfs/dbraw/zinc/74/80/06/483748006.db2.gz WKEXJLUUPHJXOY-ZIAGYGMSSA-N 0 3 369.441 -1.349 20 0 FAADHN Cn1ccnc(N2CCN(C(=O)C(=O)N3CC4CC3(CN)C4)CC2)c1=O ZINC000662935389 483747893 /nfs/dbraw/zinc/74/78/93/483747893.db2.gz WDSAQDKDOWLUNN-UHFFFAOYSA-N 0 3 360.418 -1.621 20 0 FAADHN CN(C)C(=O)CCN1CCN(C(=O)C(=O)N2CC[C@@H](F)[C@H](N)C2)CC1 ZINC000662938879 483748183 /nfs/dbraw/zinc/74/81/83/483748183.db2.gz JJBUBPNFDGWKAR-CHWSQXEVSA-N 0 3 357.430 -1.493 20 0 FAADHN CN(C)C(=O)CCN1CCN(C(=O)C(=O)N2CC3CC2(CN)C3)CC1 ZINC000662939963 483748294 /nfs/dbraw/zinc/74/82/94/483748294.db2.gz RRDKHMLEWHKRGW-UHFFFAOYSA-N 0 3 351.451 -1.441 20 0 FAADHN CN1CCC[C@H]1C(=O)N1CCN(C(=O)C(=O)N2CC[C@@H](F)[C@H](N)C2)CC1 ZINC000662941850 483748885 /nfs/dbraw/zinc/74/88/85/483748885.db2.gz ZNTBFESNVXNWIL-MCIONIFRSA-N 0 3 369.441 -1.351 20 0 FAADHN CN1CCC[C@@H]1C(=O)N1CCN(C(=O)C(=O)N2CC[C@@H](F)[C@H](N)C2)CC1 ZINC000662941851 483748812 /nfs/dbraw/zinc/74/88/12/483748812.db2.gz ZNTBFESNVXNWIL-MGPQQGTHSA-N 0 3 369.441 -1.351 20 0 FAADHN NCC12CC(C1)CN2C(=O)C(=O)N1CCC[C@@H](N2CCCS2(=O)=O)C1 ZINC000662943137 483748551 /nfs/dbraw/zinc/74/85/51/483748551.db2.gz ORZAYESDZJYTGT-MFOWVQHXSA-N 0 3 370.475 -1.037 20 0 FAADHN NCC12CC(C1)CN2C(=O)C(=O)N1CCC[C@H](N2CCCS2(=O)=O)C1 ZINC000662943138 483748567 /nfs/dbraw/zinc/74/85/67/483748567.db2.gz ORZAYESDZJYTGT-UYJPIKCFSA-N 0 3 370.475 -1.037 20 0 FAADHN NCC12CC(C1)CN2C(=O)C(=O)N1CCN(c2nc(N)ns2)CC1 ZINC000662943540 483748612 /nfs/dbraw/zinc/74/86/12/483748612.db2.gz YMQYIKCLUZSABK-UHFFFAOYSA-N 0 3 351.436 -1.281 20 0 FAADHN COCC(COC)N1CCN(C(=O)C(=O)N2CC3CC2(CN)C3)CC1 ZINC000662946077 483748561 /nfs/dbraw/zinc/74/85/61/483748561.db2.gz NGIAYPJQLHKVRF-UHFFFAOYSA-N 0 3 354.451 -1.258 20 0 FAADHN CN(C)C(=O)N(C)[C@@H]1CCN(C(=O)C(=O)N2CCN(C)C[C@H]2CN)C1 ZINC000662946468 483748598 /nfs/dbraw/zinc/74/85/98/483748598.db2.gz FDRXBHRSXRUFAH-CHWSQXEVSA-N 0 3 354.455 -1.698 20 0 FAADHN CN(C)C(=O)N(C)[C@@H]1CCN(C(=O)C(=O)N2CCN(C)C[C@@H]2CN)C1 ZINC000662946469 483748642 /nfs/dbraw/zinc/74/86/42/483748642.db2.gz FDRXBHRSXRUFAH-OLZOCXBDSA-N 0 3 354.455 -1.698 20 0 FAADHN CN(C)C(=O)N(C)[C@H]1CCN(C(=O)C(=O)N2CCN(C)C[C@H]2CN)C1 ZINC000662946470 483748796 /nfs/dbraw/zinc/74/87/96/483748796.db2.gz FDRXBHRSXRUFAH-QWHCGFSZSA-N 0 3 354.455 -1.698 20 0 FAADHN CN(C)C(=O)N(C)[C@H]1CCN(C(=O)C(=O)N2CCN(C)C[C@@H]2CN)C1 ZINC000662946471 483748667 /nfs/dbraw/zinc/74/86/67/483748667.db2.gz FDRXBHRSXRUFAH-STQMWFEESA-N 0 3 354.455 -1.698 20 0 FAADHN CS(=O)(=O)[C@@H]1CN(C(=O)C(=O)N2CC[C@@H](N)C2)C[C@H]1C(F)(F)F ZINC000662946905 482587967 /nfs/dbraw/zinc/58/79/67/482587967.db2.gz ILWJJSORDADJRZ-IWSPIJDZSA-N 0 3 357.354 -1.020 20 0 FAADHN CN1CCN(C(=O)C(=O)N2CC[C@@H](CN3CCCC3=O)C2)[C@@H](CN)C1 ZINC000662947272 483748974 /nfs/dbraw/zinc/74/89/74/483748974.db2.gz MIYLSCDCYCQSQP-KBPBESRZSA-N 0 3 351.451 -1.441 20 0 FAADHN CN1CCN(C(=O)C(=O)N2CC[C@H](CN3CCCC3=O)C2)[C@@H](CN)C1 ZINC000662947273 483748652 /nfs/dbraw/zinc/74/86/52/483748652.db2.gz MIYLSCDCYCQSQP-KGLIPLIRSA-N 0 3 351.451 -1.441 20 0 FAADHN CN1CCN(C(=O)C(=O)N2CC[C@@H](CN3CCCC3=O)C2)[C@H](CN)C1 ZINC000662947274 483748918 /nfs/dbraw/zinc/74/89/18/483748918.db2.gz MIYLSCDCYCQSQP-UONOGXRCSA-N 0 3 351.451 -1.441 20 0 FAADHN CN1CCN(C(=O)C(=O)N2CC[C@H](CN3CCCC3=O)C2)[C@H](CN)C1 ZINC000662947275 483748649 /nfs/dbraw/zinc/74/86/49/483748649.db2.gz MIYLSCDCYCQSQP-ZIAGYGMSSA-N 0 3 351.451 -1.441 20 0 FAADHN CO[C@@H]1CS(=O)(=O)[C@H]2CN(C(=O)C(=O)N3CCN(C)C[C@@H]3CN)C[C@H]21 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483798775 /nfs/dbraw/zinc/79/87/75/483798775.db2.gz OIOKOISAFBURDJ-UHFFFAOYSA-N 0 3 365.500 -1.823 20 0 FAADHN C[C@@H]1CN(C(=O)C(=O)Nc2cnn(CCN(C)C)c2)CCN1CCO ZINC000681733699 483799518 /nfs/dbraw/zinc/79/95/18/483799518.db2.gz DAAAXTALGWRTGY-CYBMUJFWSA-N 0 3 352.439 -1.092 20 0 FAADHN C[C@H]1CN(C(=O)C(=O)Nc2cnn(CCN(C)C)c2)CCN1CCO ZINC000681733705 483799413 /nfs/dbraw/zinc/79/94/13/483799413.db2.gz DAAAXTALGWRTGY-ZDUSSCGKSA-N 0 3 352.439 -1.092 20 0 FAADHN CN1CCN(CC(=O)N2CCC(N3CCC[C@H]3C(N)=O)CC2)CC1=O ZINC000681980575 483800165 /nfs/dbraw/zinc/80/01/65/483800165.db2.gz FJYQZGIVUQWNRL-AWEZNQCLSA-N 0 3 351.451 -1.299 20 0 FAADHN CN1CCN(CC(=O)N2CCC(N3CCC[C@@H]3C(N)=O)CC2)CC1=O ZINC000681980576 483800015 /nfs/dbraw/zinc/80/00/15/483800015.db2.gz FJYQZGIVUQWNRL-CQSZACIVSA-N 0 3 351.451 -1.299 20 0 FAADHN Cn1c2ncn(CCN3CCN(CCO)C(C)(C)C3)c2c(=O)n(C)c1=O ZINC000682032755 483800815 /nfs/dbraw/zinc/80/08/15/483800815.db2.gz KPGZYXAZHZTVAE-UHFFFAOYSA-N 0 3 364.450 -1.178 20 0 FAADHN Cn1c2[nH]c(CN3CCN(CCO)C(C)(C)C3)nc2c(=O)n(C)c1=O ZINC000682035492 483800798 /nfs/dbraw/zinc/80/07/98/483800798.db2.gz ZKJMQUVWTAUDPZ-UHFFFAOYSA-N 0 3 350.423 -1.151 20 0 FAADHN CN(C)CCOCCNC(=O)NCCN1CCN(S(C)(=O)=O)CC1 ZINC000682613189 483801324 /nfs/dbraw/zinc/80/13/24/483801324.db2.gz GNCVKFZYKVOJHX-UHFFFAOYSA-N 0 3 365.500 -1.559 20 0 FAADHN CN(C)CCOCCNC(=O)N1CCN(S(=O)(=O)N(C)C)CC1 ZINC000682614723 483497226 /nfs/dbraw/zinc/49/72/26/483497226.db2.gz SRSDQCZUVXWHNV-UHFFFAOYSA-N 0 3 351.473 -1.302 20 0 FAADHN COC1(CO)CCN(CCn2cnc3c2c(=O)n(C)c(=O)n3C)CC1 ZINC000683678639 483801811 /nfs/dbraw/zinc/80/18/11/483801811.db2.gz ALJDXSQLKKYCBD-UHFFFAOYSA-N 0 3 351.407 -1.093 20 0 FAADHN CN(C)CCN1C[C@H](C(=O)NCCCn2c(=O)ccn(C)c2=O)CC1=O ZINC000684182277 483802812 /nfs/dbraw/zinc/80/28/12/483802812.db2.gz ZDHHXDSBSCVPGP-CYBMUJFWSA-N 0 3 365.434 -1.537 20 0 FAADHN CN(C)CCN1C[C@@H](C(=O)NCCCn2c(=O)ccn(C)c2=O)CC1=O ZINC000684182281 483803014 /nfs/dbraw/zinc/80/30/14/483803014.db2.gz 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C[C@@H]1C[C@H](NC(=O)C(=O)N(C)C[C@H](O)CN2CCOCC2)CN1C1CC1 ZINC000685277130 483804643 /nfs/dbraw/zinc/80/46/43/483804643.db2.gz GZSSPUXWKYWMGT-YCPHGPKFSA-N 0 3 368.478 -1.121 20 0 FAADHN CS(=O)(=O)N1CC(CNC(=O)C(=O)N2CC[C@@H](N3CCCC3)C2)C1 ZINC000685328397 483804617 /nfs/dbraw/zinc/80/46/17/483804617.db2.gz YRNLIDKWXNDFBT-CYBMUJFWSA-N 0 3 358.464 -1.309 20 0 FAADHN CS(=O)(=O)N1CC(CNC(=O)C(=O)N2CC[C@H](N3CCCC3)C2)C1 ZINC000685328398 483804373 /nfs/dbraw/zinc/80/43/73/483804373.db2.gz YRNLIDKWXNDFBT-ZDUSSCGKSA-N 0 3 358.464 -1.309 20 0 FAADHN C[C@@H](NC(=O)C(=O)N(C)CCCN1CCN(C)CC1)[C@@H]1CN(C)CCO1 ZINC000685339087 483805445 /nfs/dbraw/zinc/80/54/45/483805445.db2.gz HATRKZZDSHQKOB-CVEARBPZSA-N 0 3 369.510 -1.082 20 0 FAADHN C[C@H](NC(=O)C(=O)N(C)CCCN1CCN(C)CC1)[C@@H]1CN(C)CCO1 ZINC000685339088 483804941 /nfs/dbraw/zinc/80/49/41/483804941.db2.gz HATRKZZDSHQKOB-HOTGVXAUSA-N 0 3 369.510 -1.082 20 0 FAADHN C[C@@H](NC(=O)C(=O)N(C)CCCN1CCN(C)CC1)[C@H]1CN(C)CCO1 ZINC000685339089 483805389 /nfs/dbraw/zinc/80/53/89/483805389.db2.gz HATRKZZDSHQKOB-HZPDHXFCSA-N 0 3 369.510 -1.082 20 0 FAADHN C[C@H](NC(=O)C(=O)N(C)CCCN1CCN(C)CC1)[C@H]1CN(C)CCO1 ZINC000685339090 483805374 /nfs/dbraw/zinc/80/53/74/483805374.db2.gz HATRKZZDSHQKOB-JKSUJKDBSA-N 0 3 369.510 -1.082 20 0 FAADHN C[C@@H](NC(=O)C(=O)N(CCN(C)C)CCN(C)C)[C@@H]1CN(C)CCO1 ZINC000685341024 483805484 /nfs/dbraw/zinc/80/54/84/483805484.db2.gz MITZXMXMHOEIHY-CABCVRRESA-N 0 3 357.499 -1.227 20 0 FAADHN C[C@H](NC(=O)C(=O)N(CCN(C)C)CCN(C)C)[C@@H]1CN(C)CCO1 ZINC000685341045 483805508 /nfs/dbraw/zinc/80/55/08/483805508.db2.gz MITZXMXMHOEIHY-GJZGRUSLSA-N 0 3 357.499 -1.227 20 0 FAADHN C[C@@H](NC(=O)C(=O)N(CCN(C)C)CCN(C)C)[C@H]1CN(C)CCO1 ZINC000685341048 483804917 /nfs/dbraw/zinc/80/49/17/483804917.db2.gz MITZXMXMHOEIHY-HUUCEWRRSA-N 0 3 357.499 -1.227 20 0 FAADHN C[C@H](NC(=O)C(=O)N(CCN(C)C)CCN(C)C)[C@H]1CN(C)CCO1 ZINC000685341050 483804733 /nfs/dbraw/zinc/80/47/33/483804733.db2.gz MITZXMXMHOEIHY-LSDHHAIUSA-N 0 3 357.499 -1.227 20 0 FAADHN CN(C[C@H](O)CN1CCN(S(=O)(=O)N2CCOCC2)CC1)C1CC1 ZINC000685561018 483806059 /nfs/dbraw/zinc/80/60/59/483806059.db2.gz UAMHBQVYRDKCJS-HNNXBMFYSA-N 0 3 362.496 -1.364 20 0 FAADHN CN(C[C@@H](O)CN1CCN(S(=O)(=O)N2CCOCC2)CC1)C1CC1 ZINC000685561021 483805909 /nfs/dbraw/zinc/80/59/09/483805909.db2.gz UAMHBQVYRDKCJS-OAHLLOKOSA-N 0 3 362.496 -1.364 20 0 FAADHN CCN1CCN(CCC(=O)NCCS(=O)(=O)N2CCOCC2)CC1 ZINC000725894441 657773066 /nfs/dbraw/zinc/77/30/66/657773066.db2.gz IRAYKVTVCMHUSP-UHFFFAOYSA-N 0 3 362.496 -1.208 20 0 FAADHN Cc1nc(S(=O)(=O)NCC(=O)NC[C@@H]2CN3CCC[C@@H]3CO2)cn1C ZINC000725896985 657774866 /nfs/dbraw/zinc/77/48/66/657774866.db2.gz PLXGXXBWWFNEIT-CHWSQXEVSA-N 0 3 371.463 -1.014 20 0 FAADHN Cc1nc(S(=O)(=O)NCC(=O)NC[C@H]2CN3CCC[C@@H]3CO2)cn1C ZINC000725896986 657774772 /nfs/dbraw/zinc/77/47/72/657774772.db2.gz PLXGXXBWWFNEIT-OLZOCXBDSA-N 0 3 371.463 -1.014 20 0 FAADHN Cc1nc(S(=O)(=O)NCC(=O)NC[C@@H]2CN3CCC[C@H]3CO2)cn1C ZINC000725896987 657775052 /nfs/dbraw/zinc/77/50/52/657775052.db2.gz PLXGXXBWWFNEIT-QWHCGFSZSA-N 0 3 371.463 -1.014 20 0 FAADHN Cc1nc(S(=O)(=O)NCC(=O)NC[C@H]2CN3CCC[C@H]3CO2)cn1C ZINC000725896988 657774883 /nfs/dbraw/zinc/77/48/83/657774883.db2.gz PLXGXXBWWFNEIT-STQMWFEESA-N 0 3 371.463 -1.014 20 0 FAADHN Cn1cc(S(=O)(=O)NCC(=O)NC[C@H]2CN3CCC[C@@H]3CO2)cn1 ZINC000725898855 657776225 /nfs/dbraw/zinc/77/62/25/657776225.db2.gz YHYUXZMAROWPHQ-NEPJUHHUSA-N 0 3 357.436 -1.322 20 0 FAADHN Cn1cc(S(=O)(=O)NCC(=O)NC[C@@H]2CN3CCC[C@H]3CO2)cn1 ZINC000725898861 657775982 /nfs/dbraw/zinc/77/59/82/657775982.db2.gz YHYUXZMAROWPHQ-NWDGAFQWSA-N 0 3 357.436 -1.322 20 0 FAADHN Cn1cc(S(=O)(=O)NCC(=O)NC[C@H]2CN3CCC[C@H]3CO2)cn1 ZINC000725898863 657776056 /nfs/dbraw/zinc/77/60/56/657776056.db2.gz YHYUXZMAROWPHQ-RYUDHWBXSA-N 0 3 357.436 -1.322 20 0 FAADHN Cn1cc(S(=O)(=O)NCC(=O)NC[C@@H]2CN3CCC[C@@H]3CO2)cn1 ZINC000725898865 657775723 /nfs/dbraw/zinc/77/57/23/657775723.db2.gz YHYUXZMAROWPHQ-VXGBXAGGSA-N 0 3 357.436 -1.322 20 0 FAADHN COCCN(C)CCNC(=O)NCCS(=O)(=O)N1CCOCC1 ZINC000727031852 657862501 /nfs/dbraw/zinc/86/25/01/657862501.db2.gz ACPGMJKPRBIVMW-UHFFFAOYSA-N 0 3 352.457 -1.474 20 0 FAADHN C[C@H](CNC(=S)NCCNS(C)(=O)=O)CN1CCN(C)CC1 ZINC000727084699 657864597 /nfs/dbraw/zinc/86/45/97/657864597.db2.gz MOWJAWHMEQFMCL-GFCCVEGCSA-N 0 3 351.542 -1.117 20 0 FAADHN C[C@@H](CNC(=S)NCCNS(C)(=O)=O)CN1CCN(C)CC1 ZINC000727084701 657864904 /nfs/dbraw/zinc/86/49/04/657864904.db2.gz MOWJAWHMEQFMCL-LBPRGKRZSA-N 0 3 351.542 -1.117 20 0 FAADHN COC(=O)CN(CC(=O)OC)CN1C(=O)NC2(CCN(C)CC2)C1=O ZINC000728560610 657883294 /nfs/dbraw/zinc/88/32/94/657883294.db2.gz LOBMYMGBMYWGKR-UHFFFAOYSA-N 0 3 356.379 -1.392 20 0 FAADHN O=C(CN1CCN(C(=O)CN2CCCC2)CC1)N[C@H]1CCS(=O)(=O)C1 ZINC000728575589 657883233 /nfs/dbraw/zinc/88/32/33/657883233.db2.gz CMADYIKWZYMDFJ-AWEZNQCLSA-N 0 3 372.491 -1.470 20 0 FAADHN O=C(CN1CCN(C(=O)CN2CCCC2)CC1)N[C@@H]1CCS(=O)(=O)C1 ZINC000728575591 657882874 /nfs/dbraw/zinc/88/28/74/657882874.db2.gz CMADYIKWZYMDFJ-CQSZACIVSA-N 0 3 372.491 -1.470 20 0 FAADHN COCCN(CCN(C)C)C(=O)NCCS(=O)(=O)N1CCOCC1 ZINC000729605258 657942907 /nfs/dbraw/zinc/94/29/07/657942907.db2.gz IRDUCSAPVBJEMM-UHFFFAOYSA-N 0 3 366.484 -1.132 20 0 FAADHN CN(CC(=O)N1CCOCC1)CN1C(=O)NC2(CCN(C)CC2)C1=O ZINC000732179765 658056287 /nfs/dbraw/zinc/05/62/87/658056287.db2.gz CCNQOMTURQSMKO-UHFFFAOYSA-N 0 3 353.423 -1.249 20 0 FAADHN COC(=O)c1c(C)[nH]nc1S(=O)(=O)N1CCN(C(=O)CN(C)C)CC1 ZINC000732217094 658056222 /nfs/dbraw/zinc/05/62/22/658056222.db2.gz PJASQNCXKOFDSF-UHFFFAOYSA-N 0 3 373.435 -1.101 20 0 FAADHN CNS(=O)(=O)[C@@H]1CCCN(CN2C(=O)NC3(CCN(C)CC3)C2=O)C1 ZINC000733301864 658284159 /nfs/dbraw/zinc/28/41/59/658284159.db2.gz XAIITZLAVDSEQM-GFCCVEGCSA-N 0 3 373.479 -1.026 20 0 FAADHN CNS(=O)(=O)[C@H]1CCCN(CN2C(=O)NC3(CCN(C)CC3)C2=O)C1 ZINC000733301865 658284049 /nfs/dbraw/zinc/28/40/49/658284049.db2.gz XAIITZLAVDSEQM-LBPRGKRZSA-N 0 3 373.479 -1.026 20 0 FAADHN CCNS(=O)(=O)CC[NH2+]C[C@@H]1CNc2c(-c3nn[n-]n3)cnn2C1 ZINC000736577077 598596255 /nfs/dbraw/zinc/59/62/55/598596255.db2.gz AGCBRWUZKJSWTA-SECBINFHSA-N 0 3 355.428 -1.366 20 0 FAADHN CCNS(=O)(=O)CC[NH2+]C[C@@H]1CNc2c(-c3nnn[n-]3)cnn2C1 ZINC000736577077 598596254 /nfs/dbraw/zinc/59/62/54/598596254.db2.gz AGCBRWUZKJSWTA-SECBINFHSA-N 0 3 355.428 -1.366 20 0 FAADHN CCNS(=O)(=O)CC[NH2+]C[C@H]1CNc2c(-c3nn[n-]n3)cnn2C1 ZINC000736577078 598596382 /nfs/dbraw/zinc/59/63/82/598596382.db2.gz AGCBRWUZKJSWTA-VIFPVBQESA-N 0 3 355.428 -1.366 20 0 FAADHN CCNS(=O)(=O)CC[NH2+]C[C@H]1CNc2c(-c3nnn[n-]3)cnn2C1 ZINC000736577078 598596381 /nfs/dbraw/zinc/59/63/81/598596381.db2.gz AGCBRWUZKJSWTA-VIFPVBQESA-N 0 3 355.428 -1.366 20 0 FAADHN COCCN1CC[C@@H](NC(=O)NCCS(=O)(=O)N2CCOCC2)C1 ZINC000736657285 658332750 /nfs/dbraw/zinc/33/27/50/658332750.db2.gz RIYFQCHSEJZZTF-CYBMUJFWSA-N 0 3 364.468 -1.332 20 0 FAADHN COCCN1CC[C@H](NC(=O)NCCS(=O)(=O)N2CCOCC2)C1 ZINC000736657286 658332954 /nfs/dbraw/zinc/33/29/54/658332954.db2.gz RIYFQCHSEJZZTF-ZDUSSCGKSA-N 0 3 364.468 -1.332 20 0 FAADHN CCS(=O)(=O)NCC[NH2+]C[C@@H]1CNc2c(-c3nn[n-]n3)cnn2C1 ZINC000736663105 598526504 /nfs/dbraw/zinc/52/65/04/598526504.db2.gz CLJVANWAERQSLP-SECBINFHSA-N 0 3 355.428 -1.366 20 0 FAADHN CCS(=O)(=O)NCC[NH2+]C[C@@H]1CNc2c(-c3nnn[n-]3)cnn2C1 ZINC000736663105 598526503 /nfs/dbraw/zinc/52/65/03/598526503.db2.gz CLJVANWAERQSLP-SECBINFHSA-N 0 3 355.428 -1.366 20 0 FAADHN CCS(=O)(=O)NCC[NH2+]C[C@H]1CNc2c(-c3nn[n-]n3)cnn2C1 ZINC000736663107 598526456 /nfs/dbraw/zinc/52/64/56/598526456.db2.gz CLJVANWAERQSLP-VIFPVBQESA-N 0 3 355.428 -1.366 20 0 FAADHN CCS(=O)(=O)NCC[NH2+]C[C@H]1CNc2c(-c3nnn[n-]3)cnn2C1 ZINC000736663107 598526455 /nfs/dbraw/zinc/52/64/55/598526455.db2.gz CLJVANWAERQSLP-VIFPVBQESA-N 0 3 355.428 -1.366 20 0 FAADHN C[NH+](C)C[C@H](O)CNC(=O)C(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000736763679 598635551 /nfs/dbraw/zinc/63/55/51/598635551.db2.gz NRZDJHVHXPJJFN-SECBINFHSA-N 0 3 351.342 -1.017 20 0 FAADHN C[NH+](C)C[C@H](O)CNC(=O)C(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000736763679 598635549 /nfs/dbraw/zinc/63/55/49/598635549.db2.gz NRZDJHVHXPJJFN-SECBINFHSA-N 0 3 351.342 -1.017 20 0 FAADHN C[NH+](C)C[C@@H](O)CNC(=O)C(=O)Nc1ccc(F)c(-c2nn[n-]n2)c1 ZINC000736763688 598635689 /nfs/dbraw/zinc/63/56/89/598635689.db2.gz NRZDJHVHXPJJFN-VIFPVBQESA-N 0 3 351.342 -1.017 20 0 FAADHN C[NH+](C)C[C@@H](O)CNC(=O)C(=O)Nc1ccc(F)c(-c2nnn[n-]2)c1 ZINC000736763688 598635687 /nfs/dbraw/zinc/63/56/87/598635687.db2.gz NRZDJHVHXPJJFN-VIFPVBQESA-N 0 3 351.342 -1.017 20 0 FAADHN CN(CCC[NH2+]C[C@H]1CNc2c(-c3nn[n-]n3)cnn2C1)S(C)(=O)=O ZINC000736799251 598521815 /nfs/dbraw/zinc/52/18/15/598521815.db2.gz APLDAUOEFQCYMY-JTQLQIEISA-N 0 3 369.455 -1.024 20 0 FAADHN CN(CCC[NH2+]C[C@H]1CNc2c(-c3nnn[n-]3)cnn2C1)S(C)(=O)=O ZINC000736799251 598521814 /nfs/dbraw/zinc/52/18/14/598521814.db2.gz APLDAUOEFQCYMY-JTQLQIEISA-N 0 3 369.455 -1.024 20 0 FAADHN CN(CCC[NH2+]C[C@@H]1CNc2c(-c3nn[n-]n3)cnn2C1)S(C)(=O)=O ZINC000736799257 598522067 /nfs/dbraw/zinc/52/20/67/598522067.db2.gz APLDAUOEFQCYMY-SNVBAGLBSA-N 0 3 369.455 -1.024 20 0 FAADHN CN(CCC[NH2+]C[C@@H]1CNc2c(-c3nnn[n-]3)cnn2C1)S(C)(=O)=O ZINC000736799257 598522066 /nfs/dbraw/zinc/52/20/66/598522066.db2.gz APLDAUOEFQCYMY-SNVBAGLBSA-N 0 3 369.455 -1.024 20 0 FAADHN CN1CCN(C(=O)CC[NH2+]C[C@@H]2CNc3c(-c4nn[n-]n4)cnn3C2)CC1 ZINC000736855915 598531095 /nfs/dbraw/zinc/53/10/95/598531095.db2.gz GOMKQMDLZSSDNA-GFCCVEGCSA-N 0 3 374.453 -1.141 20 0 FAADHN CN1CCN(C(=O)CC[NH2+]C[C@@H]2CNc3c(-c4nnn[n-]4)cnn3C2)CC1 ZINC000736855915 598531093 /nfs/dbraw/zinc/53/10/93/598531093.db2.gz GOMKQMDLZSSDNA-GFCCVEGCSA-N 0 3 374.453 -1.141 20 0 FAADHN CN1CCN(C(=O)CC[NH2+]C[C@H]2CNc3c(-c4nn[n-]n4)cnn3C2)CC1 ZINC000736855917 598530922 /nfs/dbraw/zinc/53/09/22/598530922.db2.gz GOMKQMDLZSSDNA-LBPRGKRZSA-N 0 3 374.453 -1.141 20 0 FAADHN CN1CCN(C(=O)CC[NH2+]C[C@H]2CNc3c(-c4nnn[n-]4)cnn3C2)CC1 ZINC000736855917 598530920 /nfs/dbraw/zinc/53/09/20/598530920.db2.gz GOMKQMDLZSSDNA-LBPRGKRZSA-N 0 3 374.453 -1.141 20 0 FAADHN CN1CCN(C(=O)C[NH2+]C[C@@H]2CNc3c(-c4nn[n-]n4)cnn3C2)CC1 ZINC000736856586 598526098 /nfs/dbraw/zinc/52/60/98/598526098.db2.gz KUGUOJVNNPZZJU-LLVKDONJSA-N 0 3 360.426 -1.532 20 0 FAADHN CN1CCN(C(=O)C[NH2+]C[C@@H]2CNc3c(-c4nnn[n-]4)cnn3C2)CC1 ZINC000736856586 598526096 /nfs/dbraw/zinc/52/60/96/598526096.db2.gz KUGUOJVNNPZZJU-LLVKDONJSA-N 0 3 360.426 -1.532 20 0 FAADHN CN1CCN(C(=O)C[NH2+]C[C@H]2CNc3c(-c4nn[n-]n4)cnn3C2)CC1 ZINC000736856595 598526328 /nfs/dbraw/zinc/52/63/28/598526328.db2.gz KUGUOJVNNPZZJU-NSHDSACASA-N 0 3 360.426 -1.532 20 0 FAADHN CN1CCN(C(=O)C[NH2+]C[C@H]2CNc3c(-c4nnn[n-]4)cnn3C2)CC1 ZINC000736856595 598526326 /nfs/dbraw/zinc/52/63/26/598526326.db2.gz KUGUOJVNNPZZJU-NSHDSACASA-N 0 3 360.426 -1.532 20 0 FAADHN CS(=O)(=O)CCS(=O)(=O)N1CCN(C(=O)CN2CCCC2)CC1 ZINC000742289729 658444728 /nfs/dbraw/zinc/44/47/28/658444728.db2.gz BIKWCCOVNUGUAC-UHFFFAOYSA-N 0 3 367.493 -1.399 20 0 FAADHN CCN(CC)CC(=O)N1CCN(S(=O)(=O)CCS(C)(=O)=O)CC1 ZINC000742290955 658445104 /nfs/dbraw/zinc/44/51/04/658445104.db2.gz UXFCSCQBXYDDSC-UHFFFAOYSA-N 0 3 369.509 -1.153 20 0 FAADHN CCS(=O)(=O)N1CCN(CN2C(=O)NC3(CCN(C)CC3)C2=O)CC1 ZINC000748080062 658455574 /nfs/dbraw/zinc/45/55/74/658455574.db2.gz PSKMOUWCHQAJSG-UHFFFAOYSA-N 0 3 373.479 -1.073 20 0 FAADHN CNS(=O)(=O)C[C@H]1CCCN1CN1C(=O)NC2(CCN(C)CC2)C1=O ZINC000749968916 658461891 /nfs/dbraw/zinc/46/18/91/658461891.db2.gz QDKDVJPFJMJYII-GFCCVEGCSA-N 0 3 373.479 -1.026 20 0 FAADHN CNS(=O)(=O)C[C@@H]1CCCN1CN1C(=O)NC2(CCN(C)CC2)C1=O ZINC000749968917 658461472 /nfs/dbraw/zinc/46/14/72/658461472.db2.gz QDKDVJPFJMJYII-LBPRGKRZSA-N 0 3 373.479 -1.026 20 0 FAADHN CN(CCN1CCCS1(=O)=O)CN1C(=O)NC2(CCN(C)CC2)C1=O ZINC000751934419 658469313 /nfs/dbraw/zinc/46/93/13/658469313.db2.gz MJFWTOYILSQZJH-UHFFFAOYSA-N 0 3 373.479 -1.073 20 0 FAADHN CN(C)C(=O)COC1CN(CN2C(=O)NC3(CCN(C)CC3)C2=O)C1 ZINC000751944033 658469056 /nfs/dbraw/zinc/46/90/56/658469056.db2.gz QCHKRXOKRSNOEA-UHFFFAOYSA-N 0 3 353.423 -1.251 20 0 FAADHN CN(C)CCN1C[C@@H](C(=O)N2CCN(CC[S@](C)=O)CC2)CC1=O ZINC000754297333 658473915 /nfs/dbraw/zinc/47/39/15/658473915.db2.gz DSZDBLYBVXWYHW-BSEYFRJRSA-N 0 3 358.508 -1.081 20 0 FAADHN CN(C)CCN1C[C@H](C(=O)N2CCN(CC[S@@](C)=O)CC2)CC1=O ZINC000754297334 658473843 /nfs/dbraw/zinc/47/38/43/658473843.db2.gz DSZDBLYBVXWYHW-JBEBIEQOSA-N 0 3 358.508 -1.081 20 0 FAADHN CN(C)CCN1C[C@@H](C(=O)N2CCN(CC[S@@](C)=O)CC2)CC1=O ZINC000754297335 658473660 /nfs/dbraw/zinc/47/36/60/658473660.db2.gz DSZDBLYBVXWYHW-LFPIHBKWSA-N 0 3 358.508 -1.081 20 0 FAADHN CN(C)CCN1C[C@H](C(=O)N2CCN(CC[S@](C)=O)CC2)CC1=O ZINC000754297336 658473835 /nfs/dbraw/zinc/47/38/35/658473835.db2.gz DSZDBLYBVXWYHW-SHACYNPGSA-N 0 3 358.508 -1.081 20 0 FAADHN CNc1nc(NCCS(C)(=O)=O)nc(NCCS(C)(=O)=O)n1 ZINC000758269273 658484601 /nfs/dbraw/zinc/48/46/01/658484601.db2.gz AAPYJIARSZYLAU-UHFFFAOYSA-N 0 3 352.442 -1.174 20 0 FAADHN CS(=O)(=O)N1CCN(CC(=O)NC[C@H]2CN3CCC[C@H]3CO2)CC1 ZINC000759622500 658489626 /nfs/dbraw/zinc/48/96/26/658489626.db2.gz SMAFWNPWQUQIIJ-KBPBESRZSA-N 0 3 360.480 -1.457 20 0 FAADHN CS(=O)(=O)N1CCN(CC(=O)NC[C@H]2CN3CCC[C@@H]3CO2)CC1 ZINC000759622532 658489529 /nfs/dbraw/zinc/48/95/29/658489529.db2.gz SMAFWNPWQUQIIJ-KGLIPLIRSA-N 0 3 360.480 -1.457 20 0 FAADHN CS(=O)(=O)N1CCN(CC(=O)NC[C@@H]2CN3CCC[C@H]3CO2)CC1 ZINC000759622536 658489807 /nfs/dbraw/zinc/48/98/07/658489807.db2.gz SMAFWNPWQUQIIJ-UONOGXRCSA-N 0 3 360.480 -1.457 20 0 FAADHN CS(=O)(=O)N1CCN(CC(=O)NC[C@@H]2CN3CCC[C@@H]3CO2)CC1 ZINC000759622539 658489119 /nfs/dbraw/zinc/48/91/19/658489119.db2.gz SMAFWNPWQUQIIJ-ZIAGYGMSSA-N 0 3 360.480 -1.457 20 0 FAADHN CN1CC[C@@](O)(CNC(=O)NCCS(=O)(=O)N2CCOCC2)C1 ZINC000763028152 658499368 /nfs/dbraw/zinc/49/93/68/658499368.db2.gz HBTJSTARDKOKLH-CYBMUJFWSA-N 0 3 350.441 -1.986 20 0 FAADHN CN1CC[C@](O)(CNC(=O)NCCS(=O)(=O)N2CCOCC2)C1 ZINC000763028163 658499311 /nfs/dbraw/zinc/49/93/11/658499311.db2.gz HBTJSTARDKOKLH-ZDUSSCGKSA-N 0 3 350.441 -1.986 20 0 FAADHN COCCN1CCN(CN2C(=O)NC3(CCN(C)CC3)C2=O)CC1=O ZINC000768467905 658512051 /nfs/dbraw/zinc/51/20/51/658512051.db2.gz NDCYQWKUZZUFSV-UHFFFAOYSA-N 0 3 353.423 -1.249 20 0 FAADHN CCN(CCO)CCNC(=O)NCCS(=O)(=O)N1CCOCC1 ZINC000769496742 658514576 /nfs/dbraw/zinc/51/45/76/658514576.db2.gz XPJPIONCRDEAGP-UHFFFAOYSA-N 0 3 352.457 -1.738 20 0 FAADHN CCNS(=O)(=O)[C@@H]1CCN(CN2C(=O)NC3(CCN(C)CC3)C2=O)C1 ZINC000770674590 658518747 /nfs/dbraw/zinc/51/87/47/658518747.db2.gz IAWIGRDCCBWVSP-GFCCVEGCSA-N 0 3 373.479 -1.026 20 0 FAADHN CCNS(=O)(=O)[C@H]1CCN(CN2C(=O)NC3(CCN(C)CC3)C2=O)C1 ZINC000770674594 658518366 /nfs/dbraw/zinc/51/83/66/658518366.db2.gz IAWIGRDCCBWVSP-LBPRGKRZSA-N 0 3 373.479 -1.026 20 0 FAADHN CN(C)CCN1C[C@@H](C(=O)N2CCC(C(=O)NCCO)CC2)CC1=O ZINC000771776345 658519617 /nfs/dbraw/zinc/51/96/17/658519617.db2.gz HMAAVPUJMXYWIC-AWEZNQCLSA-N 0 3 354.451 -1.256 20 0 FAADHN CN(C)CCN1C[C@H](C(=O)N2CCC(C(=O)NCCO)CC2)CC1=O ZINC000771776346 658520417 /nfs/dbraw/zinc/52/04/17/658520417.db2.gz HMAAVPUJMXYWIC-CQSZACIVSA-N 0 3 354.451 -1.256 20 0 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CC[S@@](=O)CCNC(=O)C(=O)NCCCN1CCC[C@@H]1C(=O)N(C)C ZINC000804261776 658587732 /nfs/dbraw/zinc/58/77/32/658587732.db2.gz VMDSPSYKUCEJGG-YMXBGEKHSA-N 0 3 374.507 -1.070 20 0 FAADHN CC[S@@](=O)CCNC(=O)C(=O)NCCCN1CCC[C@H]1C(=O)N(C)C ZINC000804261777 658587922 /nfs/dbraw/zinc/58/79/22/658587922.db2.gz VMDSPSYKUCEJGG-ZJWNCGCPSA-N 0 3 374.507 -1.070 20 0 FAADHN CCS(=O)(=O)CCNC(=O)C(=O)NCCN1CCN(C)C(C)(C)C1 ZINC000804547237 658589193 /nfs/dbraw/zinc/58/91/93/658589193.db2.gz TUSPIVGDDZSVBK-UHFFFAOYSA-N 0 3 362.496 -1.321 20 0 FAADHN CN1CCC[C@H]1C(=O)N1CCN(C(=O)C(=O)NCC[S@@](C)=O)CC1 ZINC000804993010 658465247 /nfs/dbraw/zinc/46/52/47/658465247.db2.gz JCRCVTRWTGEKKH-FNODVLLQSA-N 0 3 358.464 -1.754 20 0 FAADHN CN1CCC[C@H]1C(=O)N1CCN(C(=O)C(=O)NCC[S@](C)=O)CC1 ZINC000804993011 658464915 /nfs/dbraw/zinc/46/49/15/658464915.db2.gz JCRCVTRWTGEKKH-MCFWBGNESA-N 0 3 358.464 -1.754 20 0 FAADHN CN1CCC[C@@H]1C(=O)N1CCN(C(=O)C(=O)NCC[S@@](C)=O)CC1 ZINC000804993012 658464829 /nfs/dbraw/zinc/46/48/29/658464829.db2.gz JCRCVTRWTGEKKH-OIRASMEMSA-N 0 3 358.464 -1.754 20 0 FAADHN CN1CCC[C@@H]1C(=O)N1CCN(C(=O)C(=O)NCC[S@](C)=O)CC1 ZINC000804993013 658465141 /nfs/dbraw/zinc/46/51/41/658465141.db2.gz JCRCVTRWTGEKKH-YYUOZPCZSA-N 0 3 358.464 -1.754 20 0 FAADHN CCN(CC)CC(=O)N1CCN(C(=O)C(=O)NCC[S@](C)=O)CC1 ZINC000805001186 658468237 /nfs/dbraw/zinc/46/82/37/658468237.db2.gz ZZEGMVPEOZWUIJ-DEOSSOPVSA-N 0 3 360.480 -1.506 20 0 FAADHN CCN(CC)CC(=O)N1CCN(C(=O)C(=O)NCC[S@@](C)=O)CC1 ZINC000805001189 658468480 /nfs/dbraw/zinc/46/84/80/658468480.db2.gz ZZEGMVPEOZWUIJ-XMMPIXPASA-N 0 3 360.480 -1.506 20 0 FAADHN C[S@](=O)CCNC(=O)C(=O)N1CCN(C(=O)CN2CCCC2)CC1 ZINC000805003230 658468175 /nfs/dbraw/zinc/46/81/75/658468175.db2.gz MLLDJNRWMIHQHS-DEOSSOPVSA-N 0 3 358.464 -1.752 20 0 FAADHN C[S@@](=O)CCNC(=O)C(=O)N1CCN(C(=O)CN2CCCC2)CC1 ZINC000805003231 658468435 /nfs/dbraw/zinc/46/84/35/658468435.db2.gz MLLDJNRWMIHQHS-XMMPIXPASA-N 0 3 358.464 -1.752 20 0 FAADHN CC[S@](=O)CCNC(=O)C(=O)N1CCN(C(=O)[C@@H]2CCCN2C)CC1 ZINC000805607747 658534775 /nfs/dbraw/zinc/53/47/75/658534775.db2.gz ZXXYRIBRUKXTOG-CANCMXDXSA-N 0 3 372.491 -1.364 20 0 FAADHN CC[S@](=O)CCNC(=O)C(=O)N1CCN(C(=O)[C@H]2CCCN2C)CC1 ZINC000805607748 658534860 /nfs/dbraw/zinc/53/48/60/658534860.db2.gz ZXXYRIBRUKXTOG-SHZVTRLKSA-N 0 3 372.491 -1.364 20 0 FAADHN CC[S@@](=O)CCNC(=O)C(=O)N1CCN(C(=O)[C@H]2CCCN2C)CC1 ZINC000805607749 658534650 /nfs/dbraw/zinc/53/46/50/658534650.db2.gz ZXXYRIBRUKXTOG-YMXBGEKHSA-N 0 3 372.491 -1.364 20 0 FAADHN CC[S@@](=O)CCNC(=O)C(=O)N1CCN(C(=O)[C@@H]2CCCN2C)CC1 ZINC000805607750 658534583 /nfs/dbraw/zinc/53/45/83/658534583.db2.gz ZXXYRIBRUKXTOG-ZJWNCGCPSA-N 0 3 372.491 -1.364 20 0 FAADHN CCN(CC)CC(=O)N1CCN(C(=O)C(=O)NCC[S@](=O)CC)CC1 ZINC000805618356 658538139 /nfs/dbraw/zinc/53/81/39/658538139.db2.gz XSAKDJBYNKSJBH-RUZDIDTESA-N 0 3 374.507 -1.116 20 0 FAADHN CCN(CC)CC(=O)N1CCN(C(=O)C(=O)NCC[S@@](=O)CC)CC1 ZINC000805618357 658538362 /nfs/dbraw/zinc/53/83/62/658538362.db2.gz XSAKDJBYNKSJBH-VWLOTQADSA-N 0 3 374.507 -1.116 20 0 FAADHN CC[S@@](=O)CCNC(=O)C(=O)N1CCN(C(=O)CN2CCCC2)CC1 ZINC000805619299 658538114 /nfs/dbraw/zinc/53/81/14/658538114.db2.gz AYGVGAHSLNVKPR-RUZDIDTESA-N 0 3 372.491 -1.362 20 0 FAADHN CC[S@](=O)CCNC(=O)C(=O)N1CCN(C(=O)CN2CCCC2)CC1 ZINC000805619301 658538381 /nfs/dbraw/zinc/53/83/81/658538381.db2.gz AYGVGAHSLNVKPR-VWLOTQADSA-N 0 3 372.491 -1.362 20 0 FAADHN C[C@@H]1CN(C)C(=O)CN1C(=O)C(=O)NCCN1CCN(C)C(C)(C)C1 ZINC000806785745 658592817 /nfs/dbraw/zinc/59/28/17/658592817.db2.gz BLIVHTHBMIWIKP-CYBMUJFWSA-N 0 3 353.467 -1.182 20 0 FAADHN C[C@H]1CN(C)C(=O)CN1C(=O)C(=O)NCCN1CCN(C)C(C)(C)C1 ZINC000806785752 658592878 /nfs/dbraw/zinc/59/28/78/658592878.db2.gz BLIVHTHBMIWIKP-ZDUSSCGKSA-N 0 3 353.467 -1.182 20 0 FAADHN CN(C)C[C@H](CO)NC(=O)C1=NN([C@@H]2CCS(=O)(=O)C2)C(=O)CC1 ZINC000808170427 658595158 /nfs/dbraw/zinc/59/51/58/658595158.db2.gz AHBJTHIPWJRNAL-GHMZBOCLSA-N 0 3 360.436 -1.809 20 0 FAADHN CN(C)C[C@H](CO)NC(=O)C1=NN([C@H]2CCS(=O)(=O)C2)C(=O)CC1 ZINC000808170428 658595790 /nfs/dbraw/zinc/59/57/90/658595790.db2.gz AHBJTHIPWJRNAL-MNOVXSKESA-N 0 3 360.436 -1.809 20 0 FAADHN CN(C)C[C@@H](CO)NC(=O)C1=NN([C@H]2CCS(=O)(=O)C2)C(=O)CC1 ZINC000808170429 658595582 /nfs/dbraw/zinc/59/55/82/658595582.db2.gz AHBJTHIPWJRNAL-QWRGUYRKSA-N 0 3 360.436 -1.809 20 0 FAADHN CN(C)C[C@@H](CO)NC(=O)C1=NN([C@@H]2CCS(=O)(=O)C2)C(=O)CC1 ZINC000808170430 658595421 /nfs/dbraw/zinc/59/54/21/658595421.db2.gz AHBJTHIPWJRNAL-WDEREUQCSA-N 0 3 360.436 -1.809 20 0 FAADHN COCCN(C)CCN1C[C@H](NC(=O)C2=NN(C)C(=O)CC2)CC1=O ZINC000808270452 658595403 /nfs/dbraw/zinc/59/54/03/658595403.db2.gz XACGOWJUTQORTD-GFCCVEGCSA-N 0 3 353.423 -1.110 20 0 FAADHN COCCN(C)CCN1C[C@@H](NC(=O)C2=NN(C)C(=O)CC2)CC1=O ZINC000808270453 658595907 /nfs/dbraw/zinc/59/59/07/658595907.db2.gz XACGOWJUTQORTD-LBPRGKRZSA-N 0 3 353.423 -1.110 20 0 FAADHN CCN(CC)CC(=O)N1CCN(C(=O)C(=O)Nc2cnnn2C)CC1 ZINC000810360920 658601152 /nfs/dbraw/zinc/60/11/52/658601152.db2.gz BLPXLSWPOSXELG-UHFFFAOYSA-N 0 3 351.411 -1.234 20 0 FAADHN CC1(C)CN(C(=O)C(=O)NC[C@@H]2CN3CCC[C@H]3CO2)C[C@H](CO)O1 ZINC000817815390 658616941 /nfs/dbraw/zinc/61/69/41/658616941.db2.gz WMPUSEBPVDPGQZ-BFHYXJOUSA-N 0 3 355.435 -1.036 20 0 FAADHN CC1(C)CN(C(=O)C(=O)NC[C@@H]2CN3CCC[C@@H]3CO2)C[C@@H](CO)O1 ZINC000817815396 658617339 /nfs/dbraw/zinc/61/73/39/658617339.db2.gz WMPUSEBPVDPGQZ-MCIONIFRSA-N 0 3 355.435 -1.036 20 0 FAADHN CC1(C)CN(C(=O)C(=O)NC[C@@H]2CN3CCC[C@@H]3CO2)C[C@H](CO)O1 ZINC000817815399 658616740 /nfs/dbraw/zinc/61/67/40/658616740.db2.gz WMPUSEBPVDPGQZ-MGPQQGTHSA-N 0 3 355.435 -1.036 20 0 FAADHN CC1(C)CN(C(=O)C(=O)NC[C@@H]2CN3CCC[C@H]3CO2)C[C@@H](CO)O1 ZINC000817815402 658616953 /nfs/dbraw/zinc/61/69/53/658616953.db2.gz WMPUSEBPVDPGQZ-MJBXVCDLSA-N 0 3 355.435 -1.036 20 0 FAADHN CCN1CCN(CCNS(=O)(=O)CCS(=O)(=O)N(C)C)CC1 ZINC000820796717 658630713 /nfs/dbraw/zinc/63/07/13/658630713.db2.gz RKJWXEROIWSWIA-UHFFFAOYSA-N 0 3 356.514 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CN1CC[C@H]1CNC(=O)C(=O)N1CCN(C(=O)[C@H]2CCCN2C)CC1 ZINC000931880697 658812430 /nfs/dbraw/zinc/81/24/30/658812430.db2.gz KOHCVWBAMDKPSC-UONOGXRCSA-N 0 3 351.451 -1.428 20 0 FAADHN CN1CC[C@@H]1CNC(=O)C(=O)N1CCN(C(=O)[C@H]2CCCN2C)CC1 ZINC000931880698 658811888 /nfs/dbraw/zinc/81/18/88/658811888.db2.gz KOHCVWBAMDKPSC-ZIAGYGMSSA-N 0 3 351.451 -1.428 20 0 FAADHN COC1(C(=O)N2CCN(C(=O)CN3CCCC3)CC2)CS(=O)(=O)C1 ZINC000931898828 658812578 /nfs/dbraw/zinc/81/25/78/658812578.db2.gz PCYXICSPUUTVBM-UHFFFAOYSA-N 0 3 359.448 -1.433 20 0 FAADHN CCN(CC)CC(=O)N1CCN(C(=O)C2(OC)CS(=O)(=O)C2)CC1 ZINC000931957132 658813309 /nfs/dbraw/zinc/81/33/09/658813309.db2.gz JUFQNPDJWHDOQM-UHFFFAOYSA-N 0 3 361.464 -1.187 20 0 FAADHN CN(C)C(=O)CN1CCN(C(=O)CN2CC[C@H](C3OCCO3)C2)CC1 ZINC000932007491 658812840 /nfs/dbraw/zinc/81/28/40/658812840.db2.gz HFYXDVAHFXSTNL-AWEZNQCLSA-N 0 3 354.451 -1.086 20 0 FAADHN CN(C)C(=O)CN1CCN(C(=O)CN2CC[C@@H](C3OCCO3)C2)CC1 ZINC000932007492 658812974 /nfs/dbraw/zinc/81/29/74/658812974.db2.gz HFYXDVAHFXSTNL-CQSZACIVSA-N 0 3 354.451 -1.086 20 0 FAADHN C[C@H]1COC[C@@H]1NC(=O)C(=O)N1CCN(C(=O)CN2CCCC2)CC1 ZINC000932077782 658813067 /nfs/dbraw/zinc/81/30/67/658813067.db2.gz HTZDCZLQVBSZQP-KBPBESRZSA-N 0 3 352.435 -1.096 20 0 FAADHN C[C@@H]1COC[C@@H]1NC(=O)C(=O)N1CCN(C(=O)CN2CCCC2)CC1 ZINC000932077784 658813453 /nfs/dbraw/zinc/81/34/53/658813453.db2.gz HTZDCZLQVBSZQP-KGLIPLIRSA-N 0 3 352.435 -1.096 20 0 FAADHN C[C@H]1COC[C@H]1NC(=O)C(=O)N1CCN(C(=O)CN2CCCC2)CC1 ZINC000932077787 658813210 /nfs/dbraw/zinc/81/32/10/658813210.db2.gz HTZDCZLQVBSZQP-UONOGXRCSA-N 0 3 352.435 -1.096 20 0 FAADHN C[C@@H]1COC[C@H]1NC(=O)C(=O)N1CCN(C(=O)CN2CCCC2)CC1 ZINC000932077789 658813554 /nfs/dbraw/zinc/81/35/54/658813554.db2.gz HTZDCZLQVBSZQP-ZIAGYGMSSA-N 0 3 352.435 -1.096 20 0 FAADHN C[C@@H]1COC[C@@H]1NC(=O)C(=O)N1CCN(C(=O)[C@H]2CCCN2C)CC1 ZINC000932084146 658814369 /nfs/dbraw/zinc/81/43/69/658814369.db2.gz LUISIMDTQAWNOJ-HZSPNIEDSA-N 0 3 352.435 -1.098 20 0 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CC(=O)N1CCO[C@H](C(=O)N2CCN(C(=O)[C@@H]3CCCN3C)CC2)C1 ZINC000934895671 658818610 /nfs/dbraw/zinc/81/86/10/658818610.db2.gz NODCORMTPHSOGU-GJZGRUSLSA-N 0 3 352.435 -1.001 20 0 FAADHN CC(=O)N1CCO[C@@H](C(=O)N2CCN(C(=O)[C@H]3CCCN3C)CC2)C1 ZINC000934895672 658818808 /nfs/dbraw/zinc/81/88/08/658818808.db2.gz NODCORMTPHSOGU-HUUCEWRRSA-N 0 3 352.435 -1.001 20 0 FAADHN CC(=O)N1CCO[C@@H](C(=O)N2CCN(C(=O)[C@@H]3CCCN3C)CC2)C1 ZINC000934895674 658818425 /nfs/dbraw/zinc/81/84/25/658818425.db2.gz NODCORMTPHSOGU-LSDHHAIUSA-N 0 3 352.435 -1.001 20 0 FAADHN COCCN(C)CCN1C[C@H](NC(=O)[C@@H]2CSCC(=O)N2)CC1=O ZINC000936010843 658820036 /nfs/dbraw/zinc/82/00/36/658820036.db2.gz NFDAAJRNPOZCAU-NEPJUHHUSA-N 0 3 358.464 -1.487 20 0 FAADHN COCCN(C)CCN1C[C@@H](NC(=O)[C@@H]2CSCC(=O)N2)CC1=O ZINC000936010844 658820094 /nfs/dbraw/zinc/82/00/94/658820094.db2.gz NFDAAJRNPOZCAU-RYUDHWBXSA-N 0 3 358.464 -1.487 20 0 FAADHN CN1CCC[C@@H]1C(=O)N1C[C@@H]2C[C@H]1CN2C(=O)[C@H]1CC[C@@H](C(N)=O)O1 ZINC000937546745 657864782 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/nfs/dbraw/zinc/92/43/58/658924358.db2.gz CHAMYKWQBVSBAW-SDDRHHMPSA-N 0 3 351.411 -1.398 20 0 FAADHN CC[C@H](C(=O)N1C[C@H]2OCCN(C(=O)c3nnn(C)n3)[C@H]2C1)N(C)C ZINC000960770613 658926680 /nfs/dbraw/zinc/92/66/80/658926680.db2.gz REUVZNBJUDGUGU-GRYCIOLGSA-N 0 3 351.411 -1.398 20 0 FAADHN CC[C@@H](C(=O)N1C[C@H]2OCCN(C(=O)c3nnn(C)n3)[C@H]2C1)N(C)C ZINC000960782727 658927217 /nfs/dbraw/zinc/92/72/17/658927217.db2.gz REUVZNBJUDGUGU-SDDRHHMPSA-N 0 3 351.411 -1.398 20 0 FAADHN C[C@H](C(=O)N1C[C@H]2OCCN(C(=O)Cc3c[nH]cn3)[C@H]2C1)S(C)(=O)=O ZINC000961064600 658931702 /nfs/dbraw/zinc/93/17/02/658931702.db2.gz MEAGVPSESMWNBQ-KGYLQXTDSA-N 0 3 370.431 -1.177 20 0 FAADHN C[C@@H](C(=O)N1C[C@H]2OCCN(C(=O)Cc3c[nH]cn3)[C@H]2C1)S(C)(=O)=O ZINC000961064602 658931888 /nfs/dbraw/zinc/93/18/88/658931888.db2.gz MEAGVPSESMWNBQ-WCFLWFBJSA-N 0 3 370.431 -1.177 20 0 FAADHN CC(C)(C(=O)N1C[C@@H](NC(=O)Cn2cnnn2)[C@@H](O)C1)N1CCCC1 ZINC000961429602 658938054 /nfs/dbraw/zinc/93/80/54/658938054.db2.gz MHUWLTMYYBHCHG-NEPJUHHUSA-N 0 3 351.411 -1.765 20 0 FAADHN CCCN1CCC[C@H]1C(=O)N1C[C@@H](NC(=O)Cn2cnnn2)[C@@H](O)C1 ZINC000961430496 658938336 /nfs/dbraw/zinc/93/83/36/658938336.db2.gz VMFFTBUXJOUGCZ-AGIUHOORSA-N 0 3 351.411 -1.765 20 0 FAADHN CCCN1CCC[C@@H]1C(=O)N1C[C@@H](NC(=O)Cn2cnnn2)[C@@H](O)C1 ZINC000961430499 658938325 /nfs/dbraw/zinc/93/83/25/658938325.db2.gz VMFFTBUXJOUGCZ-UPJWGTAASA-N 0 3 351.411 -1.765 20 0 FAADHN CC(C)N1CCC[C@H]1C(=O)N1C[C@@H](NC(=O)Cn2cnnn2)[C@@H](O)C1 ZINC000961446701 658939034 /nfs/dbraw/zinc/93/90/34/658939034.db2.gz MAVIGFOJIWFCEA-AGIUHOORSA-N 0 3 351.411 -1.766 20 0 FAADHN CC(C)N1CCC[C@@H]1C(=O)N1C[C@@H](NC(=O)Cn2cnnn2)[C@@H](O)C1 ZINC000961446703 658939157 /nfs/dbraw/zinc/93/91/57/658939157.db2.gz MAVIGFOJIWFCEA-UPJWGTAASA-N 0 3 351.411 -1.766 20 0 FAADHN CC(C)[C@H](C(=O)N1C[C@@H](NC(=O)CN2CCCC2=O)[C@@H](O)C1)N(C)C ZINC000961458592 658939298 /nfs/dbraw/zinc/93/92/98/658939298.db2.gz IPKFVNDBUDUYRM-DVOMOZLQSA-N 0 3 354.451 -1.117 20 0 FAADHN CC(C)[C@@H](C(=O)N1C[C@@H](NC(=O)CN2CCCC2=O)[C@@H](O)C1)N(C)C ZINC000961458595 658939335 /nfs/dbraw/zinc/93/93/35/658939335.db2.gz IPKFVNDBUDUYRM-WWGRRREGSA-N 0 3 354.451 -1.117 20 0 FAADHN CN(CC(=O)N1C[C@@H](NC(=O)CN2CCCC2=O)[C@@H](O)C1)C1CCC1 ZINC000961471617 658939596 /nfs/dbraw/zinc/93/95/96/658939596.db2.gz BKCKXRKPVWWEDM-KGLIPLIRSA-N 0 3 352.435 -1.219 20 0 FAADHN CN(C)C1(C(=O)N2C[C@@H](NC(=O)CN3CCCC3=O)[C@@H](O)C2)CCC1 ZINC000961472804 658939829 /nfs/dbraw/zinc/93/98/29/658939829.db2.gz HTNALYCPPMTIEQ-OLZOCXBDSA-N 0 3 352.435 -1.219 20 0 FAADHN C[C@@H]1CCN(CC(=O)N2C[C@@H](NC(=O)CN3CCCC3=O)[C@@H](O)C2)C1 ZINC000961473734 658939849 /nfs/dbraw/zinc/93/98/49/658939849.db2.gz JVFCOHIGBKYRQE-MCIONIFRSA-N 0 3 352.435 -1.362 20 0 FAADHN C[C@H]1CCN(CC(=O)N2C[C@@H](NC(=O)CN3CCCC3=O)[C@@H](O)C2)C1 ZINC000961473735 658939891 /nfs/dbraw/zinc/93/98/91/658939891.db2.gz JVFCOHIGBKYRQE-MJBXVCDLSA-N 0 3 352.435 -1.362 20 0 FAADHN C[C@@H]1CCCN1CC(=O)N1C[C@@H](NC(=O)CN2CCCC2=O)[C@@H](O)C1 ZINC000961475916 658939929 /nfs/dbraw/zinc/93/99/29/658939929.db2.gz YXFVRCIPTARLMC-MCIONIFRSA-N 0 3 352.435 -1.219 20 0 FAADHN C[C@H]1CCCN1CC(=O)N1C[C@@H](NC(=O)CN2CCCC2=O)[C@@H](O)C1 ZINC000961475918 658939921 /nfs/dbraw/zinc/93/99/21/658939921.db2.gz YXFVRCIPTARLMC-MJBXVCDLSA-N 0 3 352.435 -1.219 20 0 FAADHN CN(C)[C@@H](C(=O)N1C[C@@H](NC(=O)CN2CCCC2=O)[C@@H](O)C1)C1CC1 ZINC000961475965 658939915 /nfs/dbraw/zinc/93/99/15/658939915.db2.gz ZPLFQTCIFKIFLS-DVOMOZLQSA-N 0 3 352.435 -1.363 20 0 FAADHN CN(C)[C@H](C(=O)N1C[C@@H](NC(=O)CN2CCCC2=O)[C@@H](O)C1)C1CC1 ZINC000961475967 658939853 /nfs/dbraw/zinc/93/98/53/658939853.db2.gz ZPLFQTCIFKIFLS-WWGRRREGSA-N 0 3 352.435 -1.363 20 0 FAADHN CC(C)(C(=O)N1C[C@@H](NC(=O)[C@H]2COCCO2)[C@@H](O)C1)N1CCCC1 ZINC000961654356 658943053 /nfs/dbraw/zinc/94/30/53/658943053.db2.gz GBPFOLMAHLJOSF-HZSPNIEDSA-N 0 3 355.435 -1.036 20 0 FAADHN CC(C)(C(=O)N1C[C@@H](NC(=O)[C@@H]2COCCO2)[C@@H](O)C1)N1CCCC1 ZINC000961654359 658943133 /nfs/dbraw/zinc/94/31/33/658943133.db2.gz GBPFOLMAHLJOSF-RDBSUJKOSA-N 0 3 355.435 -1.036 20 0 FAADHN NC(=O)[C@@H]1CC[C@H](C(=O)N[C@@H]2[C@H]3CN(CCN4CCNC4=O)C[C@H]32)O1 ZINC000961742849 658951954 /nfs/dbraw/zinc/95/19/54/658951954.db2.gz INFCAXSPXJWIPO-OBPIAQAESA-N 0 3 351.407 -1.909 20 0 FAADHN NC(=O)[C@@H]1CC[C@H](C(=O)N[C@@H]2[C@H]3CN(CCN4CCCC4=O)C[C@H]32)O1 ZINC000961748061 658952622 /nfs/dbraw/zinc/95/26/22/658952622.db2.gz YIBNLHPOMVJJKK-GGAZOKNXSA-N 0 3 350.419 -1.312 20 0 FAADHN CC(C)(C(=O)N1C[C@@H](NC(=O)[C@H]2CCC(=O)N2)[C@@H](O)C1)N1CCCC1 ZINC000961900047 658960984 /nfs/dbraw/zinc/96/09/84/658960984.db2.gz DJBHRFOTEDDFCT-UPJWGTAASA-N 0 3 352.435 -1.173 20 0 FAADHN CC(C)[C@@H](C(=O)N1C[C@@H](NC(=O)c2nccnc2N)[C@@H](O)C1)N(C)C ZINC000961947150 658964899 /nfs/dbraw/zinc/96/48/99/658964899.db2.gz GEHMLFFFESJPRP-MDZLAQPJSA-N 0 3 350.423 -1.054 20 0 FAADHN CC(C)[C@H](C(=O)N1C[C@@H](NC(=O)c2nccnc2N)[C@@H](O)C1)N(C)C ZINC000961947155 658964753 /nfs/dbraw/zinc/96/47/53/658964753.db2.gz 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Cc1c(C(=O)N[C@@H]2CN(C(=O)C3(N(C)C)CCC3)C[C@@H]2O)nnn1C ZINC000962031845 658970790 /nfs/dbraw/zinc/97/07/90/658970790.db2.gz ZXEYFQNNFJDJGM-NEPJUHHUSA-N 0 3 350.423 -1.091 20 0 FAADHN Cc1c(C(=O)N[C@@H]2CN(C(=O)[C@H](C3CC3)N(C)C)C[C@@H]2O)nnn1C ZINC000962031852 658970744 /nfs/dbraw/zinc/97/07/44/658970744.db2.gz ZZDQNFNTTRUCMK-DYEKYZERSA-N 0 3 350.423 -1.235 20 0 FAADHN Cc1c(C(=O)N[C@@H]2CN(C(=O)[C@@H](C3CC3)N(C)C)C[C@@H]2O)nnn1C ZINC000962031855 658970783 /nfs/dbraw/zinc/97/07/83/658970783.db2.gz ZZDQNFNTTRUCMK-MBNYWOFBSA-N 0 3 350.423 -1.235 20 0 FAADHN Cc1c(C(=O)N[C@@H]2CN(C(=O)CN(C)C3CCC3)C[C@@H]2O)nnn1C ZINC000962032834 658971257 /nfs/dbraw/zinc/97/12/57/658971257.db2.gz VCMBBMIQERQCHX-OLZOCXBDSA-N 0 3 350.423 -1.091 20 0 FAADHN CN(CC(=O)N1C[C@@H](NC(=O)[C@@H]2CN(C)CCO2)[C@@H](O)C1)C1CCC1 ZINC000962055657 658975620 /nfs/dbraw/zinc/97/56/20/658975620.db2.gz WZFICEQLEIFOFD-ILXRZTDVSA-N 0 3 354.451 -1.511 20 0 FAADHN CN(CC(=O)N1C[C@@H](NC(=O)[C@H]2CN(C)CCO2)[C@@H](O)C1)C1CCC1 ZINC000962055659 658975654 /nfs/dbraw/zinc/97/56/54/658975654.db2.gz WZFICEQLEIFOFD-QLFBSQMISA-N 0 3 354.451 -1.511 20 0 FAADHN CN1CCO[C@H](C(=O)N[C@@H]2CN(C(=O)CCc3cnn[nH]3)C[C@@H]2O)C1 ZINC000962056209 658975579 /nfs/dbraw/zinc/97/55/79/658975579.db2.gz DUEQAZHIENLNKP-AGIUHOORSA-N 0 3 352.395 -2.244 20 0 FAADHN CN1CCO[C@@H](C(=O)N[C@@H]2CN(C(=O)CCc3cnn[nH]3)C[C@@H]2O)C1 ZINC000962056215 658975498 /nfs/dbraw/zinc/97/54/98/658975498.db2.gz DUEQAZHIENLNKP-FRRDWIJNSA-N 0 3 352.395 -2.244 20 0 FAADHN CN1CC(C(=O)N2C[C@@H](NC(=O)[C@H]3CN(C)CCO3)[C@@H](O)C2)=NC1=O ZINC000962059187 658976292 /nfs/dbraw/zinc/97/62/92/658976292.db2.gz SEWYPKHDKKMGBL-ADEWGFFLSA-N 0 3 353.379 -2.242 20 0 FAADHN CN1CC(C(=O)N2C[C@@H](NC(=O)[C@@H]3CN(C)CCO3)[C@@H](O)C2)=NC1=O ZINC000962059189 658976255 /nfs/dbraw/zinc/97/62/55/658976255.db2.gz SEWYPKHDKKMGBL-USWWRNFRSA-N 0 3 353.379 -2.242 20 0 FAADHN CN(C)C1(C(=O)N2C[C@@H](NC(=O)[C@H]3CN(C)CCO3)[C@@H](O)C2)CCC1 ZINC000962060071 658976518 /nfs/dbraw/zinc/97/65/18/658976518.db2.gz YYEBWQNNKDKBPV-HZSPNIEDSA-N 0 3 354.451 -1.511 20 0 FAADHN CN(C)C1(C(=O)N2C[C@@H](NC(=O)[C@@H]3CN(C)CCO3)[C@@H](O)C2)CCC1 ZINC000962060082 658976452 /nfs/dbraw/zinc/97/64/52/658976452.db2.gz YYEBWQNNKDKBPV-RDBSUJKOSA-N 0 3 354.451 -1.511 20 0 FAADHN CN(CC(=O)N1C[C@@H](NC(=O)[C@@H]2CCNC(=O)C2)[C@@H](O)C1)C1CCC1 ZINC000962243769 658981278 /nfs/dbraw/zinc/98/12/78/658981278.db2.gz KHOCKFZTJBHRMI-BNOWGMLFSA-N 0 3 352.435 -1.315 20 0 FAADHN CN(CC(=O)N1C[C@@H](NC(=O)[C@H]2CCNC(=O)C2)[C@@H](O)C1)C1CCC1 ZINC000962243770 658981286 /nfs/dbraw/zinc/98/12/86/658981286.db2.gz KHOCKFZTJBHRMI-YUTCNCBUSA-N 0 3 352.435 -1.315 20 0 FAADHN CN(C)C1(C(=O)N2C[C@@H](NC(=O)[C@@H]3CCNC(=O)C3)[C@@H](O)C2)CCC1 ZINC000962244307 658981386 /nfs/dbraw/zinc/98/13/86/658981386.db2.gz OVSFVPLUNXLECN-UPJWGTAASA-N 0 3 352.435 -1.315 20 0 FAADHN CN(C)C1(C(=O)N2C[C@@H](NC(=O)[C@H]3CCNC(=O)C3)[C@@H](O)C2)CCC1 ZINC000962244308 658981340 /nfs/dbraw/zinc/98/13/40/658981340.db2.gz 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ZINICSPAYVSBMW-TYNCELHUSA-N 0 3 351.407 -1.051 20 0 FAADHN Cc1nnc(CC(=O)N[C@@H]2CN(C(=O)[C@H](C3CC3)N(C)C)C[C@@H]2O)o1 ZINC000962700463 659021105 /nfs/dbraw/zinc/02/11/05/659021105.db2.gz ZINICSPAYVSBMW-XUJVJEKNSA-N 0 3 351.407 -1.051 20 0 FAADHN CC(C)N1CCC[C@@H]1C(=O)N1C[C@@H](NC(=O)c2cn(C)nn2)[C@@H](O)C1 ZINC000962712349 659022048 /nfs/dbraw/zinc/02/20/48/659022048.db2.gz SMLKIYDHHRZFHH-BNOWGMLFSA-N 0 3 350.423 -1.011 20 0 FAADHN CC(C)N1CCC[C@H]1C(=O)N1C[C@@H](NC(=O)c2cn(C)nn2)[C@@H](O)C1 ZINC000962712350 659022108 /nfs/dbraw/zinc/02/21/08/659022108.db2.gz SMLKIYDHHRZFHH-XBFCOCLRSA-N 0 3 350.423 -1.011 20 0 FAADHN CC(C)N1CCC[C@H]1C(=O)N1C[C@@H](NC(=O)c2ncn(C)n2)[C@@H](O)C1 ZINC000962720991 659024041 /nfs/dbraw/zinc/02/40/41/659024041.db2.gz KGTHXXDOLDOCGE-AGIUHOORSA-N 0 3 350.423 -1.011 20 0 FAADHN CC(C)N1CCC[C@@H]1C(=O)N1C[C@@H](NC(=O)c2ncn(C)n2)[C@@H](O)C1 ZINC000962720993 659023477 /nfs/dbraw/zinc/02/34/77/659023477.db2.gz KGTHXXDOLDOCGE-UPJWGTAASA-N 0 3 350.423 -1.011 20 0 FAADHN CCCN1CCC[C@H]1C(=O)N1C[C@@H](NC(=O)c2ncn(C)n2)[C@@H](O)C1 ZINC000962721272 659024080 /nfs/dbraw/zinc/02/40/80/659024080.db2.gz ANOZNRCVCDVAQF-AGIUHOORSA-N 0 3 350.423 -1.009 20 0 FAADHN CCCN1CCC[C@@H]1C(=O)N1C[C@@H](NC(=O)c2ncn(C)n2)[C@@H](O)C1 ZINC000962721273 659023701 /nfs/dbraw/zinc/02/37/01/659023701.db2.gz ANOZNRCVCDVAQF-UPJWGTAASA-N 0 3 350.423 -1.009 20 0 FAADHN Cn1cnc(C(=O)N[C@@H]2CN(C(=O)C(C)(C)N3CCCC3)C[C@@H]2O)n1 ZINC000962724010 659024758 /nfs/dbraw/zinc/02/47/58/659024758.db2.gz UDLUPHPXNCCSAO-NEPJUHHUSA-N 0 3 350.423 -1.009 20 0 FAADHN CCn1ncc(C(=O)N[C@@H]2CN(C(=O)CN3CC[C@@H](C)C3)C[C@@H]2O)n1 ZINC000962739882 659025800 /nfs/dbraw/zinc/02/58/00/659025800.db2.gz HERFOEZONOVUEG-BNOWGMLFSA-N 0 3 350.423 -1.059 20 0 FAADHN CCn1ncc(C(=O)N[C@@H]2CN(C(=O)CN3CC[C@H](C)C3)C[C@@H]2O)n1 ZINC000962739883 659025455 /nfs/dbraw/zinc/02/54/55/659025455.db2.gz HERFOEZONOVUEG-YUTCNCBUSA-N 0 3 350.423 -1.059 20 0 FAADHN CCn1nncc1C(=O)N[C@@H]1CN(C(=O)CN2CC[C@@H](C)C2)C[C@@H]1O ZINC000962741365 659026389 /nfs/dbraw/zinc/02/63/89/659026389.db2.gz AIWSVVAWKCMTEV-BZPMIXESSA-N 0 3 350.423 -1.059 20 0 FAADHN CCn1nncc1C(=O)N[C@@H]1CN(C(=O)CN2CC[C@H](C)C2)C[C@@H]1O ZINC000962741366 659026535 /nfs/dbraw/zinc/02/65/35/659026535.db2.gz AIWSVVAWKCMTEV-SCRDCRAPSA-N 0 3 350.423 -1.059 20 0 FAADHN CCn1ncc(C(=O)N[C@@H]2CN(C(=O)[C@@H](C3CC3)N(C)C)C[C@@H]2O)n1 ZINC000962741532 659026300 /nfs/dbraw/zinc/02/63/00/659026300.db2.gz VTPFKMAZCBBEPT-HZSPNIEDSA-N 0 3 350.423 -1.060 20 0 FAADHN CCn1ncc(C(=O)N[C@@H]2CN(C(=O)[C@H](C3CC3)N(C)C)C[C@@H]2O)n1 ZINC000962741534 659026064 /nfs/dbraw/zinc/02/60/64/659026064.db2.gz VTPFKMAZCBBEPT-RDBSUJKOSA-N 0 3 350.423 -1.060 20 0 FAADHN CCn1nncc1C(=O)N[C@@H]1CN(C(=O)[C@@H](C2CC2)N(C)C)C[C@@H]1O ZINC000962741785 659026135 /nfs/dbraw/zinc/02/61/35/659026135.db2.gz FTJKWPBOYBYHIK-KWCYVHTRSA-N 0 3 350.423 -1.060 20 0 FAADHN CCn1nncc1C(=O)N[C@@H]1CN(C(=O)[C@H](C2CC2)N(C)C)C[C@@H]1O ZINC000962741786 659026265 /nfs/dbraw/zinc/02/62/65/659026265.db2.gz FTJKWPBOYBYHIK-XBFCOCLRSA-N 0 3 350.423 -1.060 20 0 FAADHN Cc1nnc(CC(=O)N[C@@H]2CN(C(=O)CN(C)C3CCC3)C[C@@H]2O)[nH]1 ZINC000962876364 659031356 /nfs/dbraw/zinc/03/13/56/659031356.db2.gz DEIWUVNSQPMCIP-OLZOCXBDSA-N 0 3 350.423 -1.172 20 0 FAADHN Cc1nnc(CC(=O)N[C@@H]2CN(C(=O)CN3CCC[C@H]3C)C[C@@H]2O)[nH]1 ZINC000962877878 659031030 /nfs/dbraw/zinc/03/10/30/659031030.db2.gz JLPBGDWPPCNYSG-RTXFEEFZSA-N 0 3 350.423 -1.172 20 0 FAADHN Cc1nnc(CC(=O)N[C@@H]2CN(C(=O)CN3CCC[C@@H]3C)C[C@@H]2O)[nH]1 ZINC000962877880 659031437 /nfs/dbraw/zinc/03/14/37/659031437.db2.gz JLPBGDWPPCNYSG-UHTWSYAYSA-N 0 3 350.423 -1.172 20 0 FAADHN Cc1nnc(CC(=O)N[C@@H]2CN(C(=O)C3(N(C)C)CCC3)C[C@@H]2O)[nH]1 ZINC000962879867 659031605 /nfs/dbraw/zinc/03/16/05/659031605.db2.gz SOSVCMLGOVZMMU-NEPJUHHUSA-N 0 3 350.423 -1.172 20 0 FAADHN Cc1nnc(CC(=O)N[C@@H]2CN(C(=O)CN3CC[C@@H](C)C3)C[C@@H]2O)[nH]1 ZINC000962879868 659032133 /nfs/dbraw/zinc/03/21/33/659032133.db2.gz SQINKNQDUGRCNZ-RTXFEEFZSA-N 0 3 350.423 -1.315 20 0 FAADHN Cc1nnc(CC(=O)N[C@@H]2CN(C(=O)CN3CC[C@H](C)C3)C[C@@H]2O)[nH]1 ZINC000962879869 659031962 /nfs/dbraw/zinc/03/19/62/659031962.db2.gz SQINKNQDUGRCNZ-UHTWSYAYSA-N 0 3 350.423 -1.315 20 0 FAADHN CC[C@H](C(=O)N1C[C@@H](NC(=O)CN2C(=O)CCC2=O)[C@@H](O)C1)N(C)C ZINC000962931574 659034351 /nfs/dbraw/zinc/03/43/51/659034351.db2.gz NKDJVDWYLJCNHN-UTUOFQBUSA-N 0 3 354.407 -1.837 20 0 FAADHN CC[C@@H](C(=O)N1C[C@@H](NC(=O)CN2C(=O)CCC2=O)[C@@H](O)C1)N(C)C ZINC000962931575 659034051 /nfs/dbraw/zinc/03/40/51/659034051.db2.gz NKDJVDWYLJCNHN-WOPDTQHZSA-N 0 3 354.407 -1.837 20 0 FAADHN CC[C@H](C(=O)N1C[C@@H](NC(=O)Cn2ccccc2=O)[C@@H](O)C1)N(C)C ZINC000962953532 659035333 /nfs/dbraw/zinc/03/53/33/659035333.db2.gz SFEZYBJPVJZPLC-MCIONIFRSA-N 0 3 350.419 -1.124 20 0 FAADHN CC[C@@H](C(=O)N1C[C@@H](NC(=O)Cn2ccccc2=O)[C@@H](O)C1)N(C)C ZINC000962953534 659035135 /nfs/dbraw/zinc/03/51/35/659035135.db2.gz SFEZYBJPVJZPLC-RDBSUJKOSA-N 0 3 350.419 -1.124 20 0 FAADHN CC(C)N1CCC[C@@H]1C(=O)N[C@@H]1CN(C(=O)c2nnn(C)n2)C[C@@H]1O ZINC000963069231 659038500 /nfs/dbraw/zinc/03/85/00/659038500.db2.gz QMCACTJENBIOJC-UTUOFQBUSA-N 0 3 351.411 -1.616 20 0 FAADHN CC(C)N1CCC[C@H]1C(=O)N[C@@H]1CN(C(=O)c2nnn(C)n2)C[C@@H]1O ZINC000963069232 659038805 /nfs/dbraw/zinc/03/88/05/659038805.db2.gz QMCACTJENBIOJC-WOPDTQHZSA-N 0 3 351.411 -1.616 20 0 FAADHN CC(C)N1CCC[C@H]1C(=O)N[C@@H]1CN(C(=O)Cn2ncnn2)C[C@@H]1O ZINC000963072306 659038559 /nfs/dbraw/zinc/03/85/59/659038559.db2.gz AAHWQRAFPFUMKA-AGIUHOORSA-N 0 3 351.411 -1.766 20 0 FAADHN CC(C)N1CCC[C@@H]1C(=O)N[C@@H]1CN(C(=O)Cn2ncnn2)C[C@@H]1O ZINC000963072307 659038352 /nfs/dbraw/zinc/03/83/52/659038352.db2.gz AAHWQRAFPFUMKA-UPJWGTAASA-N 0 3 351.411 -1.766 20 0 FAADHN CC(C)N1CCC[C@@H]1C(=O)N[C@@H]1CN(C(=O)c2cnn(C)n2)C[C@@H]1O ZINC000963074824 659038892 /nfs/dbraw/zinc/03/88/92/659038892.db2.gz JMDGUBXRSRFGIW-MCIONIFRSA-N 0 3 350.423 -1.011 20 0 FAADHN CC(C)N1CCC[C@H]1C(=O)N[C@@H]1CN(C(=O)c2cnn(C)n2)C[C@@H]1O ZINC000963074830 659038653 /nfs/dbraw/zinc/03/86/53/659038653.db2.gz JMDGUBXRSRFGIW-RDBSUJKOSA-N 0 3 350.423 -1.011 20 0 FAADHN CC(C)N1CCC[C@H]1C(=O)N[C@@H]1CN(C(=O)c2ncn(C)n2)C[C@@H]1O ZINC000963075377 659038105 /nfs/dbraw/zinc/03/81/05/659038105.db2.gz JUKOWNPPAALCQB-AGIUHOORSA-N 0 3 350.423 -1.011 20 0 FAADHN CC(C)N1CCC[C@@H]1C(=O)N[C@@H]1CN(C(=O)c2ncn(C)n2)C[C@@H]1O ZINC000963075378 659038684 /nfs/dbraw/zinc/03/86/84/659038684.db2.gz JUKOWNPPAALCQB-UPJWGTAASA-N 0 3 350.423 -1.011 20 0 FAADHN CC(C)N1CCC[C@@H]1C(=O)N[C@@H]1CN(C(=O)Cn2nccn2)C[C@@H]1O ZINC000963075405 659038324 /nfs/dbraw/zinc/03/83/24/659038324.db2.gz KCVOCQYTGDOATG-MCIONIFRSA-N 0 3 350.423 -1.161 20 0 FAADHN CC(C)N1CCC[C@H]1C(=O)N[C@@H]1CN(C(=O)Cn2nccn2)C[C@@H]1O ZINC000963075407 659038409 /nfs/dbraw/zinc/03/84/09/659038409.db2.gz KCVOCQYTGDOATG-RDBSUJKOSA-N 0 3 350.423 -1.161 20 0 FAADHN CC(C)N1CCC[C@@H]1C(=O)N[C@@H]1CN(C(=O)c2cnnn2C)C[C@@H]1O ZINC000963075451 659038382 /nfs/dbraw/zinc/03/83/82/659038382.db2.gz LFTIZYFQOQMWQG-BZPMIXESSA-N 0 3 350.423 -1.011 20 0 FAADHN CC(C)N1CCC[C@H]1C(=O)N[C@@H]1CN(C(=O)c2cnnn2C)C[C@@H]1O ZINC000963075452 659038599 /nfs/dbraw/zinc/03/85/99/659038599.db2.gz LFTIZYFQOQMWQG-DYEKYZERSA-N 0 3 350.423 -1.011 20 0 FAADHN CC(C)N1CCC[C@@H]1C(=O)N[C@@H]1CN(C(=O)Cn2cncn2)C[C@@H]1O ZINC000963076801 659038457 /nfs/dbraw/zinc/03/84/57/659038457.db2.gz XNVMYHPLAYPNLB-MCIONIFRSA-N 0 3 350.423 -1.161 20 0 FAADHN CC(C)N1CCC[C@H]1C(=O)N[C@@H]1CN(C(=O)Cn2cncn2)C[C@@H]1O ZINC000963076802 659038737 /nfs/dbraw/zinc/03/87/37/659038737.db2.gz XNVMYHPLAYPNLB-RDBSUJKOSA-N 0 3 350.423 -1.161 20 0 FAADHN CC(C)N1CCC[C@H]1C(=O)N[C@@H]1CN(C(=O)C2(C(N)=O)CC2)C[C@@H]1O ZINC000963078388 659039703 /nfs/dbraw/zinc/03/97/03/659039703.db2.gz UIUPDMMXABCUEH-AGIUHOORSA-N 0 3 352.435 -1.187 20 0 FAADHN CC(C)N1CCC[C@@H]1C(=O)N[C@@H]1CN(C(=O)C2(C(N)=O)CC2)C[C@@H]1O ZINC000963078393 659039255 /nfs/dbraw/zinc/03/92/55/659039255.db2.gz UIUPDMMXABCUEH-UPJWGTAASA-N 0 3 352.435 -1.187 20 0 FAADHN CC(C)N1CCC[C@@H]1C(=O)N[C@@H]1CN(C(=O)c2cn(C)nn2)C[C@@H]1O ZINC000963079511 659039465 /nfs/dbraw/zinc/03/94/65/659039465.db2.gz WYHAWJLEQGSGTC-BNOWGMLFSA-N 0 3 350.423 -1.011 20 0 FAADHN CC(C)N1CCC[C@H]1C(=O)N[C@@H]1CN(C(=O)c2cn(C)nn2)C[C@@H]1O ZINC000963079515 659039231 /nfs/dbraw/zinc/03/92/31/659039231.db2.gz WYHAWJLEQGSGTC-XBFCOCLRSA-N 0 3 350.423 -1.011 20 0 FAADHN CC(C)N1CCC[C@H]1C(=O)N[C@@H]1CN(C(=O)Cn2cnnn2)C[C@@H]1O ZINC000963079539 659039334 /nfs/dbraw/zinc/03/93/34/659039334.db2.gz XCMSSLOUOUDOGD-AGIUHOORSA-N 0 3 351.411 -1.766 20 0 FAADHN CC(C)N1CCC[C@@H]1C(=O)N[C@@H]1CN(C(=O)Cn2cnnn2)C[C@@H]1O ZINC000963079545 659039562 /nfs/dbraw/zinc/03/95/62/659039562.db2.gz XCMSSLOUOUDOGD-UPJWGTAASA-N 0 3 351.411 -1.766 20 0 FAADHN CC[C@@H](C(=O)N1C[C@@H](NC(=O)[C@@H]2CC(=O)NC(=O)N2)[C@@H](O)C1)N(C)C ZINC000963144091 659040753 /nfs/dbraw/zinc/04/07/53/659040753.db2.gz UUOQOZKTGUOTRR-VLEAKVRGSA-N 0 3 355.395 -2.387 20 0 FAADHN 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CC[C@@H](C(=O)N1C[C@@H](NC(=O)c2cn(C)c(=O)cn2)[C@@H](O)C1)N(C)C ZINC000969580565 657135171 /nfs/dbraw/zinc/13/51/71/657135171.db2.gz FLTATEPGAURWSF-WXHSDQCUSA-N 0 3 351.407 -1.578 20 0 FAADHN CC[C@H](C(=O)N1C[C@@H](NC(=O)Cc2cn(CC)nn2)[C@@H](O)C1)N(C)C ZINC000969639123 657136521 /nfs/dbraw/zinc/13/65/21/657136521.db2.gz GHJIIGDDRDLQNN-MCIONIFRSA-N 0 3 352.439 -1.131 20 0 FAADHN CC[C@@H](C(=O)N1C[C@@H](NC(=O)Cc2cn(CC)nn2)[C@@H](O)C1)N(C)C ZINC000969639124 657136469 /nfs/dbraw/zinc/13/64/69/657136469.db2.gz GHJIIGDDRDLQNN-RDBSUJKOSA-N 0 3 352.439 -1.131 20 0 FAADHN CC[C@H](C(=O)N1C[C@@H](NC(=O)CN2CC(=O)NC2=O)[C@@H](O)C1)N(C)C ZINC000969712403 657141780 /nfs/dbraw/zinc/14/17/80/657141780.db2.gz AIJANDHHDDMDBM-MXWKQRLJSA-N 0 3 355.395 -2.434 20 0 FAADHN CC[C@@H](C(=O)N1C[C@@H](NC(=O)CN2CC(=O)NC2=O)[C@@H](O)C1)N(C)C ZINC000969712404 657141886 /nfs/dbraw/zinc/14/18/86/657141886.db2.gz AIJANDHHDDMDBM-VWYCJHECSA-N 0 3 355.395 -2.434 20 0 FAADHN CC(C)N1CCO[C@@H](C(=O)N2C[C@@H](NC(=O)c3nc[nH]n3)[C@@H](O)C2)C1 ZINC000969740247 657145772 /nfs/dbraw/zinc/14/57/72/657145772.db2.gz LGQAYXYWIDABQX-GRYCIOLGSA-N 0 3 352.395 -1.785 20 0 FAADHN CC(C)N1CCO[C@@H](C(=O)N2C[C@@H](NC(=O)c3ncn[nH]3)[C@@H](O)C2)C1 ZINC000969740247 657145770 /nfs/dbraw/zinc/14/57/70/657145770.db2.gz LGQAYXYWIDABQX-GRYCIOLGSA-N 0 3 352.395 -1.785 20 0 FAADHN CC(C)N1CCO[C@@H](C(=O)N2C[C@@H](NC(=O)c3nnc[nH]3)[C@@H](O)C2)C1 ZINC000969740247 657145767 /nfs/dbraw/zinc/14/57/67/657145767.db2.gz LGQAYXYWIDABQX-GRYCIOLGSA-N 0 3 352.395 -1.785 20 0 FAADHN CC(C)N1CCO[C@H](C(=O)N2C[C@@H](NC(=O)c3nc[nH]n3)[C@@H](O)C2)C1 ZINC000969740252 657145570 /nfs/dbraw/zinc/14/55/70/657145570.db2.gz LGQAYXYWIDABQX-WOPDTQHZSA-N 0 3 352.395 -1.785 20 0 FAADHN CC(C)N1CCO[C@H](C(=O)N2C[C@@H](NC(=O)c3ncn[nH]3)[C@@H](O)C2)C1 ZINC000969740252 657145564 /nfs/dbraw/zinc/14/55/64/657145564.db2.gz LGQAYXYWIDABQX-WOPDTQHZSA-N 0 3 352.395 -1.785 20 0 FAADHN CC(C)N1CCO[C@H](C(=O)N2C[C@@H](NC(=O)c3nnc[nH]3)[C@@H](O)C2)C1 ZINC000969740252 657145558 /nfs/dbraw/zinc/14/55/58/657145558.db2.gz LGQAYXYWIDABQX-WOPDTQHZSA-N 0 3 352.395 -1.785 20 0 FAADHN C[C@@H](CN1CCOCC1)C(=O)N1C[C@@H](NC(=O)c2ncn[nH]2)[C@@H](O)C1 ZINC000969747498 657146962 /nfs/dbraw/zinc/14/69/62/657146962.db2.gz DHRAGIVUSFCAIW-TUAOUCFPSA-N 0 3 352.395 -1.926 20 0 FAADHN C[C@@H](CN1CCOCC1)C(=O)N1C[C@@H](NC(=O)c2nnc[nH]2)[C@@H](O)C1 ZINC000969747498 657146961 /nfs/dbraw/zinc/14/69/61/657146961.db2.gz DHRAGIVUSFCAIW-TUAOUCFPSA-N 0 3 352.395 -1.926 20 0 FAADHN C[C@H](CN1CCOCC1)C(=O)N1C[C@@H](NC(=O)c2ncn[nH]2)[C@@H](O)C1 ZINC000969747499 657147533 /nfs/dbraw/zinc/14/75/33/657147533.db2.gz DHRAGIVUSFCAIW-UTUOFQBUSA-N 0 3 352.395 -1.926 20 0 FAADHN C[C@H](CN1CCOCC1)C(=O)N1C[C@@H](NC(=O)c2nnc[nH]2)[C@@H](O)C1 ZINC000969747499 657147530 /nfs/dbraw/zinc/14/75/30/657147530.db2.gz DHRAGIVUSFCAIW-UTUOFQBUSA-N 0 3 352.395 -1.926 20 0 FAADHN 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ZINC001023530627 657358398 /nfs/dbraw/zinc/35/83/98/657358398.db2.gz TYVSQQRIBNZLCK-QJPTWQEYSA-N 0 3 352.391 -1.236 20 0 FAADHN C[C@@H]1CCN(CC(=O)N2C[C@@H](O)[C@H](NC(=O)c3cc(=O)n(C)o3)C2)C1 ZINC001023531403 657359576 /nfs/dbraw/zinc/35/95/76/657359576.db2.gz MKZYHDDRUSRVNR-IJLUTSLNSA-N 0 3 352.391 -1.378 20 0 FAADHN C[C@H]1CCN(CC(=O)N2C[C@@H](O)[C@H](NC(=O)c3cc(=O)n(C)o3)C2)C1 ZINC001023531404 657359662 /nfs/dbraw/zinc/35/96/62/657359662.db2.gz MKZYHDDRUSRVNR-QJPTWQEYSA-N 0 3 352.391 -1.378 20 0 FAADHN CN(C)[C@H](C(=O)N1C[C@@H](O)[C@H](NC(=O)c2cc(=O)n(C)o2)C1)C1CC1 ZINC001023531415 657359538 /nfs/dbraw/zinc/35/95/38/657359538.db2.gz MTGNXVVZABHTEC-GYSYKLTISA-N 0 3 352.391 -1.380 20 0 FAADHN CN(C)[C@@H](C(=O)N1C[C@@H](O)[C@H](NC(=O)c2cc(=O)n(C)o2)C1)C1CC1 ZINC001023531416 657359456 /nfs/dbraw/zinc/35/94/56/657359456.db2.gz MTGNXVVZABHTEC-JTNHKYCSSA-N 0 3 352.391 -1.380 20 0 FAADHN CCCN1CCC[C@H]1C(=O)N1C[C@@H](O)[C@H](NC(=O)c2cnnn2C)C1 ZINC001023560274 657361849 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0 3 350.423 -1.011 20 0 FAADHN CC(C)N1CCC[C@@H]1C(=O)N1C[C@@H](O)[C@H](NC(=O)c2cnnn2C)C1 ZINC001023568028 657364577 /nfs/dbraw/zinc/36/45/77/657364577.db2.gz ZSUJGZVCFFSMEB-YRGRVCCFSA-N 0 3 350.423 -1.011 20 0 FAADHN Cn1cc(C(=O)N[C@@H]2CN(C(=O)C(C)(C)N3CCCC3)C[C@H]2O)nn1 ZINC001023587173 657368328 /nfs/dbraw/zinc/36/83/28/657368328.db2.gz CFDMNERWZWKCJN-DGCLKSJQSA-N 0 3 350.423 -1.009 20 0 FAADHN CCCN1CCC[C@H]1C(=O)N1C[C@@H](O)[C@H](NC(=O)c2cn(C)nn2)C1 ZINC001023587718 657368995 /nfs/dbraw/zinc/36/89/95/657368995.db2.gz OOLCYAOSQSZLFL-KWCYVHTRSA-N 0 3 350.423 -1.009 20 0 FAADHN CCCN1CCC[C@@H]1C(=O)N1C[C@@H](O)[C@H](NC(=O)c2cn(C)nn2)C1 ZINC001023587719 657368783 /nfs/dbraw/zinc/36/87/83/657368783.db2.gz OOLCYAOSQSZLFL-MRVWCRGKSA-N 0 3 350.423 -1.009 20 0 FAADHN CC(C)N1CCC[C@H]1C(=O)N1C[C@@H](O)[C@H](NC(=O)c2cn(C)nn2)C1 ZINC001023590409 657370118 /nfs/dbraw/zinc/37/01/18/657370118.db2.gz SMLKIYDHHRZFHH-KWCYVHTRSA-N 0 3 350.423 -1.011 20 0 FAADHN CC(C)N1CCC[C@@H]1C(=O)N1C[C@@H](O)[C@H](NC(=O)c2cn(C)nn2)C1 ZINC001023590410 657370095 /nfs/dbraw/zinc/37/00/95/657370095.db2.gz SMLKIYDHHRZFHH-MRVWCRGKSA-N 0 3 350.423 -1.011 20 0 FAADHN CCCN1CCC[C@H]1C(=O)N1C[C@@H](O)[C@H](NC(=O)c2ncn(C)n2)C1 ZINC001023592396 657370349 /nfs/dbraw/zinc/37/03/49/657370349.db2.gz ANOZNRCVCDVAQF-FRRDWIJNSA-N 0 3 350.423 -1.009 20 0 FAADHN CCCN1CCC[C@@H]1C(=O)N1C[C@@H](O)[C@H](NC(=O)c2ncn(C)n2)C1 ZINC001023592398 657370375 /nfs/dbraw/zinc/37/03/75/657370375.db2.gz ANOZNRCVCDVAQF-JHJVBQTASA-N 0 3 350.423 -1.009 20 0 FAADHN NC(=O)[C@@H]1C[C@@H]1C(=O)NC[C@@H]1CCCN(CCN2C(=O)CNC2=O)C1 ZINC001023592700 657370265 /nfs/dbraw/zinc/37/02/65/657370265.db2.gz WJGDKKVASYEGCQ-TUAOUCFPSA-N 0 3 351.407 -1.512 20 0 FAADHN NC(=O)[C@@H]1C[C@@H]1C(=O)NC[C@H]1CCCN(CCN2C(=O)CNC2=O)C1 ZINC001023592701 657370490 /nfs/dbraw/zinc/37/04/90/657370490.db2.gz WJGDKKVASYEGCQ-UTUOFQBUSA-N 0 3 351.407 -1.512 20 0 FAADHN Cn1cnc(C(=O)N[C@@H]2CN(C(=O)C(C)(C)N3CCCC3)C[C@H]2O)n1 ZINC001023593509 657370742 /nfs/dbraw/zinc/37/07/42/657370742.db2.gz UDLUPHPXNCCSAO-VXGBXAGGSA-N 0 3 350.423 -1.009 20 0 FAADHN Cc1nnc(CC(=O)N[C@@H]2CN(C(=O)CN3CC[C@H](C)C3)C[C@H]2O)o1 ZINC001023594534 657370013 /nfs/dbraw/zinc/37/00/13/657370013.db2.gz CGGHWNUMCVHFES-CYZMBNFOSA-N 0 3 351.407 -1.050 20 0 FAADHN Cc1nnc(CC(=O)N[C@@H]2CN(C(=O)CN3CC[C@@H](C)C3)C[C@H]2O)o1 ZINC001023594535 657370075 /nfs/dbraw/zinc/37/00/75/657370075.db2.gz CGGHWNUMCVHFES-RAIGVLPGSA-N 0 3 351.407 -1.050 20 0 FAADHN Cc1nnc(CC(=O)N[C@@H]2CN(C(=O)[C@H](C3CC3)N(C)C)C[C@H]2O)o1 ZINC001023595178 657370289 /nfs/dbraw/zinc/37/02/89/657370289.db2.gz ZINICSPAYVSBMW-JMSVASOKSA-N 0 3 351.407 -1.051 20 0 FAADHN Cc1nnc(CC(=O)N[C@@H]2CN(C(=O)[C@@H](C3CC3)N(C)C)C[C@H]2O)o1 ZINC001023595179 657370478 /nfs/dbraw/zinc/37/04/78/657370478.db2.gz ZINICSPAYVSBMW-LALPHHSUSA-N 0 3 351.407 -1.051 20 0 FAADHN CC(C)N1CCC[C@H]1C(=O)N1C[C@@H](O)[C@H](NC(=O)c2ncn(C)n2)C1 ZINC001023598724 657371854 /nfs/dbraw/zinc/37/18/54/657371854.db2.gz KGTHXXDOLDOCGE-FRRDWIJNSA-N 0 3 350.423 -1.011 20 0 FAADHN CC(C)N1CCC[C@@H]1C(=O)N1C[C@@H](O)[C@H](NC(=O)c2ncn(C)n2)C1 ZINC001023598726 657371890 /nfs/dbraw/zinc/37/18/90/657371890.db2.gz KGTHXXDOLDOCGE-JHJVBQTASA-N 0 3 350.423 -1.011 20 0 FAADHN CCn1ncc(C(=O)N[C@@H]2CN(C(=O)CN3CC[C@H](C)C3)C[C@H]2O)n1 ZINC001023602772 657372287 /nfs/dbraw/zinc/37/22/87/657372287.db2.gz HERFOEZONOVUEG-IACUBPJLSA-N 0 3 350.423 -1.059 20 0 FAADHN CCn1ncc(C(=O)N[C@@H]2CN(C(=O)CN3CC[C@@H](C)C3)C[C@H]2O)n1 ZINC001023602773 657372803 /nfs/dbraw/zinc/37/28/03/657372803.db2.gz HERFOEZONOVUEG-MRVWCRGKSA-N 0 3 350.423 -1.059 20 0 FAADHN CCn1ncc(C(=O)N[C@@H]2CN(C(=O)[C@H](C3CC3)N(C)C)C[C@H]2O)n1 ZINC001023603448 657372830 /nfs/dbraw/zinc/37/28/30/657372830.db2.gz VTPFKMAZCBBEPT-MCIONIFRSA-N 0 3 350.423 -1.060 20 0 FAADHN CCn1ncc(C(=O)N[C@@H]2CN(C(=O)[C@@H](C3CC3)N(C)C)C[C@H]2O)n1 ZINC001023603450 657372699 /nfs/dbraw/zinc/37/26/99/657372699.db2.gz VTPFKMAZCBBEPT-MGPQQGTHSA-N 0 3 350.423 -1.060 20 0 FAADHN CCn1nncc1C(=O)N[C@@H]1CN(C(=O)CN2CC[C@H](C)C2)C[C@H]1O ZINC001023606001 657372776 /nfs/dbraw/zinc/37/27/76/657372776.db2.gz AIWSVVAWKCMTEV-OUCADQQQSA-N 0 3 350.423 -1.059 20 0 FAADHN CCn1nncc1C(=O)N[C@@H]1CN(C(=O)CN2CC[C@@H](C)C2)C[C@H]1O ZINC001023606002 657372899 /nfs/dbraw/zinc/37/28/99/657372899.db2.gz AIWSVVAWKCMTEV-YRGRVCCFSA-N 0 3 350.423 -1.059 20 0 FAADHN CCn1nncc1C(=O)N[C@@H]1CN(C(=O)[C@H](C2CC2)N(C)C)C[C@H]1O ZINC001023606253 657373186 /nfs/dbraw/zinc/37/31/86/657373186.db2.gz FTJKWPBOYBYHIK-BNOWGMLFSA-N 0 3 350.423 -1.060 20 0 FAADHN CCn1nncc1C(=O)N[C@@H]1CN(C(=O)[C@@H](C2CC2)N(C)C)C[C@H]1O ZINC001023606255 657373317 /nfs/dbraw/zinc/37/33/17/657373317.db2.gz FTJKWPBOYBYHIK-MRVWCRGKSA-N 0 3 350.423 -1.060 20 0 FAADHN Cc1nnc(CC(=O)N[C@@H]2CN(C(=O)CN3CCC[C@@H]3C)C[C@H]2O)[nH]1 ZINC001023642253 657375286 /nfs/dbraw/zinc/37/52/86/657375286.db2.gz JLPBGDWPPCNYSG-CYZMBNFOSA-N 0 3 350.423 -1.172 20 0 FAADHN Cc1nnc(CC(=O)N[C@@H]2CN(C(=O)CN3CCC[C@H]3C)C[C@H]2O)[nH]1 ZINC001023642254 657375250 /nfs/dbraw/zinc/37/52/50/657375250.db2.gz JLPBGDWPPCNYSG-RAIGVLPGSA-N 0 3 350.423 -1.172 20 0 FAADHN Cc1nnc(CC(=O)N[C@@H]2CN(C(=O)C3(N(C)C)CCC3)C[C@H]2O)[nH]1 ZINC001023642463 657375152 /nfs/dbraw/zinc/37/51/52/657375152.db2.gz SOSVCMLGOVZMMU-VXGBXAGGSA-N 0 3 350.423 -1.172 20 0 FAADHN Cc1nnc(CC(=O)N[C@@H]2CN(C(=O)CN3CC[C@H](C)C3)C[C@H]2O)[nH]1 ZINC001023644437 657375772 /nfs/dbraw/zinc/37/57/72/657375772.db2.gz SQINKNQDUGRCNZ-CYZMBNFOSA-N 0 3 350.423 -1.315 20 0 FAADHN Cc1nnc(CC(=O)N[C@@H]2CN(C(=O)CN3CC[C@@H](C)C3)C[C@H]2O)[nH]1 ZINC001023644438 657375848 /nfs/dbraw/zinc/37/58/48/657375848.db2.gz SQINKNQDUGRCNZ-RAIGVLPGSA-N 0 3 350.423 -1.315 20 0 FAADHN Cc1nnc(CC(=O)N[C@@H]2CN(C(=O)CN(C)C3CCC3)C[C@H]2O)[nH]1 ZINC001023648689 657376171 /nfs/dbraw/zinc/37/61/71/657376171.db2.gz DEIWUVNSQPMCIP-CHWSQXEVSA-N 0 3 350.423 -1.172 20 0 FAADHN CC[C@@H](C(=O)N1C[C@@H](O)[C@H](NC(=O)CN2C(=O)CCC2=O)C1)N(C)C ZINC001023657371 657376998 /nfs/dbraw/zinc/37/69/98/657376998.db2.gz NKDJVDWYLJCNHN-GRYCIOLGSA-N 0 3 354.407 -1.837 20 0 FAADHN CC[C@H](C(=O)N1C[C@@H](O)[C@H](NC(=O)CN2C(=O)CCC2=O)C1)N(C)C ZINC001023657373 657377114 /nfs/dbraw/zinc/37/71/14/657377114.db2.gz NKDJVDWYLJCNHN-IJLUTSLNSA-N 0 3 354.407 -1.837 20 0 FAADHN CC[C@@H](C(=O)N1C[C@@H](O)[C@H](NC(=O)Cn2ccccc2=O)C1)N(C)C ZINC001023668804 657378104 /nfs/dbraw/zinc/37/81/04/657378104.db2.gz SFEZYBJPVJZPLC-HZSPNIEDSA-N 0 3 350.419 -1.124 20 0 FAADHN CC[C@H](C(=O)N1C[C@@H](O)[C@H](NC(=O)Cn2ccccc2=O)C1)N(C)C ZINC001023668807 657378141 /nfs/dbraw/zinc/37/81/41/657378141.db2.gz SFEZYBJPVJZPLC-MGPQQGTHSA-N 0 3 350.419 -1.124 20 0 FAADHN CC(C)N1CCC[C@H]1C(=O)N[C@@H]1CN(C(=O)c2nnn(C)n2)C[C@H]1O ZINC001023704606 657380453 /nfs/dbraw/zinc/38/04/53/657380453.db2.gz QMCACTJENBIOJC-GRYCIOLGSA-N 0 3 351.411 -1.616 20 0 FAADHN CC(C)N1CCC[C@@H]1C(=O)N[C@@H]1CN(C(=O)c2nnn(C)n2)C[C@H]1O ZINC001023704607 657380582 /nfs/dbraw/zinc/38/05/82/657380582.db2.gz QMCACTJENBIOJC-IJLUTSLNSA-N 0 3 351.411 -1.616 20 0 FAADHN CC(C)N1CCC[C@H]1C(=O)N[C@@H]1CN(C(=O)Cn2ncnn2)C[C@H]1O ZINC001023705594 657381195 /nfs/dbraw/zinc/38/11/95/657381195.db2.gz AAHWQRAFPFUMKA-FRRDWIJNSA-N 0 3 351.411 -1.766 20 0 FAADHN CC(C)N1CCC[C@@H]1C(=O)N[C@@H]1CN(C(=O)Cn2ncnn2)C[C@H]1O ZINC001023705595 657381008 /nfs/dbraw/zinc/38/10/08/657381008.db2.gz AAHWQRAFPFUMKA-JHJVBQTASA-N 0 3 351.411 -1.766 20 0 FAADHN CC(C)N1CCC[C@H]1C(=O)N[C@@H]1CN(C(=O)c2cnn(C)n2)C[C@H]1O ZINC001023706126 657381039 /nfs/dbraw/zinc/38/10/39/657381039.db2.gz JMDGUBXRSRFGIW-HZSPNIEDSA-N 0 3 350.423 -1.011 20 0 FAADHN CC(C)N1CCC[C@@H]1C(=O)N[C@@H]1CN(C(=O)c2cnn(C)n2)C[C@H]1O ZINC001023706127 657381389 /nfs/dbraw/zinc/38/13/89/657381389.db2.gz JMDGUBXRSRFGIW-MGPQQGTHSA-N 0 3 350.423 -1.011 20 0 FAADHN CC(C)N1CCC[C@H]1C(=O)N[C@@H]1CN(C(=O)c2ncn(C)n2)C[C@H]1O ZINC001023706140 657381251 /nfs/dbraw/zinc/38/12/51/657381251.db2.gz JUKOWNPPAALCQB-FRRDWIJNSA-N 0 3 350.423 -1.011 20 0 FAADHN CC(C)N1CCC[C@@H]1C(=O)N[C@@H]1CN(C(=O)c2ncn(C)n2)C[C@H]1O ZINC001023706141 657380820 /nfs/dbraw/zinc/38/08/20/657380820.db2.gz JUKOWNPPAALCQB-JHJVBQTASA-N 0 3 350.423 -1.011 20 0 FAADHN CC(C)N1CCC[C@H]1C(=O)N[C@@H]1CN(C(=O)Cn2nccn2)C[C@H]1O ZINC001023706152 657380774 /nfs/dbraw/zinc/38/07/74/657380774.db2.gz KCVOCQYTGDOATG-HZSPNIEDSA-N 0 3 350.423 -1.161 20 0 FAADHN CC(C)N1CCC[C@@H]1C(=O)N[C@@H]1CN(C(=O)Cn2nccn2)C[C@H]1O ZINC001023706153 657381268 /nfs/dbraw/zinc/38/12/68/657381268.db2.gz KCVOCQYTGDOATG-MGPQQGTHSA-N 0 3 350.423 -1.161 20 0 FAADHN CC(C)N1CCC[C@H]1C(=O)N[C@@H]1CN(C(=O)c2cnnn2C)C[C@H]1O ZINC001023706189 657380990 /nfs/dbraw/zinc/38/09/90/657380990.db2.gz LFTIZYFQOQMWQG-MBNYWOFBSA-N 0 3 350.423 -1.011 20 0 FAADHN CC(C)N1CCC[C@@H]1C(=O)N[C@@H]1CN(C(=O)c2cnnn2C)C[C@H]1O ZINC001023706190 657380877 /nfs/dbraw/zinc/38/08/77/657380877.db2.gz LFTIZYFQOQMWQG-YRGRVCCFSA-N 0 3 350.423 -1.011 20 0 FAADHN 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CC(C)(C(=O)N[C@@H]1CN(C(=O)Cn2cncn2)C[C@H]1O)N1CCCC1 ZINC001025000177 657595128 /nfs/dbraw/zinc/59/51/28/657595128.db2.gz BWSZXCNFDSMPNG-CHWSQXEVSA-N 0 3 350.423 -1.160 20 0 FAADHN CC(C)(C(=O)N[C@@H]1CN(C(=O)[C@@H]2CCNC2=O)C[C@H]1O)N1CCCC1 ZINC001025000591 657595736 /nfs/dbraw/zinc/59/57/36/657595736.db2.gz HBMQURQQYYKIQB-JHJVBQTASA-N 0 3 352.435 -1.315 20 0 FAADHN CC(C)(C(=O)N[C@@H]1CN(C(=O)[C@H]2CCNC2=O)C[C@H]1O)N1CCCC1 ZINC001025000592 657595842 /nfs/dbraw/zinc/59/58/42/657595842.db2.gz HBMQURQQYYKIQB-YNEHKIRRSA-N 0 3 352.435 -1.315 20 0 FAADHN CC(C)(C(=O)N[C@@H]1CN(C(=O)[C@H]2CNC(=O)N2)C[C@H]1O)N1CCCC1 ZINC001025000600 657595888 /nfs/dbraw/zinc/59/58/88/657595888.db2.gz HHDALPWNKLUIIG-IJLUTSLNSA-N 0 3 353.423 -1.770 20 0 FAADHN CC(C)(C(=O)N[C@@H]1CN(C(=O)[C@@H]2CNC(=O)N2)C[C@H]1O)N1CCCC1 ZINC001025000601 657595769 /nfs/dbraw/zinc/59/57/69/657595769.db2.gz HHDALPWNKLUIIG-QJPTWQEYSA-N 0 3 353.423 -1.770 20 0 FAADHN CC[C@@H](C(=O)N1C[C@@H](O)[C@H](NC(=O)CN2CCNC(=O)C2)C1)N(C)C ZINC001025000691 657595836 /nfs/dbraw/zinc/59/58/36/657595836.db2.gz KOLHKKCGWZMHPZ-FRRDWIJNSA-N 0 3 355.439 -2.554 20 0 FAADHN CC[C@H](C(=O)N1C[C@@H](O)[C@H](NC(=O)CN2CCNC(=O)C2)C1)N(C)C ZINC001025000697 657596023 /nfs/dbraw/zinc/59/60/23/657596023.db2.gz KOLHKKCGWZMHPZ-JHJVBQTASA-N 0 3 355.439 -2.554 20 0 FAADHN CC(C)(C(=O)N[C@@H]1CN(C(=O)[C@H]2C[C@H]2C(N)=O)C[C@H]1O)N1CCCC1 ZINC001025001124 657596064 /nfs/dbraw/zinc/59/60/64/657596064.db2.gz NONMKRUGDLJANZ-YVECIDJPSA-N 0 3 352.435 -1.330 20 0 FAADHN CC(C)(C(=O)N[C@@H]1CN(C(=O)Cn2ncnn2)C[C@H]1O)N1CCCC1 ZINC001025001427 657596577 /nfs/dbraw/zinc/59/65/77/657596577.db2.gz PUNJLUQFCOJEON-VXGBXAGGSA-N 0 3 351.411 -1.765 20 0 FAADHN CC(C)(C(=O)N[C@@H]1CN(C(=O)C2(C(N)=O)CC2)C[C@H]1O)N1CCCC1 ZINC001025001798 657598502 /nfs/dbraw/zinc/59/85/02/657598502.db2.gz UCJLADHVWGRNSR-VXGBXAGGSA-N 0 3 352.435 -1.186 20 0 FAADHN Cn1nnc(C(=O)N2C[C@@H](O)[C@H](NC(=O)C(C)(C)N3CCCC3)C2)n1 ZINC001025001952 657598453 /nfs/dbraw/zinc/59/84/53/657598453.db2.gz WBTOPUSZXWQFJC-GHMZBOCLSA-N 0 3 351.411 -1.614 20 0 FAADHN CC(C)(C(=O)N[C@@H]1CN(C(=O)Cn2nccn2)C[C@H]1O)N1CCCC1 ZINC001025002060 657598633 /nfs/dbraw/zinc/59/86/33/657598633.db2.gz YUCIESBDQWKPFZ-CHWSQXEVSA-N 0 3 350.423 -1.160 20 0 FAADHN O=C(CN1CCNC(=O)C1)N[C@@H]1CN(C(=O)Cc2c[nH]cn2)C[C@H]1O ZINC001025003258 657597659 /nfs/dbraw/zinc/59/76/59/657597659.db2.gz SPAOAGYSUHUARD-VXGBXAGGSA-N 0 3 350.379 -2.928 20 0 FAADHN CC(C)(C(=O)N1C[C@@H](O)[C@H](NC(=O)[C@@H]2CCNC2=O)C1)N1CCCC1 ZINC001025010343 657604445 /nfs/dbraw/zinc/60/44/45/657604445.db2.gz JBLHDGINKJRKRJ-JHJVBQTASA-N 0 3 352.435 -1.315 20 0 FAADHN CC(C)(C(=O)N1C[C@@H](O)[C@H](NC(=O)[C@H]2CCNC2=O)C1)N1CCCC1 ZINC001025010344 657604401 /nfs/dbraw/zinc/60/44/01/657604401.db2.gz JBLHDGINKJRKRJ-YNEHKIRRSA-N 0 3 352.435 -1.315 20 0 FAADHN CN(C)[C@@H](C(=O)N1C[C@@H](O)[C@H](NC(=O)c2c[nH]c(=O)n2C)C1)C1CC1 ZINC001025011697 657606707 /nfs/dbraw/zinc/60/67/07/657606707.db2.gz IXOUPAOKFDHENH-RAIGVLPGSA-N 0 3 351.407 -1.233 20 0 FAADHN 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C[C@@H]1CCCN1CC(=O)N1C[C@@H](O)[C@H](NC(=O)c2c[nH]c(=O)n2C)C1 ZINC001025012570 657607330 /nfs/dbraw/zinc/60/73/30/657607330.db2.gz YOTYJZREGOQHNX-NQBHXWOUSA-N 0 3 351.407 -1.089 20 0 FAADHN CN(CC(=O)N1C[C@@H](O)[C@H](NC(=O)c2c[nH]c(=O)n2C)C1)C1CCC1 ZINC001025013240 657608356 /nfs/dbraw/zinc/60/83/56/657608356.db2.gz MGSOFIHJQRKDAA-DGCLKSJQSA-N 0 3 351.407 -1.089 20 0 FAADHN CN(C)C1(C(=O)N2C[C@@H](O)[C@H](NC(=O)[C@@H]3CN(C)C(=O)N3)C2)CCC1 ZINC001025013312 657608450 /nfs/dbraw/zinc/60/84/50/657608450.db2.gz OEAPRXKJPQFDDZ-GRYCIOLGSA-N 0 3 353.423 -1.818 20 0 FAADHN CN(C)C1(C(=O)N2C[C@@H](O)[C@H](NC(=O)[C@H]3CN(C)C(=O)N3)C2)CCC1 ZINC001025013315 657608470 /nfs/dbraw/zinc/60/84/70/657608470.db2.gz OEAPRXKJPQFDDZ-IJLUTSLNSA-N 0 3 353.423 -1.818 20 0 FAADHN CN(CC(=O)N1C[C@@H](O)[C@H](NC(=O)[C@@H]2CN(C)C(=O)N2)C1)C1CCC1 ZINC001025014041 657611234 /nfs/dbraw/zinc/61/12/34/657611234.db2.gz GUYBDYNXFDVGQF-FRRDWIJNSA-N 0 3 353.423 -1.818 20 0 FAADHN CN(CC(=O)N1C[C@@H](O)[C@H](NC(=O)[C@H]2CN(C)C(=O)N2)C1)C1CCC1 ZINC001025014042 657611307 /nfs/dbraw/zinc/61/13/07/657611307.db2.gz GUYBDYNXFDVGQF-JHJVBQTASA-N 0 3 353.423 -1.818 20 0 FAADHN CC[C@@H](C(=O)N1C[C@@H](O)[C@H](NC(=O)c2cn(C)c(=O)cn2)C1)N(C)C ZINC001025031477 657613126 /nfs/dbraw/zinc/61/31/26/657613126.db2.gz FLTATEPGAURWSF-KGYLQXTDSA-N 0 3 351.407 -1.578 20 0 FAADHN CC[C@H](C(=O)N1C[C@@H](O)[C@H](NC(=O)c2cn(C)c(=O)cn2)C1)N(C)C ZINC001025031479 657613141 /nfs/dbraw/zinc/61/31/41/657613141.db2.gz FLTATEPGAURWSF-RAIGVLPGSA-N 0 3 351.407 -1.578 20 0 FAADHN CC[C@@H](C(=O)N1C[C@@H](O)[C@H](NC(=O)Cc2cn(CC)nn2)C1)N(C)C ZINC001025057701 657616447 /nfs/dbraw/zinc/61/64/47/657616447.db2.gz GHJIIGDDRDLQNN-HZSPNIEDSA-N 0 3 352.439 -1.131 20 0 FAADHN CC[C@H](C(=O)N1C[C@@H](O)[C@H](NC(=O)Cc2cn(CC)nn2)C1)N(C)C ZINC001025057702 657616560 /nfs/dbraw/zinc/61/65/60/657616560.db2.gz GHJIIGDDRDLQNN-MGPQQGTHSA-N 0 3 352.439 -1.131 20 0 FAADHN CC[C@H](C(=O)N1C[C@@H](O)[C@H](NC(=O)CN2CC(=O)NC2=O)C1)N(C)C ZINC001025093916 657627213 /nfs/dbraw/zinc/62/72/13/657627213.db2.gz AIJANDHHDDMDBM-GMTAPVOTSA-N 0 3 355.395 -2.434 20 0 FAADHN CC[C@@H](C(=O)N1C[C@@H](O)[C@H](NC(=O)CN2CC(=O)NC2=O)C1)N(C)C ZINC001025094807 657627006 /nfs/dbraw/zinc/62/70/06/657627006.db2.gz AIJANDHHDDMDBM-OUAUKWLOSA-N 0 3 355.395 -2.434 20 0 FAADHN CC(C)N1CCO[C@@H](C(=O)N2C[C@@H](O)[C@H](NC(=O)c3nc[nH]n3)C2)C1 ZINC001025105733 657632353 /nfs/dbraw/zinc/63/23/53/657632353.db2.gz LGQAYXYWIDABQX-IJLUTSLNSA-N 0 3 352.395 -1.785 20 0 FAADHN CC(C)N1CCO[C@@H](C(=O)N2C[C@@H](O)[C@H](NC(=O)c3ncn[nH]3)C2)C1 ZINC001025105733 657632346 /nfs/dbraw/zinc/63/23/46/657632346.db2.gz LGQAYXYWIDABQX-IJLUTSLNSA-N 0 3 352.395 -1.785 20 0 FAADHN CC(C)N1CCO[C@@H](C(=O)N2C[C@@H](O)[C@H](NC(=O)c3nnc[nH]3)C2)C1 ZINC001025105733 657632341 /nfs/dbraw/zinc/63/23/41/657632341.db2.gz LGQAYXYWIDABQX-IJLUTSLNSA-N 0 3 352.395 -1.785 20 0 FAADHN CC(C)N1CCO[C@H](C(=O)N2C[C@@H](O)[C@H](NC(=O)c3nc[nH]n3)C2)C1 ZINC001025105735 657632771 /nfs/dbraw/zinc/63/27/71/657632771.db2.gz LGQAYXYWIDABQX-UTUOFQBUSA-N 0 3 352.395 -1.785 20 0 FAADHN CC(C)N1CCO[C@H](C(=O)N2C[C@@H](O)[C@H](NC(=O)c3ncn[nH]3)C2)C1 ZINC001025105735 657632768 /nfs/dbraw/zinc/63/27/68/657632768.db2.gz LGQAYXYWIDABQX-UTUOFQBUSA-N 0 3 352.395 -1.785 20 0 FAADHN CC(C)N1CCO[C@H](C(=O)N2C[C@@H](O)[C@H](NC(=O)c3nnc[nH]3)C2)C1 ZINC001025105735 657632763 /nfs/dbraw/zinc/63/27/63/657632763.db2.gz LGQAYXYWIDABQX-UTUOFQBUSA-N 0 3 352.395 -1.785 20 0 FAADHN C[C@H](CN1CCOCC1)C(=O)N1C[C@@H](O)[C@H](NC(=O)c2ncn[nH]2)C1 ZINC001025110323 657635317 /nfs/dbraw/zinc/63/53/17/657635317.db2.gz DHRAGIVUSFCAIW-IJLUTSLNSA-N 0 3 352.395 -1.926 20 0 FAADHN C[C@H](CN1CCOCC1)C(=O)N1C[C@@H](O)[C@H](NC(=O)c2nnc[nH]2)C1 ZINC001025110323 657635314 /nfs/dbraw/zinc/63/53/14/657635314.db2.gz DHRAGIVUSFCAIW-IJLUTSLNSA-N 0 3 352.395 -1.926 20 0 FAADHN C[C@@H](CN1CCOCC1)C(=O)N1C[C@@H](O)[C@H](NC(=O)c2ncn[nH]2)C1 ZINC001025110326 657635147 /nfs/dbraw/zinc/63/51/47/657635147.db2.gz DHRAGIVUSFCAIW-QJPTWQEYSA-N 0 3 352.395 -1.926 20 0 FAADHN C[C@@H](CN1CCOCC1)C(=O)N1C[C@@H](O)[C@H](NC(=O)c2nnc[nH]2)C1 ZINC001025110326 657635141 /nfs/dbraw/zinc/63/51/41/657635141.db2.gz DHRAGIVUSFCAIW-QJPTWQEYSA-N 0 3 352.395 -1.926 20 0 FAADHN CN(C)C1(C(=O)N2C[C@@H](O)[C@H](NC(=O)[C@@H]3CCC(=O)N3C)C2)CCC1 ZINC001025128816 657641277 /nfs/dbraw/zinc/64/12/77/657641277.db2.gz MQMPQHDQVHCLEA-FRRDWIJNSA-N 0 3 352.435 -1.221 20 0 FAADHN CC(C)[C@@H](C(=O)N1C[C@@H](O)[C@H](NC(=O)[C@@H]2CCC(=O)N2C)C1)N(C)C ZINC001025129195 657638394 /nfs/dbraw/zinc/63/83/94/657638394.db2.gz VCXMIVHWTVTAPV-COMQUAJESA-N 0 3 354.451 -1.119 20 0 FAADHN CC(C)[C@H](C(=O)N1C[C@@H](O)[C@H](NC(=O)[C@@H]2CCC(=O)N2C)C1)N(C)C ZINC001025129196 657638270 /nfs/dbraw/zinc/63/82/70/657638270.db2.gz VCXMIVHWTVTAPV-QVHKTLOISA-N 0 3 354.451 -1.119 20 0 FAADHN 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ZINC001058856462 679516010 /nfs/dbraw/zinc/51/60/10/679516010.db2.gz WCBMOSWQTWAZNR-HZSPNIEDSA-N 0 3 354.451 -1.082 20 0 FAADHN CC(C)N1CCC[C@H]1C(=O)NCCN(CCO)C(=O)[C@H]1C[C@H]1C(N)=O ZINC001058856463 679516124 /nfs/dbraw/zinc/51/61/24/679516124.db2.gz WCBMOSWQTWAZNR-RDBSUJKOSA-N 0 3 354.451 -1.082 20 0 FAADHN CCN1CCCC[C@@H]1C(=O)NCCN(CCO)C(=O)[C@H]1C[C@H]1C(N)=O ZINC001058856668 679516398 /nfs/dbraw/zinc/51/63/98/679516398.db2.gz FQQUOHHSVMTTDX-HZSPNIEDSA-N 0 3 354.451 -1.081 20 0 FAADHN CCN1CCCC[C@H]1C(=O)NCCN(CCO)C(=O)[C@H]1C[C@H]1C(N)=O ZINC001058856669 679516374 /nfs/dbraw/zinc/51/63/74/679516374.db2.gz FQQUOHHSVMTTDX-RDBSUJKOSA-N 0 3 354.451 -1.081 20 0 FAADHN CN(C)C1(C(=O)NC[C@@H]2COCCN2C(=O)[C@H]2C[C@H]2C(N)=O)CCC1 ZINC001061655047 679959204 /nfs/dbraw/zinc/95/92/04/679959204.db2.gz HTOZSQTXTXNJBD-UPJWGTAASA-N 0 3 352.435 -1.064 20 0 FAADHN CN(C)C1(C(=O)NC[C@H]2COCCN2C(=O)[C@H]2C[C@H]2C(N)=O)CCC1 ZINC001061655048 679959030 /nfs/dbraw/zinc/95/90/30/679959030.db2.gz HTOZSQTXTXNJBD-XQQFMLRXSA-N 0 3 352.435 -1.064 20 0 FAADHN CN(C)C1(C(=O)NC[C@@H]2CN(C(=O)[C@H]3C[C@H]3C(N)=O)CCO2)CCC1 ZINC001065625520 680067053 /nfs/dbraw/zinc/06/70/53/680067053.db2.gz PIQQGGPARPAXJW-UPJWGTAASA-N 0 3 352.435 -1.064 20 0 FAADHN CN(C)C1(C(=O)NC[C@H]2CN(C(=O)[C@H]3C[C@H]3C(N)=O)CCO2)CCC1 ZINC001065625521 680067031 /nfs/dbraw/zinc/06/70/31/680067031.db2.gz PIQQGGPARPAXJW-XQQFMLRXSA-N 0 3 352.435 -1.064 20 0 FAADHN CCN(CC)CC(=O)N1CCOC2(CN(C(=O)[C@H]3C[C@H]3C(N)=O)C2)C1 ZINC001068399436 680074754 /nfs/dbraw/zinc/07/47/54/680074754.db2.gz CXTLBNPQGSVIBO-OLZOCXBDSA-N 0 3 352.435 -1.111 20 0 FAADHN CC(C)N(C)CC(=O)N1CCOC2(CN(C(=O)[C@H]3C[C@H]3C(N)=O)C2)C1 ZINC001068406266 680075623 /nfs/dbraw/zinc/07/56/23/680075623.db2.gz NNIDYICPUQQHQO-OLZOCXBDSA-N 0 3 352.435 -1.112 20 0 FAADHN CCCN(C)CC(=O)N1CCOC2(CN(C(=O)[C@H]3C[C@H]3C(N)=O)C2)C1 ZINC001068421015 680075585 /nfs/dbraw/zinc/07/55/85/680075585.db2.gz JCVMDTIZSDUGEE-OLZOCXBDSA-N 0 3 352.435 -1.111 20 0 FAADHN CCN(CC)CC(=O)N1CC2(C1)CN(C(=O)[C@H]1C[C@H]1C(N)=O)CCO2 ZINC001068463457 680075319 /nfs/dbraw/zinc/07/53/19/680075319.db2.gz GWANBAALRXSQRS-OLZOCXBDSA-N 0 3 352.435 -1.111 20 0 FAADHN CCCN(C)CC(=O)N1CC2(C1)CN(C(=O)[C@H]1C[C@H]1C(N)=O)CCO2 ZINC001068464076 680075411 /nfs/dbraw/zinc/07/54/11/680075411.db2.gz WCGZRNGRJDIZBG-OLZOCXBDSA-N 0 3 352.435 -1.111 20 0 FAADHN CC(C)N(C)CC(=O)N1CC2(C1)CN(C(=O)[C@H]1C[C@H]1C(N)=O)CCO2 ZINC001068465283 680076058 /nfs/dbraw/zinc/07/60/58/680076058.db2.gz VPKQOEQLWZNSRB-OLZOCXBDSA-N 0 3 352.435 -1.112 20 0 FAADHN CCN(CC)CC(=O)N[C@H]1COC2(CN(C(=O)[C@H]3C[C@H]3C(N)=O)C2)C1 ZINC001068877990 680076880 /nfs/dbraw/zinc/07/68/80/680076880.db2.gz BFKPPRIAIWLUOT-UPJWGTAASA-N 0 3 352.435 -1.064 20 0 FAADHN CCN(CC)CC(=O)N[C@@H]1COC2(CN(C(=O)[C@H]3C[C@H]3C(N)=O)C2)C1 ZINC001068877991 680077075 /nfs/dbraw/zinc/07/70/75/680077075.db2.gz BFKPPRIAIWLUOT-XQQFMLRXSA-N 0 3 352.435 -1.064 20 0 FAADHN CC(C)N(C)CC(=O)N[C@H]1COC2(CN(C(=O)[C@H]3C[C@H]3C(N)=O)C2)C1 ZINC001068902478 680077052 /nfs/dbraw/zinc/07/70/52/680077052.db2.gz QVZJCPPELKWGDH-UPJWGTAASA-N 0 3 352.435 -1.066 20 0 FAADHN CC(C)N(C)CC(=O)N[C@@H]1COC2(CN(C(=O)[C@H]3C[C@H]3C(N)=O)C2)C1 ZINC001068902479 680076830 /nfs/dbraw/zinc/07/68/30/680076830.db2.gz QVZJCPPELKWGDH-XQQFMLRXSA-N 0 3 352.435 -1.066 20 0 FAADHN CCCN(C)CC(=O)N[C@H]1COC2(CN(C(=O)[C@H]3C[C@H]3C(N)=O)C2)C1 ZINC001068939736 680077393 /nfs/dbraw/zinc/07/73/93/680077393.db2.gz HCBAVODZVSLKBX-UPJWGTAASA-N 0 3 352.435 -1.064 20 0 FAADHN CCCN(C)CC(=O)N[C@@H]1COC2(CN(C(=O)[C@H]3C[C@H]3C(N)=O)C2)C1 ZINC001068939737 680077386 /nfs/dbraw/zinc/07/73/86/680077386.db2.gz HCBAVODZVSLKBX-XQQFMLRXSA-N 0 3 352.435 -1.064 20 0 FAADHN CCCN(C)CC(=O)N1CC2(C1)C[C@@H](NC(=O)[C@H]1C[C@H]1C(N)=O)CO2 ZINC001069038908 680077417 /nfs/dbraw/zinc/07/74/17/680077417.db2.gz BAMWKDKNPWNMJZ-UPJWGTAASA-N 0 3 352.435 -1.064 20 0 FAADHN CCCN(C)CC(=O)N1CC2(C1)C[C@H](NC(=O)[C@H]1C[C@H]1C(N)=O)CO2 ZINC001069038909 680077493 /nfs/dbraw/zinc/07/74/93/680077493.db2.gz BAMWKDKNPWNMJZ-XQQFMLRXSA-N 0 3 352.435 -1.064 20 0 FAADHN CCN(CC)CC(=O)N1CC2(C1)C[C@@H](NC(=O)[C@H]1C[C@H]1C(N)=O)CO2 ZINC001069040595 680077427 /nfs/dbraw/zinc/07/74/27/680077427.db2.gz POXSWMVCZUEZFK-UPJWGTAASA-N 0 3 352.435 -1.064 20 0 FAADHN CCN(CC)CC(=O)N1CC2(C1)C[C@H](NC(=O)[C@H]1C[C@H]1C(N)=O)CO2 ZINC001069040596 680077447 /nfs/dbraw/zinc/07/74/47/680077447.db2.gz POXSWMVCZUEZFK-XQQFMLRXSA-N 0 3 352.435 -1.064 20 0 FAADHN CC(C)N(C)CC(=O)N1CC2(C1)C[C@@H](NC(=O)[C@H]1C[C@H]1C(N)=O)CO2 ZINC001069041658 680077942 /nfs/dbraw/zinc/07/79/42/680077942.db2.gz ZOLISCGUZUEXSP-UPJWGTAASA-N 0 3 352.435 -1.066 20 0 FAADHN CC(C)N(C)CC(=O)N1CC2(C1)C[C@H](NC(=O)[C@H]1C[C@H]1C(N)=O)CO2 ZINC001069041660 680078092 /nfs/dbraw/zinc/07/80/92/680078092.db2.gz ZOLISCGUZUEXSP-XQQFMLRXSA-N 0 3 352.435 -1.066 20 0 FAADHN CC(C)CN1C[C@@H](NC(=O)[C@H]2CCS(=O)(=O)N2)[C@@H](n2ccnn2)C1 ZINC001070098740 680085885 /nfs/dbraw/zinc/08/58/85/680085885.db2.gz PWVKJJJUXGLPLL-UPJWGTAASA-N 0 3 356.452 -1.033 20 0 FAADHN CC(C)CN1C[C@@H](NC(=O)[C@@H]2CCS(=O)(=O)N2)[C@@H](n2ccnn2)C1 ZINC001070098741 680085397 /nfs/dbraw/zinc/08/53/97/680085397.db2.gz PWVKJJJUXGLPLL-XQQFMLRXSA-N 0 3 356.452 -1.033 20 0 FAADHN O=C(N[C@@H]1CN(CC2CC2)C[C@@H]1n1ccnn1)[C@H]1CCS(=O)(=O)N1 ZINC001070098931 680085617 /nfs/dbraw/zinc/08/56/17/680085617.db2.gz ZOHLUQXESKCIOX-UPJWGTAASA-N 0 3 354.436 -1.279 20 0 FAADHN O=C(N[C@@H]1CN(CC2CC2)C[C@@H]1n1ccnn1)[C@@H]1CCS(=O)(=O)N1 ZINC001070098932 680085821 /nfs/dbraw/zinc/08/58/21/680085821.db2.gz ZOHLUQXESKCIOX-XQQFMLRXSA-N 0 3 354.436 -1.279 20 0 FAADHN COCC(=O)N1C[C@@H](NC[C@H]2CCS(=O)(=O)C2)[C@@H](n2ccnn2)C1 ZINC001070114014 680086315 /nfs/dbraw/zinc/08/63/15/680086315.db2.gz YESMEAUENHDJNJ-UPJWGTAASA-N 0 3 357.436 -1.299 20 0 FAADHN COCC(=O)N1C[C@@H](NC[C@@H]2CCS(=O)(=O)C2)[C@@H](n2ccnn2)C1 ZINC001070114015 680086123 /nfs/dbraw/zinc/08/61/23/680086123.db2.gz YESMEAUENHDJNJ-XQQFMLRXSA-N 0 3 357.436 -1.299 20 0 FAADHN O=C(C(F)F)N1C[C@@H](NCCN2C(=O)CNC2=O)[C@@H](n2ccnn2)C1 ZINC001070116325 680086350 /nfs/dbraw/zinc/08/63/50/680086350.db2.gz XUSPUCVDIOGPNA-BDAKNGLRSA-N 0 3 357.321 -1.564 20 0 FAADHN COCC(=O)N1C[C@@H](NCCN2C(=O)CCC2=O)[C@@H](n2ccnn2)C1 ZINC001070120194 680086211 /nfs/dbraw/zinc/08/62/11/680086211.db2.gz BEJHFWOQMNQLQV-NEPJUHHUSA-N 0 3 350.379 -1.585 20 0 FAADHN COCC(=O)N1C[C@@H](NCCN2C(=O)CNC2=O)[C@@H](n2ccnn2)C1 ZINC001070120361 680086578 /nfs/dbraw/zinc/08/65/78/680086578.db2.gz KTLGGSDDYMLNRI-MNOVXSKESA-N 0 3 351.367 -2.182 20 0 FAADHN CSCC(=O)N1C[C@@H](NCCN2C(=O)CNC2=O)[C@@H](n2ccnn2)C1 ZINC001070133150 680086869 /nfs/dbraw/zinc/08/68/69/680086869.db2.gz IZXMLKWDVXGISF-MNOVXSKESA-N 0 3 367.435 -1.466 20 0 FAADHN CO[C@H](C)C(=O)N1C[C@@H](NCCN2CCNC2=O)[C@@H](n2ccnn2)C1 ZINC001070150241 680087643 /nfs/dbraw/zinc/08/76/43/680087643.db2.gz FLMJLEMFBBLGPH-UPJWGTAASA-N 0 3 351.411 -1.320 20 0 FAADHN CO[C@@H](C)C(=O)N1C[C@@H](NCCN2CCNC2=O)[C@@H](n2ccnn2)C1 ZINC001070150242 680087463 /nfs/dbraw/zinc/08/74/63/680087463.db2.gz FLMJLEMFBBLGPH-XQQFMLRXSA-N 0 3 351.411 -1.320 20 0 FAADHN CS(=O)(=O)CC(=O)N1C[C@@H](NCCn2cncn2)[C@@H](n2ccnn2)C1 ZINC001070153019 680087609 /nfs/dbraw/zinc/08/76/09/680087609.db2.gz AQPXKUNARZVGAT-NEPJUHHUSA-N 0 3 368.423 -2.044 20 0 FAADHN CS(=O)(=O)CC(=O)N1C[C@@H](NCCn2cccn2)[C@@H](n2ccnn2)C1 ZINC001070153527 680087490 /nfs/dbraw/zinc/08/74/90/680087490.db2.gz YFBHAYQXNZRARL-OLZOCXBDSA-N 0 3 367.435 -1.439 20 0 FAADHN NC(=O)CC(=O)N1C[C@@H](NCCN2CCNC2=O)[C@@H](n2ccnn2)C1 ZINC001070162213 680088240 /nfs/dbraw/zinc/08/82/40/680088240.db2.gz WXXCMIULODIBMN-MNOVXSKESA-N 0 3 350.383 -2.480 20 0 FAADHN NC(=O)CC(=O)N1C[C@@H](NC[C@@H]2CCS(=O)(=O)C2)[C@@H](n2ccnn2)C1 ZINC001070162266 680088128 /nfs/dbraw/zinc/08/81/28/680088128.db2.gz ZUSZCABFYJFEPQ-TUAOUCFPSA-N 0 3 370.435 -2.070 20 0 FAADHN NC(=O)CC(=O)N1C[C@@H](NC[C@H]2CCS(=O)(=O)C2)[C@@H](n2ccnn2)C1 ZINC001070162267 680088149 /nfs/dbraw/zinc/08/81/49/680088149.db2.gz ZUSZCABFYJFEPQ-UTUOFQBUSA-N 0 3 370.435 -2.070 20 0 FAADHN COCCn1cc(C(=O)N2C[C@@H](NCCO)[C@@H](n3ccnn3)C2)nn1 ZINC001070191757 680088223 /nfs/dbraw/zinc/08/82/23/680088223.db2.gz QLVAHAGAGIKYKT-YPMHNXCESA-N 0 3 350.383 -1.836 20 0 FAADHN CS(=O)(=O)c1cc(C(=O)N2C[C@@H](NCCO)[C@@H](n3ccnn3)C2)co1 ZINC001070198169 680088184 /nfs/dbraw/zinc/08/81/84/680088184.db2.gz QSACRDCDGMROFU-NEPJUHHUSA-N 0 3 369.403 -1.078 20 0 FAADHN CC(C)N1C[C@H](C(=O)N2C[C@@H](NCCO)[C@@H](n3ccnn3)C2)CC1=O ZINC001070204848 680088645 /nfs/dbraw/zinc/08/86/45/680088645.db2.gz WQSGRQOIEAHJJH-MCIONIFRSA-N 0 3 350.423 -1.131 20 0 FAADHN CC(C)N1C[C@@H](C(=O)N2C[C@@H](NCCO)[C@@H](n3ccnn3)C2)CC1=O ZINC001070204849 680088697 /nfs/dbraw/zinc/08/86/97/680088697.db2.gz WQSGRQOIEAHJJH-MJBXVCDLSA-N 0 3 350.423 -1.131 20 0 FAADHN O=C(CN1CCCS1(=O)=O)N1C[C@@H](NCCO)[C@@H](n2ccnn2)C1 ZINC001070206067 680088600 /nfs/dbraw/zinc/08/86/00/680088600.db2.gz CSSJSUFZZHRRMJ-NEPJUHHUSA-N 0 3 358.424 -2.353 20 0 FAADHN C[C@@H](C(=O)N1C[C@@H](NCCO)[C@@H](n2ccnn2)C1)N1C(=O)CCC1=O ZINC001070206283 680088902 /nfs/dbraw/zinc/08/89/02/680088902.db2.gz RVEUNQPMEWXVRO-TUAOUCFPSA-N 0 3 350.379 -1.851 20 0 FAADHN C[C@H](C(=O)N1C[C@@H](NCCO)[C@@H](n2ccnn2)C1)N1C(=O)CCC1=O ZINC001070206284 680088789 /nfs/dbraw/zinc/08/87/89/680088789.db2.gz RVEUNQPMEWXVRO-UTUOFQBUSA-N 0 3 350.379 -1.851 20 0 FAADHN O=C([C@@H]1CCCCS1(=O)=O)N1C[C@@H](NCCO)[C@@H](n2ccnn2)C1 ZINC001070207754 680088614 /nfs/dbraw/zinc/08/86/14/680088614.db2.gz MMJUYUFMXHFSKI-AGIUHOORSA-N 0 3 357.436 -1.421 20 0 FAADHN O=C([C@H]1CCCCS1(=O)=O)N1C[C@@H](NCCO)[C@@H](n2ccnn2)C1 ZINC001070207755 680088710 /nfs/dbraw/zinc/08/87/10/680088710.db2.gz MMJUYUFMXHFSKI-FRRDWIJNSA-N 0 3 357.436 -1.421 20 0 FAADHN O=C(CS(=O)(=O)C1CCCC1)N1C[C@@H](NCCO)[C@@H](n2ccnn2)C1 ZINC001070217324 680088825 /nfs/dbraw/zinc/08/88/25/680088825.db2.gz AGPXPLHWDRLKAF-KGLIPLIRSA-N 0 3 371.463 -1.031 20 0 FAADHN C[C@@H]1CN(C)C[C@H](C(=O)N2C[C@@H](NCC(N)=O)[C@@H](n3ccnn3)C2)O1 ZINC001070217645 680088547 /nfs/dbraw/zinc/08/85/47/680088547.db2.gz MIZSJVVYMVITHM-FVCCEPFGSA-N 0 3 351.411 -2.176 20 0 FAADHN O=C(C1CC2(C1)CS(=O)(=O)C2)N1C[C@@H](NCCO)[C@@H](n2ccnn2)C1 ZINC001070218981 680088625 /nfs/dbraw/zinc/08/86/25/680088625.db2.gz WSMVIQPUHRBHEV-OLZOCXBDSA-N 0 3 369.447 -1.563 20 0 FAADHN CN1CCN(CC(=O)N2C[C@@H](NCCO)[C@@H](n3ccnn3)C2)CC1=O ZINC001070220903 680089419 /nfs/dbraw/zinc/08/94/19/680089419.db2.gz RULKNPLCNBLLGM-OLZOCXBDSA-N 0 3 351.411 -2.614 20 0 FAADHN C[C@@H](O)CN[C@@H]1CN(C(=O)CC2CS(=O)(=O)C2)C[C@@H]1n1ccnn1 ZINC001070220934 680089338 /nfs/dbraw/zinc/08/93/38/680089338.db2.gz UMDSTUWAWWBRJZ-RTXFEEFZSA-N 0 3 357.436 -1.565 20 0 FAADHN C[C@H](O)CN[C@@H]1CN(C(=O)CC2CS(=O)(=O)C2)C[C@@H]1n1ccnn1 ZINC001070220935 680089101 /nfs/dbraw/zinc/08/91/01/680089101.db2.gz UMDSTUWAWWBRJZ-UHTWSYAYSA-N 0 3 357.436 -1.565 20 0 FAADHN NC(=O)C1CCC(C(=O)N2C[C@@H](NCCO)[C@@H](n3ccnn3)C2)CC1 ZINC001070222477 680089224 /nfs/dbraw/zinc/08/92/24/680089224.db2.gz LXDHKPONCMQCNI-PQAZSJQKSA-N 0 3 350.423 -1.096 20 0 FAADHN O=C(C[C@H]1CCS(=O)(=O)C1)N1C[C@@H](NCCO)[C@@H](n2ccnn2)C1 ZINC001070228223 680089476 /nfs/dbraw/zinc/08/94/76/680089476.db2.gz NYNQJJZHWGPHPE-UPJWGTAASA-N 0 3 357.436 -1.563 20 0 FAADHN O=C(C[C@@H]1CCS(=O)(=O)C1)N1C[C@@H](NCCO)[C@@H](n2ccnn2)C1 ZINC001070228224 680089296 /nfs/dbraw/zinc/08/92/96/680089296.db2.gz NYNQJJZHWGPHPE-XQQFMLRXSA-N 0 3 357.436 -1.563 20 0 FAADHN NC(=O)N1CCC[C@@H](C(=O)N2C[C@@H](NCCO)[C@@H](n3ccnn3)C2)C1 ZINC001070229145 680089501 /nfs/dbraw/zinc/08/95/01/680089501.db2.gz CWRJMXYSBWVVPR-UPJWGTAASA-N 0 3 351.411 -1.597 20 0 FAADHN NC(=O)N1CCC[C@H](C(=O)N2C[C@@H](NCCO)[C@@H](n3ccnn3)C2)C1 ZINC001070229146 680089242 /nfs/dbraw/zinc/08/92/42/680089242.db2.gz CWRJMXYSBWVVPR-XQQFMLRXSA-N 0 3 351.411 -1.597 20 0 FAADHN CC(=O)N1CCC[C@@H](C(=O)N2C[C@@H](NCCO)[C@@H](n3ccnn3)C2)C1 ZINC001070229183 680089175 /nfs/dbraw/zinc/08/91/75/680089175.db2.gz FPLRLWQHEMFTGI-KFWWJZLASA-N 0 3 350.423 -1.130 20 0 FAADHN CC(=O)N1CCC[C@H](C(=O)N2C[C@@H](NCCO)[C@@H](n3ccnn3)C2)C1 ZINC001070229184 680089184 /nfs/dbraw/zinc/08/91/84/680089184.db2.gz FPLRLWQHEMFTGI-ZNMIVQPWSA-N 0 3 350.423 -1.130 20 0 FAADHN O=C(CCN1C(=O)CCC1=O)N1C[C@@H](NCCO)[C@@H](n2ccnn2)C1 ZINC001070229544 680089139 /nfs/dbraw/zinc/08/91/39/680089139.db2.gz YITARANKEDMDHC-NEPJUHHUSA-N 0 3 350.379 -1.849 20 0 FAADHN O=C([C@@H]1OC[C@@H]2COCC[C@H]12)N1C[C@@H](NCCO)[C@@H](n2ccnn2)C1 ZINC001070241558 680089827 /nfs/dbraw/zinc/08/98/27/680089827.db2.gz MQRHNDGDXFPXAM-SBJFKYEJSA-N 0 3 351.407 -1.337 20 0 FAADHN Cn1cnn(CCC(=O)N2C[C@@H](NCCO)[C@@H](n3ccnn3)C2)c1=O ZINC001070242768 680089961 /nfs/dbraw/zinc/08/99/61/680089961.db2.gz QQCPVHNTZPCNNV-NEPJUHHUSA-N 0 3 350.383 -2.403 20 0 FAADHN O=C(C[C@H]1CCCS1(=O)=O)N1C[C@@H](NCCO)[C@@H](n2ccnn2)C1 ZINC001070242774 680089701 /nfs/dbraw/zinc/08/97/01/680089701.db2.gz QZEJSMBITUMKHL-UPJWGTAASA-N 0 3 357.436 -1.421 20 0 FAADHN O=C(C[C@@H]1CCCS1(=O)=O)N1C[C@@H](NCCO)[C@@H](n2ccnn2)C1 ZINC001070242775 680089933 /nfs/dbraw/zinc/08/99/33/680089933.db2.gz QZEJSMBITUMKHL-XQQFMLRXSA-N 0 3 357.436 -1.421 20 0 FAADHN NC(=O)C(=O)N1C[C@@H](NC[C@@H]2CCS(=O)(=O)C2)[C@@H](n2ccnn2)C1 ZINC001070264427 680090786 /nfs/dbraw/zinc/09/07/86/680090786.db2.gz MZPHZQFDIPHDFD-AXFHLTTASA-N 0 3 356.408 -2.460 20 0 FAADHN NC(=O)C(=O)N1C[C@@H](NC[C@H]2CCS(=O)(=O)C2)[C@@H](n2ccnn2)C1 ZINC001070264428 680090972 /nfs/dbraw/zinc/09/09/72/680090972.db2.gz MZPHZQFDIPHDFD-MXWKQRLJSA-N 0 3 356.408 -2.460 20 0 FAADHN Cc1csc(=O)n1CCN[C@@H]1CN(C(=O)C(N)=O)C[C@@H]1n1ccnn1 ZINC001070264455 680091025 /nfs/dbraw/zinc/09/10/25/680091025.db2.gz OABWIDWAWXTXQI-MNOVXSKESA-N 0 3 365.419 -1.663 20 0 FAADHN NC(=O)C(=O)N1C[C@@H](NCCn2cc(Cl)cn2)[C@@H](n2ccnn2)C1 ZINC001070264470 680090853 /nfs/dbraw/zinc/09/08/53/680090853.db2.gz OXMCXHWIDMHVSU-MNOVXSKESA-N 0 3 352.786 -1.345 20 0 FAADHN NC(=O)C(=O)N1C[C@@H](NCCN2C(=O)CNC2=O)[C@@H](n2ccnn2)C1 ZINC001070264532 680090907 /nfs/dbraw/zinc/09/09/07/680090907.db2.gz RGGCERNERWRHQX-BDAKNGLRSA-N 0 3 350.339 -3.343 20 0 FAADHN NC(=O)C(=O)N1C[C@@H](NC[C@@H]2CCCS(=O)(=O)C2)[C@@H](n2ccnn2)C1 ZINC001070264690 680091378 /nfs/dbraw/zinc/09/13/78/680091378.db2.gz ZSEVVZISIDGTHI-TUAOUCFPSA-N 0 3 370.435 -2.070 20 0 FAADHN NC(=O)C(=O)N1C[C@@H](NC[C@H]2CCCS(=O)(=O)C2)[C@@H](n2ccnn2)C1 ZINC001070264691 680091405 /nfs/dbraw/zinc/09/14/05/680091405.db2.gz ZSEVVZISIDGTHI-UTUOFQBUSA-N 0 3 370.435 -2.070 20 0 FAADHN CCCN1C[C@H](C(=O)N2C[C@@H](NCCO)[C@@H](n3ccnn3)C2)CC1=O ZINC001070285762 680091591 /nfs/dbraw/zinc/09/15/91/680091591.db2.gz ITXLWPSDFHHGTB-MCIONIFRSA-N 0 3 350.423 -1.130 20 0 FAADHN CCCN1C[C@@H](C(=O)N2C[C@@H](NCCO)[C@@H](n3ccnn3)C2)CC1=O ZINC001070285763 680091391 /nfs/dbraw/zinc/09/13/91/680091391.db2.gz ITXLWPSDFHHGTB-MJBXVCDLSA-N 0 3 350.423 -1.130 20 0 FAADHN O=C(C1CCS(=O)(=O)CC1)N1C[C@@H](NCCO)[C@@H](n2ccnn2)C1 ZINC001070286813 680091553 /nfs/dbraw/zinc/09/15/53/680091553.db2.gz BDWWFFLSRFKKLE-OLZOCXBDSA-N 0 3 357.436 -1.563 20 0 FAADHN C[C@H](O)CN[C@@H]1CN(C(=O)C(C)(C)S(C)(=O)=O)C[C@@H]1n1ccnn1 ZINC001070286970 680091632 /nfs/dbraw/zinc/09/16/32/680091632.db2.gz IXXLLXWDCAWYAJ-TUAOUCFPSA-N 0 3 359.452 -1.176 20 0 FAADHN C[C@@H](O)CN[C@@H]1CN(C(=O)C(C)(C)S(C)(=O)=O)C[C@@H]1n1ccnn1 ZINC001070286971 680091363 /nfs/dbraw/zinc/09/13/63/680091363.db2.gz IXXLLXWDCAWYAJ-UTUOFQBUSA-N 0 3 359.452 -1.176 20 0 FAADHN O=C([C@@H]1CCCS(=O)(=O)C1)N1C[C@@H](NCCO)[C@@H](n2ccnn2)C1 ZINC001070287017 680091486 /nfs/dbraw/zinc/09/14/86/680091486.db2.gz LEOHNEWOPGGKRI-UPJWGTAASA-N 0 3 357.436 -1.563 20 0 FAADHN O=C([C@H]1CCCS(=O)(=O)C1)N1C[C@@H](NCCO)[C@@H](n2ccnn2)C1 ZINC001070287018 680091615 /nfs/dbraw/zinc/09/16/15/680091615.db2.gz LEOHNEWOPGGKRI-XQQFMLRXSA-N 0 3 357.436 -1.563 20 0 FAADHN C[C@@H](O)CN[C@@H]1CN(C(=O)C2CCS(=O)(=O)CC2)C[C@@H]1n1ccnn1 ZINC001070287362 680091419 /nfs/dbraw/zinc/09/14/19/680091419.db2.gz ZKUPOSDUAGOBTC-BNOWGMLFSA-N 0 3 371.463 -1.175 20 0 FAADHN C[C@H](O)CN[C@@H]1CN(C(=O)C2CCS(=O)(=O)CC2)C[C@@H]1n1ccnn1 ZINC001070287363 680091350 /nfs/dbraw/zinc/09/13/50/680091350.db2.gz ZKUPOSDUAGOBTC-YUTCNCBUSA-N 0 3 371.463 -1.175 20 0 FAADHN C[C@@H]1CCCN(C(=O)C(=O)N2C[C@@H](NCCO)[C@@H](n3ccnn3)C2)C1 ZINC001070290656 680091301 /nfs/dbraw/zinc/09/13/01/680091301.db2.gz JAZYHJPOWHOZRF-MCIONIFRSA-N 0 3 350.423 -1.130 20 0 FAADHN C[C@H]1CCCN(C(=O)C(=O)N2C[C@@H](NCCO)[C@@H](n3ccnn3)C2)C1 ZINC001070290657 680091464 /nfs/dbraw/zinc/09/14/64/680091464.db2.gz JAZYHJPOWHOZRF-MJBXVCDLSA-N 0 3 350.423 -1.130 20 0 FAADHN CS(=O)(=O)c1ccc(C(=O)N2C[C@@H](NCCO)[C@@H](n3ccnn3)C2)o1 ZINC001070290813 680091224 /nfs/dbraw/zinc/09/12/24/680091224.db2.gz LHHYAYFQWRYBJS-MNOVXSKESA-N 0 3 369.403 -1.078 20 0 FAADHN CC1CCN(C(=O)C(=O)N2C[C@@H](NCCO)[C@@H](n3ccnn3)C2)CC1 ZINC001070291147 680091200 /nfs/dbraw/zinc/09/12/00/680091200.db2.gz YMDFDFMURDGICI-KGLIPLIRSA-N 0 3 350.423 -1.130 20 0 FAADHN CN1CC[C@H](C(=O)N2C[C@@H](NCCO)[C@@H](n3ccnn3)C2)S1(=O)=O ZINC001070294001 680091214 /nfs/dbraw/zinc/09/12/14/680091214.db2.gz GMZOPUZFPNBTJH-GRYCIOLGSA-N 0 3 358.424 -2.354 20 0 FAADHN CN1CC[C@@H](C(=O)N2C[C@@H](NCCO)[C@@H](n3ccnn3)C2)S1(=O)=O ZINC001070294002 680091495 /nfs/dbraw/zinc/09/14/95/680091495.db2.gz GMZOPUZFPNBTJH-WOPDTQHZSA-N 0 3 358.424 -2.354 20 0 FAADHN CS(=O)(=O)C1(C(=O)N2C[C@@H](NCCO)[C@@H](n3ccnn3)C2)CCCC1 ZINC001070294256 680092142 /nfs/dbraw/zinc/09/21/42/680092142.db2.gz OWMYFQVYNWLOEP-OLZOCXBDSA-N 0 3 371.463 -1.031 20 0 FAADHN C[C@@]1(C(=O)N2C[C@@H](NCCO)[C@@H](n3ccnn3)C2)CCCS1(=O)=O ZINC001070295070 680091786 /nfs/dbraw/zinc/09/17/86/680091786.db2.gz KVRWYNQOSDCDCV-DYEKYZERSA-N 0 3 357.436 -1.421 20 0 FAADHN C[C@]1(C(=O)N2C[C@@H](NCCO)[C@@H](n3ccnn3)C2)CCCS1(=O)=O ZINC001070295071 680091773 /nfs/dbraw/zinc/09/17/73/680091773.db2.gz KVRWYNQOSDCDCV-MBNYWOFBSA-N 0 3 357.436 -1.421 20 0 FAADHN C[C@@H](O)CN[C@@H]1CN(C(=O)C2(S(C)(=O)=O)CCC2)C[C@@H]1n1ccnn1 ZINC001070303920 680092048 /nfs/dbraw/zinc/09/20/48/680092048.db2.gz AGNBYVGAYPECMY-UPJWGTAASA-N 0 3 371.463 -1.032 20 0 FAADHN C[C@H](O)CN[C@@H]1CN(C(=O)C2(S(C)(=O)=O)CCC2)C[C@@H]1n1ccnn1 ZINC001070303921 680091973 /nfs/dbraw/zinc/09/19/73/680091973.db2.gz AGNBYVGAYPECMY-XQQFMLRXSA-N 0 3 371.463 -1.032 20 0 FAADHN CS(=O)(=O)C1(C(=O)N2C[C@@H](NCCO)[C@@H](n3ccnn3)C2)CCC1 ZINC001070304136 680092160 /nfs/dbraw/zinc/09/21/60/680092160.db2.gz MAYFRRZBYVLZSF-NEPJUHHUSA-N 0 3 357.436 -1.421 20 0 FAADHN CCC(=O)N1CC[C@@H](C(=O)N2C[C@@H](NCCO)[C@@H](n3ccnn3)C2)C1 ZINC001070306945 680092093 /nfs/dbraw/zinc/09/20/93/680092093.db2.gz IANLWUNUNSMHIF-MCIONIFRSA-N 0 3 350.423 -1.130 20 0 FAADHN CCC(=O)N1CC[C@H](C(=O)N2C[C@@H](NCCO)[C@@H](n3ccnn3)C2)C1 ZINC001070306946 680092035 /nfs/dbraw/zinc/09/20/35/680092035.db2.gz IANLWUNUNSMHIF-MJBXVCDLSA-N 0 3 350.423 -1.130 20 0 FAADHN O=C(C[C@H]1CCCS(=O)(=O)C1)N1C[C@@H](NCCO)[C@@H](n2ccnn2)C1 ZINC001070307067 680092191 /nfs/dbraw/zinc/09/21/91/680092191.db2.gz OYSRBNPHFPLCFC-MCIONIFRSA-N 0 3 371.463 -1.173 20 0 FAADHN O=C(C[C@@H]1CCCS(=O)(=O)C1)N1C[C@@H](NCCO)[C@@H](n2ccnn2)C1 ZINC001070307068 680092269 /nfs/dbraw/zinc/09/22/69/680092269.db2.gz OYSRBNPHFPLCFC-MJBXVCDLSA-N 0 3 371.463 -1.173 20 0 FAADHN CC(=O)N1CC[C@@](C)(C(=O)N2C[C@@H](NCCO)[C@@H](n3ccnn3)C2)C1 ZINC001070308219 680091804 /nfs/dbraw/zinc/09/18/04/680091804.db2.gz IEKHMTBAMHGPCM-IJEWVQPXSA-N 0 3 350.423 -1.130 20 0 FAADHN CC(=O)N1CC[C@](C)(C(=O)N2C[C@@H](NCCO)[C@@H](n3ccnn3)C2)C1 ZINC001070308220 680092154 /nfs/dbraw/zinc/09/21/54/680092154.db2.gz IEKHMTBAMHGPCM-YCPHGPKFSA-N 0 3 350.423 -1.130 20 0 FAADHN O=C(CN1CCC(=O)NC1=O)N1C[C@@H](NCCO)[C@@H](n2ccnn2)C1 ZINC001070308544 680092124 /nfs/dbraw/zinc/09/21/24/680092124.db2.gz YGVDOTFJTBEVIW-MNOVXSKESA-N 0 3 351.367 -2.446 20 0 FAADHN NC(=O)N1CCCC[C@H]1C(=O)N1C[C@@H](NCCO)[C@@H](n2ccnn2)C1 ZINC001070308959 680091852 /nfs/dbraw/zinc/09/18/52/680091852.db2.gz OIUZEVJUHRULGG-AGIUHOORSA-N 0 3 351.411 -1.455 20 0 FAADHN NC(=O)N1CCCC[C@@H]1C(=O)N1C[C@@H](NCCO)[C@@H](n2ccnn2)C1 ZINC001070308960 680092148 /nfs/dbraw/zinc/09/21/48/680092148.db2.gz OIUZEVJUHRULGG-UPJWGTAASA-N 0 3 351.411 -1.455 20 0 FAADHN CN1CCCC[C@@H](C(=O)N2C[C@@H](NCCO)[C@@H](n3ccnn3)C2)C1=O ZINC001070310299 680091819 /nfs/dbraw/zinc/09/18/19/680091819.db2.gz UAWLLEYTUAIRGS-MCIONIFRSA-N 0 3 350.423 -1.130 20 0 FAADHN CN1CCCC[C@H](C(=O)N2C[C@@H](NCCO)[C@@H](n3ccnn3)C2)C1=O ZINC001070310300 680092116 /nfs/dbraw/zinc/09/21/16/680092116.db2.gz UAWLLEYTUAIRGS-MJBXVCDLSA-N 0 3 350.423 -1.130 20 0 FAADHN CN1C(=O)CN(CC(=O)N2C[C@@H](NCCO)[C@@H](n3ccnn3)C2)C1=O ZINC001070311333 680092177 /nfs/dbraw/zinc/09/21/77/680092177.db2.gz YFQWASVCCMAVIE-MNOVXSKESA-N 0 3 351.367 -2.494 20 0 FAADHN CC(=O)N1CCO[C@@H](C(=O)N2C[C@@H](NCCO)[C@@H](n3ccnn3)C2)C1 ZINC001070320018 680092482 /nfs/dbraw/zinc/09/24/82/680092482.db2.gz TUOFKVNDYRQSNK-HZSPNIEDSA-N 0 3 352.395 -2.141 20 0 FAADHN CC(=O)N1CCO[C@H](C(=O)N2C[C@@H](NCCO)[C@@H](n3ccnn3)C2)C1 ZINC001070320019 680092585 /nfs/dbraw/zinc/09/25/85/680092585.db2.gz TUOFKVNDYRQSNK-RDBSUJKOSA-N 0 3 352.395 -2.141 20 0 FAADHN Cc1nn(CC(=O)N2C[C@@H](NCCO)[C@@H](n3ccnn3)C2)c(=O)n1C ZINC001070320086 680092882 /nfs/dbraw/zinc/09/28/82/680092882.db2.gz WTDRXBURBZOVBQ-NEPJUHHUSA-N 0 3 350.383 -2.484 20 0 FAADHN CN1CC(=O)N(CC(=O)N2C[C@@H](NCCO)[C@@H](n3ccnn3)C2)C1=O ZINC001070323317 680092544 /nfs/dbraw/zinc/09/25/44/680092544.db2.gz QJUUPCVIBZZVDP-MNOVXSKESA-N 0 3 351.367 -2.494 20 0 FAADHN CC(=O)N1CCC(C(=O)N2C[C@@H](NCCO)[C@@H](n3ccnn3)C2)CC1 ZINC001070324360 680092769 /nfs/dbraw/zinc/09/27/69/680092769.db2.gz HJGMCXQDYXIIQL-CABCVRRESA-N 0 3 350.423 -1.130 20 0 FAADHN NC(=O)N1CCC(C(=O)N2C[C@@H](NCCO)[C@@H](n3ccnn3)C2)CC1 ZINC001070324522 680092535 /nfs/dbraw/zinc/09/25/35/680092535.db2.gz RDAJGHIBWWJVAA-OLZOCXBDSA-N 0 3 351.411 -1.597 20 0 FAADHN Cc1csc(=O)n1CC(=O)N1C[C@@H](NCCO)[C@@H](n2ccnn2)C1 ZINC001070325371 680092640 /nfs/dbraw/zinc/09/26/40/680092640.db2.gz GSSHNSXHYKTSNP-NEPJUHHUSA-N 0 3 352.420 -1.156 20 0 FAADHN CC(=O)N1CCOC[C@@H]1C(=O)N1C[C@@H](NCCO)[C@@H](n2ccnn2)C1 ZINC001070331215 680093173 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Cc1nc(CC(=O)N[C@@H]2CN(CCCN3CCCC3=O)C[C@H]2O)n[nH]1 ZINC001076978504 679568150 /nfs/dbraw/zinc/56/81/50/679568150.db2.gz SLLNEFFLDDWXRF-CHWSQXEVSA-N 0 3 350.423 -1.171 20 0 FAADHN CC1(C)CC(=O)N(CC(=O)N[C@@H]2CN(C[C@H]3CCOC3)C[C@H]2O)C1=O ZINC001077003180 679569745 /nfs/dbraw/zinc/56/97/45/679569745.db2.gz XOSZBYFOMSHPFR-JHJVBQTASA-N 0 3 353.419 -1.031 20 0 FAADHN CC1(C)CC(=O)N(CC(=O)N[C@@H]2CN(C[C@@H]3CCOC3)C[C@H]2O)C1=O ZINC001077003181 679569702 /nfs/dbraw/zinc/56/97/02/679569702.db2.gz XOSZBYFOMSHPFR-YNEHKIRRSA-N 0 3 353.419 -1.031 20 0 FAADHN NC(=O)c1ncn(CC(=O)N[C@@H]2CN(CC[C@@H]3CCOC3)C[C@H]2O)n1 ZINC001077026714 679570861 /nfs/dbraw/zinc/57/08/61/679570861.db2.gz GYGUTBGXOIOHGL-IJLUTSLNSA-N 0 3 352.395 -2.035 20 0 FAADHN NC(=O)c1ncn(CC(=O)N[C@@H]2CN(CC[C@H]3CCOC3)C[C@H]2O)n1 ZINC001077026715 679570895 /nfs/dbraw/zinc/57/08/95/679570895.db2.gz GYGUTBGXOIOHGL-QJPTWQEYSA-N 0 3 352.395 -2.035 20 0 FAADHN NC(=O)c1ncn(CC(=O)N[C@@H]2CN(CC[C@H]3CCCO3)C[C@H]2O)n1 ZINC001077026750 679570685 /nfs/dbraw/zinc/57/06/85/679570685.db2.gz IKFJJLDYGIEKMP-IJLUTSLNSA-N 0 3 352.395 -1.893 20 0 FAADHN NC(=O)c1ncn(CC(=O)N[C@@H]2CN(CC[C@@H]3CCCO3)C[C@H]2O)n1 ZINC001077026751 679570724 /nfs/dbraw/zinc/57/07/24/679570724.db2.gz IKFJJLDYGIEKMP-QJPTWQEYSA-N 0 3 352.395 -1.893 20 0 FAADHN CC[C@H](CN1C[C@@H](O)[C@H](NC(=O)Cn2ccc(=O)n(C)c2=O)C1)OC ZINC001077092187 679574297 /nfs/dbraw/zinc/57/42/97/679574297.db2.gz INBWZMULDKWAFQ-JHJVBQTASA-N 0 3 354.407 -1.867 20 0 FAADHN CC[C@@H](CN1C[C@@H](O)[C@H](NC(=O)Cn2ccc(=O)n(C)c2=O)C1)OC ZINC001077092188 679574072 /nfs/dbraw/zinc/57/40/72/679574072.db2.gz INBWZMULDKWAFQ-YNEHKIRRSA-N 0 3 354.407 -1.867 20 0 FAADHN Cn1c(=O)ccn(CC(=O)N[C@@H]2CN(C[C@H]3CCOC3)C[C@H]2O)c1=O ZINC001077092573 679574122 /nfs/dbraw/zinc/57/41/22/679574122.db2.gz ZWFNCFGUMRZWGC-JHJVBQTASA-N 0 3 352.391 -2.255 20 0 FAADHN Cn1c(=O)ccn(CC(=O)N[C@@H]2CN(C[C@@H]3CCOC3)C[C@H]2O)c1=O ZINC001077092574 679574226 /nfs/dbraw/zinc/57/42/26/679574226.db2.gz ZWFNCFGUMRZWGC-YNEHKIRRSA-N 0 3 352.391 -2.255 20 0 FAADHN O=C(CN1CCCS1(=O)=O)N[C@@H]1CN(CC[C@H]2CCOC2)C[C@H]1O ZINC001077093451 679574535 /nfs/dbraw/zinc/57/45/35/679574535.db2.gz PLGSHZNJNAEOQH-BFHYXJOUSA-N 0 3 361.464 -1.390 20 0 FAADHN O=C(CN1CCCS1(=O)=O)N[C@@H]1CN(CC[C@@H]2CCOC2)C[C@H]1O ZINC001077093452 679574448 /nfs/dbraw/zinc/57/44/48/679574448.db2.gz PLGSHZNJNAEOQH-MGPQQGTHSA-N 0 3 361.464 -1.390 20 0 FAADHN O=C(CN1CCCS1(=O)=O)N[C@@H]1CN(CC[C@@H]2CCCO2)C[C@H]1O ZINC001077093460 679574488 /nfs/dbraw/zinc/57/44/88/679574488.db2.gz QLSRCQQFFKTAOV-BFHYXJOUSA-N 0 3 361.464 -1.248 20 0 FAADHN O=C(CN1CCCS1(=O)=O)N[C@@H]1CN(CC[C@H]2CCCO2)C[C@H]1O ZINC001077093461 679574459 /nfs/dbraw/zinc/57/44/59/679574459.db2.gz QLSRCQQFFKTAOV-MGPQQGTHSA-N 0 3 361.464 -1.248 20 0 FAADHN CNC(=O)CN1C[C@@H](O)[C@H](NC(=O)[C@@H]2CCCN2C2CCOCC2)C1 ZINC001077129072 679576878 /nfs/dbraw/zinc/57/68/78/679576878.db2.gz RZWYWKGLUWXBKR-QLFBSQMISA-N 0 3 354.451 -1.463 20 0 FAADHN CNC(=O)CN1C[C@@H](O)[C@H](NC(=O)[C@H]2CCCN2C2CCOCC2)C1 ZINC001077129073 679576999 /nfs/dbraw/zinc/57/69/99/679576999.db2.gz RZWYWKGLUWXBKR-RBSFLKMASA-N 0 3 354.451 -1.463 20 0 FAADHN O=C(CN1CCOCC1=O)N[C@@H]1CN(CCC[C@@H]2CCOC2)C[C@H]1O ZINC001077140759 679577854 /nfs/dbraw/zinc/57/78/54/679577854.db2.gz CYKUBFUCIFBXFT-RBSFLKMASA-N 0 3 355.435 -1.177 20 0 FAADHN O=C(CN1CCOCC1=O)N[C@@H]1CN(CCC[C@H]2CCOC2)C[C@H]1O ZINC001077140760 679577931 /nfs/dbraw/zinc/57/79/31/679577931.db2.gz CYKUBFUCIFBXFT-RRFJBIMHSA-N 0 3 355.435 -1.177 20 0 FAADHN O=C(CN1CCOCC1=O)N[C@@H]1CN(CC[C@H]2CCCCO2)C[C@H]1O ZINC001077140769 679578017 /nfs/dbraw/zinc/57/80/17/679578017.db2.gz DJZMZHPWKRBQKN-RBSFLKMASA-N 0 3 355.435 -1.034 20 0 FAADHN O=C(CN1CCOCC1=O)N[C@@H]1CN(CC[C@@H]2CCCCO2)C[C@H]1O ZINC001077140770 679578057 /nfs/dbraw/zinc/57/80/57/679578057.db2.gz DJZMZHPWKRBQKN-RRFJBIMHSA-N 0 3 355.435 -1.034 20 0 FAADHN O=C(CN1CCOCC1=O)N[C@@H]1CN(CCC2CCOCC2)C[C@H]1O ZINC001077140904 679577919 /nfs/dbraw/zinc/57/79/19/679577919.db2.gz KTMPTPABYNJYJN-HUUCEWRRSA-N 0 3 355.435 -1.177 20 0 FAADHN CCOC1CC(CN2C[C@@H](O)[C@H](NC(=O)CN3CCOCC3=O)C2)C1 ZINC001077141091 679578104 /nfs/dbraw/zinc/57/81/04/679578104.db2.gz UVWXCMUIZXUZGJ-NEXFUWMNSA-N 0 3 355.435 -1.178 20 0 FAADHN CO[C@@H](CN1C[C@@H](O)[C@H](NC(=O)CN2CCOCC2=O)C1)C1CCC1 ZINC001077141172 679578295 /nfs/dbraw/zinc/57/82/95/679578295.db2.gz YAWOFBJFSKEFOK-KFWWJZLASA-N 0 3 355.435 -1.178 20 0 FAADHN CO[C@H](CN1C[C@@H](O)[C@H](NC(=O)CN2CCOCC2=O)C1)C1CCC1 ZINC001077141173 679578572 /nfs/dbraw/zinc/57/85/72/679578572.db2.gz YAWOFBJFSKEFOK-RBSFLKMASA-N 0 3 355.435 -1.178 20 0 FAADHN C[C@@H]1CN(C)C[C@H](C(=O)N[C@@H]2CN(CCc3ccnn3C)C[C@H]2O)O1 ZINC001077220914 679582344 /nfs/dbraw/zinc/58/23/44/679582344.db2.gz VZANNHCUMXPHPP-DTZQCDIJSA-N 0 3 351.451 -1.157 20 0 FAADHN CN1CCN(CC(=O)N[C@@H]2CN(CC[C@H]3CCCO3)C[C@H]2O)CC1=O ZINC001077260469 679584507 /nfs/dbraw/zinc/58/45/07/679584507.db2.gz IRGZXTFKKBGOJE-RBSFLKMASA-N 0 3 354.451 -1.509 20 0 FAADHN CN1CCN(CC(=O)N[C@@H]2CN(CC[C@@H]3CCCO3)C[C@H]2O)CC1=O ZINC001077260470 679584696 /nfs/dbraw/zinc/58/46/96/679584696.db2.gz IRGZXTFKKBGOJE-RRFJBIMHSA-N 0 3 354.451 -1.509 20 0 FAADHN CN1CCN(CC(=O)N[C@@H]2CN(CC[C@@H]3CCOC3)C[C@H]2O)CC1=O ZINC001077260533 679584646 /nfs/dbraw/zinc/58/46/46/679584646.db2.gz KTTHVLMLNHZXFT-RBSFLKMASA-N 0 3 354.451 -1.652 20 0 FAADHN CN1CCN(CC(=O)N[C@@H]2CN(CC[C@H]3CCOC3)C[C@H]2O)CC1=O ZINC001077260534 679584636 /nfs/dbraw/zinc/58/46/36/679584636.db2.gz KTTHVLMLNHZXFT-RRFJBIMHSA-N 0 3 354.451 -1.652 20 0 FAADHN Cn1cnn(CC(=O)N[C@@H]2CN(CCC3CCOCC3)C[C@H]2O)c1=O ZINC001077264158 679585040 /nfs/dbraw/zinc/58/50/40/679585040.db2.gz GSPZIWGWDBEILU-ZIAGYGMSSA-N 0 3 353.423 -1.440 20 0 FAADHN Cn1cnn(CC(=O)N[C@@H]2CN(CCC[C@H]3CCOC3)C[C@H]2O)c1=O ZINC001077264188 679584889 /nfs/dbraw/zinc/58/48/89/679584889.db2.gz HZKHMXURUKVTLY-BFHYXJOUSA-N 0 3 353.423 -1.440 20 0 FAADHN Cn1cnn(CC(=O)N[C@@H]2CN(CCC[C@@H]3CCOC3)C[C@H]2O)c1=O ZINC001077264189 679585098 /nfs/dbraw/zinc/58/50/98/679585098.db2.gz HZKHMXURUKVTLY-MGPQQGTHSA-N 0 3 353.423 -1.440 20 0 FAADHN CO[C@@H](CN1C[C@@H](O)[C@H](NC(=O)Cn2ncn(C)c2=O)C1)C1CCC1 ZINC001077264210 679585609 /nfs/dbraw/zinc/58/56/09/679585609.db2.gz JBEXTGDMVHFKAE-MCIONIFRSA-N 0 3 353.423 -1.442 20 0 FAADHN CO[C@H](CN1C[C@@H](O)[C@H](NC(=O)Cn2ncn(C)c2=O)C1)C1CCC1 ZINC001077264211 679585644 /nfs/dbraw/zinc/58/56/44/679585644.db2.gz JBEXTGDMVHFKAE-MGPQQGTHSA-N 0 3 353.423 -1.442 20 0 FAADHN Cn1cnn(CC(=O)N[C@@H]2CN(CC[C@@H]3CCCCO3)C[C@H]2O)c1=O ZINC001077264312 679585440 /nfs/dbraw/zinc/58/54/40/679585440.db2.gz OENZRHZKVBOSIT-BFHYXJOUSA-N 0 3 353.423 -1.298 20 0 FAADHN Cn1cnn(CC(=O)N[C@@H]2CN(CC[C@H]3CCCCO3)C[C@H]2O)c1=O ZINC001077264313 679585620 /nfs/dbraw/zinc/58/56/20/679585620.db2.gz OENZRHZKVBOSIT-MGPQQGTHSA-N 0 3 353.423 -1.298 20 0 FAADHN CCOC1CC(CN2C[C@@H](O)[C@H](NC(=O)Cn3ncn(C)c3=O)C2)C1 ZINC001077264519 679586111 /nfs/dbraw/zinc/58/61/11/679586111.db2.gz YYSYVIVXPNFSPV-NWINJMCUSA-N 0 3 353.423 -1.442 20 0 FAADHN CC(C)CN1CCC[C@H]1C(=O)N[C@@H]1CN(Cc2nnnn2C)C[C@H]1O ZINC001077280492 679586925 /nfs/dbraw/zinc/58/69/25/679586925.db2.gz ARGSTLZLKUXQID-HZSPNIEDSA-N 0 3 351.455 -1.008 20 0 FAADHN CC(C)CN1CCC[C@@H]1C(=O)N[C@@H]1CN(Cc2nnnn2C)C[C@H]1O ZINC001077280493 679586888 /nfs/dbraw/zinc/58/68/88/679586888.db2.gz ARGSTLZLKUXQID-MGPQQGTHSA-N 0 3 351.455 -1.008 20 0 FAADHN CC(C)CN1CCC[C@H]1C(=O)N[C@@H]1CN(Cc2nnn(C)n2)C[C@H]1O ZINC001077280744 679587124 /nfs/dbraw/zinc/58/71/24/679587124.db2.gz KDWMGIZAWDNSJK-HZSPNIEDSA-N 0 3 351.455 -1.008 20 0 FAADHN CC(C)CN1CCC[C@@H]1C(=O)N[C@@H]1CN(Cc2nnn(C)n2)C[C@H]1O ZINC001077280745 679586949 /nfs/dbraw/zinc/58/69/49/679586949.db2.gz KDWMGIZAWDNSJK-MGPQQGTHSA-N 0 3 351.455 -1.008 20 0 FAADHN O=C(Cn1ccc(=O)[nH]c1=O)N[C@@H]1CN(CC[C@H]2CCCO2)C[C@H]1O ZINC001077321668 679589343 /nfs/dbraw/zinc/58/93/43/679589343.db2.gz HYOARCBORXHIPJ-JHJVBQTASA-N 0 3 352.391 -1.321 20 0 FAADHN O=C(Cn1ccc(=O)[nH]c1=O)N[C@@H]1CN(CC[C@@H]2CCCO2)C[C@H]1O ZINC001077321669 679589366 /nfs/dbraw/zinc/58/93/66/679589366.db2.gz HYOARCBORXHIPJ-YNEHKIRRSA-N 0 3 352.391 -1.321 20 0 FAADHN O=C(Cn1ccc(=O)[nH]c1=O)N[C@@H]1CN(CC[C@@H]2CCOC2)C[C@H]1O ZINC001077321993 679589319 /nfs/dbraw/zinc/58/93/19/679589319.db2.gz XNMPVXKHFXKXQE-JHJVBQTASA-N 0 3 352.391 -1.463 20 0 FAADHN O=C(Cn1ccc(=O)[nH]c1=O)N[C@@H]1CN(CC[C@H]2CCOC2)C[C@H]1O ZINC001077321994 679589353 /nfs/dbraw/zinc/58/93/53/679589353.db2.gz XNMPVXKHFXKXQE-YNEHKIRRSA-N 0 3 352.391 -1.463 20 0 FAADHN CC[C@@H](CN1C[C@@H](O)[C@H](NC(=O)CN2CCCCS2(=O)=O)C1)OC ZINC001077393755 679593476 /nfs/dbraw/zinc/59/34/76/679593476.db2.gz KCLFBTJHTJJXAA-BFHYXJOUSA-N 0 3 363.480 -1.002 20 0 FAADHN CC[C@H](CN1C[C@@H](O)[C@H](NC(=O)CN2CCCCS2(=O)=O)C1)OC ZINC001077393756 679593372 /nfs/dbraw/zinc/59/33/72/679593372.db2.gz KCLFBTJHTJJXAA-MGPQQGTHSA-N 0 3 363.480 -1.002 20 0 FAADHN O=C(CN1CCCCS1(=O)=O)N[C@@H]1CN(C[C@@H]2CCOC2)C[C@H]1O ZINC001077393986 679593572 /nfs/dbraw/zinc/59/35/72/679593572.db2.gz WSCFEAKVADBSPN-BFHYXJOUSA-N 0 3 361.464 -1.390 20 0 FAADHN O=C(CN1CCCCS1(=O)=O)N[C@@H]1CN(C[C@H]2CCOC2)C[C@H]1O ZINC001077393987 679593501 /nfs/dbraw/zinc/59/35/01/679593501.db2.gz WSCFEAKVADBSPN-MGPQQGTHSA-N 0 3 361.464 -1.390 20 0 FAADHN CN(C)C(=O)CN1C[C@@H](O)[C@H](NC(=O)[C@H]2CN3CC4CC3(C4)CO2)C1 ZINC001077418664 679594010 /nfs/dbraw/zinc/59/40/10/679594010.db2.gz VILNXQSZICJLGH-DEWJTKQSSA-N 0 3 352.435 -1.901 20 0 FAADHN CN(C)C(=O)CN1C[C@@H](O)[C@H](NC(=O)[C@@H]2CN3CC4CC3(C4)CO2)C1 ZINC001077418665 679594038 /nfs/dbraw/zinc/59/40/38/679594038.db2.gz VILNXQSZICJLGH-JEFPAAPESA-N 0 3 352.435 -1.901 20 0 FAADHN Cn1c(=O)[nH]cc(C(=O)N[C@@H]2CN(CC[C@H]3CCOC3)C[C@H]2O)c1=O ZINC001077498097 679610898 /nfs/dbraw/zinc/61/08/98/679610898.db2.gz AOKKTZDULQANGG-CYZMBNFOSA-N 0 3 352.391 -1.313 20 0 FAADHN Cn1c(=O)[nH]cc(C(=O)N[C@@H]2CN(CC[C@@H]3CCOC3)C[C@H]2O)c1=O ZINC001077498098 679610924 /nfs/dbraw/zinc/61/09/24/679610924.db2.gz AOKKTZDULQANGG-RAIGVLPGSA-N 0 3 352.391 -1.313 20 0 FAADHN Cn1c(=O)[nH]cc(C(=O)N[C@@H]2CN(CC[C@@H]3CCCO3)C[C@H]2O)c1=O ZINC001077498388 679610701 /nfs/dbraw/zinc/61/07/01/679610701.db2.gz HHQVSKBZFGFZBU-CYZMBNFOSA-N 0 3 352.391 -1.170 20 0 FAADHN Cn1c(=O)[nH]cc(C(=O)N[C@@H]2CN(CC[C@H]3CCCO3)C[C@H]2O)c1=O ZINC001077498389 679610670 /nfs/dbraw/zinc/61/06/70/679610670.db2.gz HHQVSKBZFGFZBU-RAIGVLPGSA-N 0 3 352.391 -1.170 20 0 FAADHN CC(C)(C(=O)N[C@@H]1CN([C@H]2CCC(=O)NC2=O)C[C@H]1O)N1CCCC1 ZINC001077505052 679611161 /nfs/dbraw/zinc/61/11/61/679611161.db2.gz LTUJTESLXLWTKP-FRRDWIJNSA-N 0 3 352.435 -1.173 20 0 FAADHN CC(C)(C(=O)N[C@@H]1CN([C@@H]2CCC(=O)NC2=O)C[C@H]1O)N1CCCC1 ZINC001077505053 679611175 /nfs/dbraw/zinc/61/11/75/679611175.db2.gz LTUJTESLXLWTKP-JHJVBQTASA-N 0 3 352.435 -1.173 20 0 FAADHN CCOC1CC(CN2C[C@@H](O)[C@H](NC(=O)CN3CCNC(=O)C3)C2)C1 ZINC001077507857 679612161 /nfs/dbraw/zinc/61/21/61/679612161.db2.gz AAHFWUCTBZRTPV-NEXFUWMNSA-N 0 3 354.451 -1.605 20 0 FAADHN O=C(CN1CCNC(=O)C1)N[C@@H]1CN(CC[C@H]2CCCCO2)C[C@H]1O ZINC001077507873 679611982 /nfs/dbraw/zinc/61/19/82/679611982.db2.gz AQGUSEFGYOKQSD-RBSFLKMASA-N 0 3 354.451 -1.461 20 0 FAADHN O=C(CN1CCNC(=O)C1)N[C@@H]1CN(CC[C@@H]2CCCCO2)C[C@H]1O ZINC001077507874 679612026 /nfs/dbraw/zinc/61/20/26/679612026.db2.gz AQGUSEFGYOKQSD-RRFJBIMHSA-N 0 3 354.451 -1.461 20 0 FAADHN O=C(CN1CCNC(=O)C1)N[C@@H]1CN(CCC[C@@H]2CCOC2)C[C@H]1O ZINC001077507949 679611991 /nfs/dbraw/zinc/61/19/91/679611991.db2.gz FFPSLGVSYFPPLP-RBSFLKMASA-N 0 3 354.451 -1.604 20 0 FAADHN O=C(CN1CCNC(=O)C1)N[C@@H]1CN(CCC[C@H]2CCOC2)C[C@H]1O ZINC001077507950 679612181 /nfs/dbraw/zinc/61/21/81/679612181.db2.gz FFPSLGVSYFPPLP-RRFJBIMHSA-N 0 3 354.451 -1.604 20 0 FAADHN CO[C@@H](CN1C[C@@H](O)[C@H](NC(=O)CN2CCNC(=O)C2)C1)C1CCC1 ZINC001077507971 679612109 /nfs/dbraw/zinc/61/21/09/679612109.db2.gz FUPXPQGFGMREJG-KFWWJZLASA-N 0 3 354.451 -1.605 20 0 FAADHN CO[C@H](CN1C[C@@H](O)[C@H](NC(=O)CN2CCNC(=O)C2)C1)C1CCC1 ZINC001077507972 679612043 /nfs/dbraw/zinc/61/20/43/679612043.db2.gz FUPXPQGFGMREJG-RBSFLKMASA-N 0 3 354.451 -1.605 20 0 FAADHN O=C(CN1CCNC(=O)C1)N[C@@H]1CN(CCC2CCOCC2)C[C@H]1O ZINC001077508221 679612505 /nfs/dbraw/zinc/61/25/05/679612505.db2.gz QDWOVFVVBDSWJC-HUUCEWRRSA-N 0 3 354.451 -1.604 20 0 FAADHN Cn1c(=O)[nH]cc1C(=O)N[C@@H]1CN(C[C@@H]2CCNC(=O)CC2)C[C@H]1O ZINC001077513727 679614254 /nfs/dbraw/zinc/61/42/54/679614254.db2.gz FIGGKEDBWFVEFM-DMDPSCGWSA-N 0 3 351.407 -1.183 20 0 FAADHN Cn1c(=O)[nH]cc1C(=O)N[C@@H]1CN(C[C@H]2CCNC(=O)CC2)C[C@H]1O ZINC001077513728 679614262 /nfs/dbraw/zinc/61/42/62/679614262.db2.gz FIGGKEDBWFVEFM-NQBHXWOUSA-N 0 3 351.407 -1.183 20 0 FAADHN Cc1nc(CN2C[C@@H](O)[C@H](NC(=O)[C@@H]3CN(C(C)C)CCO3)C2)n[nH]1 ZINC001077566782 679628053 /nfs/dbraw/zinc/62/80/53/679628053.db2.gz NYIFCMVOIHEWEV-MCIONIFRSA-N 0 3 352.439 -1.116 20 0 FAADHN Cc1nc(CN2C[C@@H](O)[C@H](NC(=O)[C@H]3CN(C(C)C)CCO3)C2)n[nH]1 ZINC001077566783 679627982 /nfs/dbraw/zinc/62/79/82/679627982.db2.gz NYIFCMVOIHEWEV-MGPQQGTHSA-N 0 3 352.439 -1.116 20 0 FAADHN CN1CC(C(=O)N[C@@H]2CN(CCN3C(=O)CCC3=O)C[C@H]2O)=NC1=O ZINC001077619326 679897596 /nfs/dbraw/zinc/89/75/96/679897596.db2.gz KIYJGZHEHYXVCP-MWLCHTKSSA-N 0 3 351.363 -1.950 20 0 FAADHN CN1CC(C(=O)N[C@@H]2CN(CCN3C(=O)CNC3=O)C[C@H]2O)=NC1=O ZINC001077624806 679898165 /nfs/dbraw/zinc/89/81/65/679898165.db2.gz CBAOWBFNSQEOKT-PSASIEDQSA-N 0 3 352.351 -2.548 20 0 FAADHN Cn1cc(C(=O)N[C@@H]2CN(C[C@@H]3CCNC(=O)CC3)C[C@H]2O)[nH]c1=O ZINC001077625263 679897919 /nfs/dbraw/zinc/89/79/19/679897919.db2.gz YUGVXSFNKAZVCD-DMDPSCGWSA-N 0 3 351.407 -1.183 20 0 FAADHN Cn1cc(C(=O)N[C@@H]2CN(C[C@H]3CCNC(=O)CC3)C[C@H]2O)[nH]c1=O ZINC001077625264 679897849 /nfs/dbraw/zinc/89/78/49/679897849.db2.gz YUGVXSFNKAZVCD-NQBHXWOUSA-N 0 3 351.407 -1.183 20 0 FAADHN O=C(N[C@@H]1CN(CCN2CCCS2(=O)=O)C[C@H]1O)c1[nH]ncc1F ZINC001077633775 679897824 /nfs/dbraw/zinc/89/78/24/679897824.db2.gz DBXBLBZWXKYTCD-GHMZBOCLSA-N 0 3 361.399 -1.641 20 0 FAADHN NC(=O)[C@@H]1CC[C@H](C(=O)N[C@@H]2CN(CCC3CCOCC3)C[C@H]2O)O1 ZINC001077668535 679899675 /nfs/dbraw/zinc/89/96/75/679899675.db2.gz DOBNCFACBBXKGR-APIJFGDWSA-N 0 3 355.435 -1.003 20 0 FAADHN O=C(Cc1cnc[nH]1)N[C@@H]1CN(CC2CCS(=O)(=O)CC2)C[C@H]1O ZINC001077743650 679901947 /nfs/dbraw/zinc/90/19/47/679901947.db2.gz IDEAUERBUWONIU-ZIAGYGMSSA-N 0 3 356.448 -1.062 20 0 FAADHN O=C(Cc1cnc[nH]1)N[C@@H]1CN(C[C@H](O)CN2CCCC2=O)C[C@H]1O ZINC001077743872 679901708 /nfs/dbraw/zinc/90/17/08/679901708.db2.gz SQQAUNCJBXQSHC-BFHYXJOUSA-N 0 3 351.407 -1.903 20 0 FAADHN O=C(N[C@@H]1CN(CCC2CCOCC2)C[C@H]1O)[C@@H]1CC(=O)NC(=O)N1 ZINC001077753636 679902401 /nfs/dbraw/zinc/90/24/01/679902401.db2.gz PRTJUOFMADGHFI-YNEHKIRRSA-N 0 3 354.407 -1.438 20 0 FAADHN C[C@H](F)CCN1C[C@@H](O)[C@H](NC(=O)Cn2ncn3nccc3c2=O)C1 ZINC001077767721 679904104 /nfs/dbraw/zinc/90/41/04/679904104.db2.gz QFEHKYUODBKLDB-DMDPSCGWSA-N 0 3 352.370 -1.200 20 0 FAADHN C[C@@H](F)CCN1C[C@@H](O)[C@H](NC(=O)Cn2ncn3nccc3c2=O)C1 ZINC001077767722 679903974 /nfs/dbraw/zinc/90/39/74/679903974.db2.gz QFEHKYUODBKLDB-NQBHXWOUSA-N 0 3 352.370 -1.200 20 0 FAADHN CC[C@@H](CN1C[C@@H](O)[C@H](NC(=O)c2cn(C)c(=O)n(C)c2=O)C1)OC ZINC001077772172 679904525 /nfs/dbraw/zinc/90/45/25/679904525.db2.gz PDKGGUALZGCJCD-CYZMBNFOSA-N 0 3 354.407 -1.716 20 0 FAADHN CC[C@H](CN1C[C@@H](O)[C@H](NC(=O)c2cn(C)c(=O)n(C)c2=O)C1)OC ZINC001077772173 679904567 /nfs/dbraw/zinc/90/45/67/679904567.db2.gz PDKGGUALZGCJCD-RAIGVLPGSA-N 0 3 354.407 -1.716 20 0 FAADHN CC[C@H](CN1C[C@@H](O)[C@H](NC(=O)CN2C(=O)C(=O)N(C)C2=O)C1)OC ZINC001077772409 679904466 /nfs/dbraw/zinc/90/44/66/679904466.db2.gz AXKNFAZBWGCTKN-GMTAPVOTSA-N 0 3 356.379 -2.007 20 0 FAADHN CC[C@@H](CN1C[C@@H](O)[C@H](NC(=O)CN2C(=O)C(=O)N(C)C2=O)C1)OC ZINC001077772412 679904427 /nfs/dbraw/zinc/90/44/27/679904427.db2.gz AXKNFAZBWGCTKN-HBNTYKKESA-N 0 3 356.379 -2.007 20 0 FAADHN CN1C(=O)C(=O)N(CC(=O)N[C@@H]2CN(C[C@H]3CCOC3)C[C@H]2O)C1=O ZINC001077772714 679904611 /nfs/dbraw/zinc/90/46/11/679904611.db2.gz HHMSXUMDJOFGMZ-GMTAPVOTSA-N 0 3 354.363 -2.395 20 0 FAADHN CN1C(=O)C(=O)N(CC(=O)N[C@@H]2CN(C[C@@H]3CCOC3)C[C@H]2O)C1=O ZINC001077772715 679904442 /nfs/dbraw/zinc/90/44/42/679904442.db2.gz HHMSXUMDJOFGMZ-HBNTYKKESA-N 0 3 354.363 -2.395 20 0 FAADHN CN1CC[C@@H](C(=O)N[C@@H]2CN(CC3CCOCC3)C[C@H]2O)S1(=O)=O ZINC001077820808 679906624 /nfs/dbraw/zinc/90/66/24/679906624.db2.gz LKWNEHIJYSXGOR-MCIONIFRSA-N 0 3 361.464 -1.392 20 0 FAADHN CN1CC[C@H](C(=O)N[C@@H]2CN(CC3CCOCC3)C[C@H]2O)S1(=O)=O ZINC001077820809 679906697 /nfs/dbraw/zinc/90/66/97/679906697.db2.gz LKWNEHIJYSXGOR-MGPQQGTHSA-N 0 3 361.464 -1.392 20 0 FAADHN CO[C@H](CN1C[C@@H](O)[C@H](NC(=O)CN2CC(=O)NC2=O)C1)C1CCC1 ZINC001077853085 679910729 /nfs/dbraw/zinc/91/07/29/679910729.db2.gz JWWSJEPSKWUGHS-JHJVBQTASA-N 0 3 354.407 -1.485 20 0 FAADHN CO[C@@H](CN1C[C@@H](O)[C@H](NC(=O)CN2CC(=O)NC2=O)C1)C1CCC1 ZINC001077853086 679910511 /nfs/dbraw/zinc/91/05/11/679910511.db2.gz JWWSJEPSKWUGHS-UPJWGTAASA-N 0 3 354.407 -1.485 20 0 FAADHN CCOC1CC(CN2C[C@@H](O)[C@H](NC(=O)CN3CC(=O)NC3=O)C2)C1 ZINC001077853127 679910771 /nfs/dbraw/zinc/91/07/71/679910771.db2.gz MKWVZEOAMSUXQH-FIYWTHMPSA-N 0 3 354.407 -1.485 20 0 FAADHN O=C(CN1CC(=O)NC1=O)N[C@@H]1CN(CCC[C@@H]2CCOC2)C[C@H]1O ZINC001077853143 679910777 /nfs/dbraw/zinc/91/07/77/679910777.db2.gz NGGOAWUJPWXHNT-JHJVBQTASA-N 0 3 354.407 -1.484 20 0 FAADHN O=C(CN1CC(=O)NC1=O)N[C@@H]1CN(CCC[C@H]2CCOC2)C[C@H]1O ZINC001077853144 679910494 /nfs/dbraw/zinc/91/04/94/679910494.db2.gz NGGOAWUJPWXHNT-YNEHKIRRSA-N 0 3 354.407 -1.484 20 0 FAADHN O=C(CN1CC(=O)NC1=O)N[C@@H]1CN(CC[C@H]2CCCCO2)C[C@H]1O ZINC001077853199 679910639 /nfs/dbraw/zinc/91/06/39/679910639.db2.gz QAVSOMIFDMWXDU-JHJVBQTASA-N 0 3 354.407 -1.341 20 0 FAADHN O=C(CN1CC(=O)NC1=O)N[C@@H]1CN(CC[C@@H]2CCCCO2)C[C@H]1O ZINC001077853200 679910595 /nfs/dbraw/zinc/91/05/95/679910595.db2.gz QAVSOMIFDMWXDU-YNEHKIRRSA-N 0 3 354.407 -1.341 20 0 FAADHN CS(=O)(=O)N1CC[C@H](CN2C[C@@H](O)[C@H](NC(=O)c3nc[nH]n3)C2)C1 ZINC001077861297 679909908 /nfs/dbraw/zinc/90/99/08/679909908.db2.gz ACSXYFYQUOKWNC-GMTAPVOTSA-N 0 3 358.424 -2.139 20 0 FAADHN CS(=O)(=O)N1CC[C@H](CN2C[C@@H](O)[C@H](NC(=O)c3ncn[nH]3)C2)C1 ZINC001077861297 679909905 /nfs/dbraw/zinc/90/99/05/679909905.db2.gz ACSXYFYQUOKWNC-GMTAPVOTSA-N 0 3 358.424 -2.139 20 0 FAADHN CS(=O)(=O)N1CC[C@@H](CN2C[C@@H](O)[C@H](NC(=O)c3nc[nH]n3)C2)C1 ZINC001077861298 679909554 /nfs/dbraw/zinc/90/95/54/679909554.db2.gz ACSXYFYQUOKWNC-HBNTYKKESA-N 0 3 358.424 -2.139 20 0 FAADHN CS(=O)(=O)N1CC[C@@H](CN2C[C@@H](O)[C@H](NC(=O)c3ncn[nH]3)C2)C1 ZINC001077861298 679909551 /nfs/dbraw/zinc/90/95/51/679909551.db2.gz ACSXYFYQUOKWNC-HBNTYKKESA-N 0 3 358.424 -2.139 20 0 FAADHN CCn1cc(C(=O)N[C@@H]2CN(C[C@@H]3CCNC(=O)CC3)C[C@H]2O)nn1 ZINC001077911549 679912420 /nfs/dbraw/zinc/91/24/20/679912420.db2.gz USMPRLBNENUIKA-OUCADQQQSA-N 0 3 350.423 -1.011 20 0 FAADHN CCn1cc(C(=O)N[C@@H]2CN(C[C@H]3CCNC(=O)CC3)C[C@H]2O)nn1 ZINC001077911550 679912647 /nfs/dbraw/zinc/91/26/47/679912647.db2.gz USMPRLBNENUIKA-YRGRVCCFSA-N 0 3 350.423 -1.011 20 0 FAADHN Cc1nonc1CC(=O)N[C@@H]1CN(C[C@@H]2CCNC(=O)CC2)C[C@H]1O ZINC001077919156 679913445 /nfs/dbraw/zinc/91/34/45/679913445.db2.gz WBNRQWNYTGMLMP-IACUBPJLSA-N 0 3 351.407 -1.002 20 0 FAADHN Cc1nonc1CC(=O)N[C@@H]1CN(C[C@H]2CCNC(=O)CC2)C[C@H]1O ZINC001077919157 679913258 /nfs/dbraw/zinc/91/32/58/679913258.db2.gz WBNRQWNYTGMLMP-MRVWCRGKSA-N 0 3 351.407 -1.002 20 0 FAADHN CC[C@H](CN1C[C@@H](O)[C@H](NC(=O)CN2C(=O)NC(=O)C2(C)C)C1)OC ZINC001077949771 679913224 /nfs/dbraw/zinc/91/32/24/679913224.db2.gz MRTLIXZAFJVSCY-IJLUTSLNSA-N 0 3 356.423 -1.097 20 0 FAADHN CC[C@@H](CN1C[C@@H](O)[C@H](NC(=O)CN2C(=O)NC(=O)C2(C)C)C1)OC ZINC001077949772 679913486 /nfs/dbraw/zinc/91/34/86/679913486.db2.gz MRTLIXZAFJVSCY-QJPTWQEYSA-N 0 3 356.423 -1.097 20 0 FAADHN O=C(CN1CCC(=O)NC1=O)N[C@@H]1CN(CC[C@@H]2CCOC2)C[C@H]1O ZINC001077956126 679913674 /nfs/dbraw/zinc/91/36/74/679913674.db2.gz QYNQXYLGIMMEKY-JHJVBQTASA-N 0 3 354.407 -1.484 20 0 FAADHN O=C(CN1CCC(=O)NC1=O)N[C@@H]1CN(CC[C@H]2CCOC2)C[C@H]1O ZINC001077956127 679914188 /nfs/dbraw/zinc/91/41/88/679914188.db2.gz QYNQXYLGIMMEKY-YNEHKIRRSA-N 0 3 354.407 -1.484 20 0 FAADHN O=C(CN1CCC(=O)NC1=O)N[C@@H]1CN(CC[C@H]2CCCO2)C[C@H]1O ZINC001077956265 679913742 /nfs/dbraw/zinc/91/37/42/679913742.db2.gz YKRFIWBVSHUTEV-JHJVBQTASA-N 0 3 354.407 -1.341 20 0 FAADHN O=C(CN1CCC(=O)NC1=O)N[C@@H]1CN(CC[C@@H]2CCCO2)C[C@H]1O ZINC001077956266 679914205 /nfs/dbraw/zinc/91/42/05/679914205.db2.gz YKRFIWBVSHUTEV-YNEHKIRRSA-N 0 3 354.407 -1.341 20 0 FAADHN O=C(Cc1nnc[nH]1)N[C@@H]1CN(C[C@H](O)CN2CCCC2=O)C[C@H]1O ZINC001077976377 679916532 /nfs/dbraw/zinc/91/65/32/679916532.db2.gz IASSRTFCCDWACT-QJPTWQEYSA-N 0 3 352.395 -2.508 20 0 FAADHN O=C(Cc1nnc[nH]1)N[C@@H]1CN(CCCN2C(=O)CNC2=O)C[C@H]1O ZINC001077976693 679916927 /nfs/dbraw/zinc/91/69/27/679916927.db2.gz QUQROBWDIRCJOI-NXEZZACHSA-N 0 3 351.367 -2.550 20 0 FAADHN CN1C(=O)CN(CC(=O)N[C@@H]2CN(CC[C@@H]3CCOC3)C[C@H]2O)C1=O ZINC001077994375 679918473 /nfs/dbraw/zinc/91/84/73/679918473.db2.gz FYQORFRVMHEGJD-JHJVBQTASA-N 0 3 354.407 -1.532 20 0 FAADHN CN1C(=O)CN(CC(=O)N[C@@H]2CN(CC[C@H]3CCOC3)C[C@H]2O)C1=O ZINC001077994376 679918139 /nfs/dbraw/zinc/91/81/39/679918139.db2.gz FYQORFRVMHEGJD-YNEHKIRRSA-N 0 3 354.407 -1.532 20 0 FAADHN CN1C(=O)CN(CC(=O)N[C@@H]2CN(CC[C@H]3CCCO3)C[C@H]2O)C1=O ZINC001077994424 679918255 /nfs/dbraw/zinc/91/82/55/679918255.db2.gz IHRKFEPUUSOIOB-JHJVBQTASA-N 0 3 354.407 -1.389 20 0 FAADHN CN1C(=O)CN(CC(=O)N[C@@H]2CN(CC[C@@H]3CCCO3)C[C@H]2O)C1=O ZINC001077994425 679918486 /nfs/dbraw/zinc/91/84/86/679918486.db2.gz IHRKFEPUUSOIOB-YNEHKIRRSA-N 0 3 354.407 -1.389 20 0 FAADHN CC(C)(C(=O)N[C@@H]1CN(CCN2CCNC2=O)C[C@H]1O)c1cnc[nH]1 ZINC001078009885 679919895 /nfs/dbraw/zinc/91/98/95/679919895.db2.gz WWKVBHOHUVGFKG-VXGBXAGGSA-N 0 3 350.423 -1.126 20 0 FAADHN Cc1[nH]cnc1CC(=O)N[C@@H]1CN(CC(=O)N2CCOCC2)C[C@H]1O ZINC001078080816 679922268 /nfs/dbraw/zinc/92/22/68/679922268.db2.gz GGAVUVMLFVODCI-ZIAGYGMSSA-N 0 3 351.407 -1.719 20 0 FAADHN Cc1[nH]cnc1CC(=O)N[C@@H]1CN(CCN2CCCS2(=O)=O)C[C@H]1O ZINC001078080976 679922246 /nfs/dbraw/zinc/92/22/46/679922246.db2.gz NGJWKYAUZJAOTQ-ZIAGYGMSSA-N 0 3 371.463 -1.543 20 0 FAADHN Cc1[nH]cnc1CC(=O)N[C@@H]1CN(C[C@@H]2CCS(=O)(=O)C2)C[C@H]1O ZINC001078081350 679922113 /nfs/dbraw/zinc/92/21/13/679922113.db2.gz VHRWFHKLPSXAJY-IACUBPJLSA-N 0 3 356.448 -1.143 20 0 FAADHN Cc1[nH]cnc1CC(=O)N[C@@H]1CN(C[C@H]2CCS(=O)(=O)C2)C[C@H]1O ZINC001078081351 679922273 /nfs/dbraw/zinc/92/22/73/679922273.db2.gz VHRWFHKLPSXAJY-MRVWCRGKSA-N 0 3 356.448 -1.143 20 0 FAADHN Cc1[nH]cnc1CC(=O)N[C@@H]1CN(CC(=O)Nc2nncs2)C[C@H]1O ZINC001078081442 679922311 /nfs/dbraw/zinc/92/23/11/679922311.db2.gz WQOHJTYKVVGTIV-GHMZBOCLSA-N 0 3 365.419 -1.088 20 0 FAADHN Cc1nn(CC(=O)N[C@@H]2CN(CC[C@@H]3CCCO3)C[C@H]2O)c(=O)n1C ZINC001078100305 679924532 /nfs/dbraw/zinc/92/45/32/679924532.db2.gz FYOMDXSVMAHYOL-BFHYXJOUSA-N 0 3 353.423 -1.379 20 0 FAADHN Cc1nn(CC(=O)N[C@@H]2CN(CC[C@H]3CCCO3)C[C@H]2O)c(=O)n1C ZINC001078100308 679924341 /nfs/dbraw/zinc/92/43/41/679924341.db2.gz FYOMDXSVMAHYOL-MGPQQGTHSA-N 0 3 353.423 -1.379 20 0 FAADHN Cc1nn(CC(=O)N[C@@H]2CN(CC[C@H]3CCOC3)C[C@H]2O)c(=O)n1C ZINC001078105624 679925739 /nfs/dbraw/zinc/92/57/39/679925739.db2.gz IMRDNCZPVJYHGE-BFHYXJOUSA-N 0 3 353.423 -1.522 20 0 FAADHN Cc1nn(CC(=O)N[C@@H]2CN(CC[C@@H]3CCOC3)C[C@H]2O)c(=O)n1C ZINC001078105625 679925670 /nfs/dbraw/zinc/92/56/70/679925670.db2.gz IMRDNCZPVJYHGE-MGPQQGTHSA-N 0 3 353.423 -1.522 20 0 FAADHN CC[C@H](CN1C[C@@H](O)[C@H](NC(=O)CN2C(=O)NC(C)(C)C2=O)C1)OC ZINC001078124447 679926549 /nfs/dbraw/zinc/92/65/49/679926549.db2.gz QYAYLALBOSNAJA-IJLUTSLNSA-N 0 3 356.423 -1.097 20 0 FAADHN CC[C@@H](CN1C[C@@H](O)[C@H](NC(=O)CN2C(=O)NC(C)(C)C2=O)C1)OC ZINC001078124448 679926441 /nfs/dbraw/zinc/92/64/41/679926441.db2.gz QYAYLALBOSNAJA-QJPTWQEYSA-N 0 3 356.423 -1.097 20 0 FAADHN O=C(CN1C(=O)CNC1=O)N[C@@H]1CN(CCC[C@@H]2CCOC2)C[C@H]1O ZINC001078144164 679928453 /nfs/dbraw/zinc/92/84/53/679928453.db2.gz BMWVAGYBMOUMQY-JHJVBQTASA-N 0 3 354.407 -1.484 20 0 FAADHN O=C(CN1C(=O)CNC1=O)N[C@@H]1CN(CCC[C@H]2CCOC2)C[C@H]1O ZINC001078144165 679928426 /nfs/dbraw/zinc/92/84/26/679928426.db2.gz BMWVAGYBMOUMQY-YNEHKIRRSA-N 0 3 354.407 -1.484 20 0 FAADHN CN1CC(=O)N(CC(=O)N[C@@H]2CN(CC[C@@H]3CCOC3)C[C@H]2O)C1=O ZINC001078144310 679928244 /nfs/dbraw/zinc/92/82/44/679928244.db2.gz JDQJNMDCAMMZGP-JHJVBQTASA-N 0 3 354.407 -1.532 20 0 FAADHN CN1CC(=O)N(CC(=O)N[C@@H]2CN(CC[C@H]3CCOC3)C[C@H]2O)C1=O ZINC001078144311 679928333 /nfs/dbraw/zinc/92/83/33/679928333.db2.gz JDQJNMDCAMMZGP-YNEHKIRRSA-N 0 3 354.407 -1.532 20 0 FAADHN O=C(CN1C(=O)CNC1=O)N[C@@H]1CN(CCC2CCOCC2)C[C@H]1O ZINC001078144445 679929241 /nfs/dbraw/zinc/92/92/41/679929241.db2.gz OWDBKPDNAICILG-CHWSQXEVSA-N 0 3 354.407 -1.484 20 0 FAADHN CCOC1CC(CN2C[C@@H](O)[C@H](NC(=O)CN3C(=O)CNC3=O)C2)C1 ZINC001078144515 679929141 /nfs/dbraw/zinc/92/91/41/679929141.db2.gz SNMQOSYFEJXDFZ-FIYWTHMPSA-N 0 3 354.407 -1.485 20 0 FAADHN O=C(CN1C(=O)CNC1=O)N[C@@H]1CN(CC[C@H]2CCCCO2)C[C@H]1O ZINC001078144561 679929118 /nfs/dbraw/zinc/92/91/18/679929118.db2.gz VRYFREQLEODNMW-JHJVBQTASA-N 0 3 354.407 -1.341 20 0 FAADHN O=C(CN1C(=O)CNC1=O)N[C@@H]1CN(CC[C@@H]2CCCCO2)C[C@H]1O ZINC001078144562 679928958 /nfs/dbraw/zinc/92/89/58/679928958.db2.gz VRYFREQLEODNMW-YNEHKIRRSA-N 0 3 354.407 -1.341 20 0 FAADHN CN1CC(=O)N(CC(=O)N[C@@H]2CN(CC[C@H]3CCCO3)C[C@H]2O)C1=O ZINC001078144585 679928918 /nfs/dbraw/zinc/92/89/18/679928918.db2.gz WTWLZMHOSNTXOQ-JHJVBQTASA-N 0 3 354.407 -1.389 20 0 FAADHN CN1CC(=O)N(CC(=O)N[C@@H]2CN(CC[C@@H]3CCCO3)C[C@H]2O)C1=O ZINC001078144586 679928935 /nfs/dbraw/zinc/92/89/35/679928935.db2.gz WTWLZMHOSNTXOQ-YNEHKIRRSA-N 0 3 354.407 -1.389 20 0 FAADHN CO[C@H](CN1C[C@@H](O)[C@H](NC(=O)CN2C(=O)CNC2=O)C1)C1CCC1 ZINC001078146493 679929777 /nfs/dbraw/zinc/92/97/77/679929777.db2.gz JPCLIZUAUPZNFV-JHJVBQTASA-N 0 3 354.407 -1.485 20 0 FAADHN CO[C@@H](CN1C[C@@H](O)[C@H](NC(=O)CN2C(=O)CNC2=O)C1)C1CCC1 ZINC001078146494 679929869 /nfs/dbraw/zinc/92/98/69/679929869.db2.gz JPCLIZUAUPZNFV-UPJWGTAASA-N 0 3 354.407 -1.485 20 0 FAADHN Cn1cc(C(=O)N[C@@H]2CN(CC[C@@H]3CCCO3)C[C@H]2O)c(=O)[nH]c1=O ZINC001078170113 679933195 /nfs/dbraw/zinc/93/31/95/679933195.db2.gz XEGLCXIWSDWWMF-CYZMBNFOSA-N 0 3 352.391 -1.170 20 0 FAADHN Cn1cc(C(=O)N[C@@H]2CN(CC[C@H]3CCCO3)C[C@H]2O)c(=O)[nH]c1=O ZINC001078170114 679933008 /nfs/dbraw/zinc/93/30/08/679933008.db2.gz XEGLCXIWSDWWMF-RAIGVLPGSA-N 0 3 352.391 -1.170 20 0 FAADHN O=C(CN1CCCC1)N[C@@H]1CN(C[C@H](O)CN2CCCC2=O)C[C@H]1O ZINC001078179155 679932420 /nfs/dbraw/zinc/93/24/20/679932420.db2.gz VLKHHHIIMFADKE-RRFJBIMHSA-N 0 3 354.451 -1.773 20 0 FAADHN O=C(CN1CCCC1)N[C@@H]1CN(CCCN2C(=O)CNC2=O)C[C@H]1O ZINC001078179872 679932192 /nfs/dbraw/zinc/93/21/92/679932192.db2.gz BNZBVXZASWICFU-CHWSQXEVSA-N 0 3 353.423 -1.815 20 0 FAADHN O=C(N[C@@H]1CN(CCC2CCOCC2)C[C@H]1O)[C@@H]1CCS(=O)(=O)N1 ZINC001078193181 679934750 /nfs/dbraw/zinc/93/47/50/679934750.db2.gz GIPABFCFCJVLRV-BFHYXJOUSA-N 0 3 361.464 -1.344 20 0 FAADHN O=C(N[C@@H]1CN(CCC2CCOCC2)C[C@H]1O)[C@H]1CCS(=O)(=O)N1 ZINC001078193182 679934772 /nfs/dbraw/zinc/93/47/72/679934772.db2.gz GIPABFCFCJVLRV-MGPQQGTHSA-N 0 3 361.464 -1.344 20 0 FAADHN CC1(C)CC(CN2C[C@@H](O)[C@H](NC(=O)c3cn(CC(N)=O)nn3)C2)C1 ZINC001078229362 679939575 /nfs/dbraw/zinc/93/95/75/679939575.db2.gz FGJGRHYUCFVSKQ-DGCLKSJQSA-N 0 3 350.423 -1.026 20 0 FAADHN NC(=O)Cn1cc(C(=O)N[C@@H]2CN(CC[C@H]3CCOC3)C[C@H]2O)nn1 ZINC001078229436 679939581 /nfs/dbraw/zinc/93/95/81/679939581.db2.gz IDVCNTMAFOLJMB-DMDPSCGWSA-N 0 3 352.395 -2.035 20 0 FAADHN NC(=O)Cn1cc(C(=O)N[C@@H]2CN(CC[C@@H]3CCOC3)C[C@H]2O)nn1 ZINC001078229437 679939705 /nfs/dbraw/zinc/93/97/05/679939705.db2.gz IDVCNTMAFOLJMB-NQBHXWOUSA-N 0 3 352.395 -2.035 20 0 FAADHN NC(=O)Cn1cc(C(=O)N[C@@H]2CN(C[C@@H]3CCCOC3)C[C@H]2O)nn1 ZINC001078229624 679940314 /nfs/dbraw/zinc/94/03/14/679940314.db2.gz QYFJANNDTPULTO-DMDPSCGWSA-N 0 3 352.395 -2.035 20 0 FAADHN NC(=O)Cn1cc(C(=O)N[C@@H]2CN(C[C@H]3CCCOC3)C[C@H]2O)nn1 ZINC001078229625 679940354 /nfs/dbraw/zinc/94/03/54/679940354.db2.gz QYFJANNDTPULTO-NQBHXWOUSA-N 0 3 352.395 -2.035 20 0 FAADHN NC(=O)Cn1cc(C(=O)N[C@@H]2CN(CC3CCOCC3)C[C@H]2O)nn1 ZINC001078229697 679940448 /nfs/dbraw/zinc/94/04/48/679940448.db2.gz UOLMCAAAMJNUPY-DGCLKSJQSA-N 0 3 352.395 -2.035 20 0 FAADHN CN(C)C(=O)Cn1cc(C(=O)N[C@@H]2CN(CC3CCC3)C[C@H]2O)nn1 ZINC001078230512 679940598 /nfs/dbraw/zinc/94/05/98/679940598.db2.gz FSUNKNDHIDOZEX-TZMCWYRMSA-N 0 3 350.423 -1.059 20 0 FAADHN CN(C)C(=O)Cn1cc(C(=O)N[C@@H]2CN(CCC3CC3)C[C@H]2O)nn1 ZINC001078230520 679940236 /nfs/dbraw/zinc/94/02/36/679940236.db2.gz FXIUIELAICAVAG-TZMCWYRMSA-N 0 3 350.423 -1.059 20 0 FAADHN C[C@@H]1CN(C[C@H](O)CN2CCCC2=O)C[C@H]1NC(=O)Cn1cnnn1 ZINC001079395305 679979658 /nfs/dbraw/zinc/97/96/58/679979658.db2.gz AGHBLISRROFIOA-FRRDWIJNSA-N 0 3 351.411 -1.907 20 0 FAADHN C[C@@H]1CN(C[C@@H]2CCN(S(C)(=O)=O)C2)C[C@H]1NC(=O)Cn1cnnn1 ZINC001079395780 679979743 /nfs/dbraw/zinc/97/97/43/679979743.db2.gz WPLBZCHFCRIPDQ-FRRDWIJNSA-N 0 3 371.467 -1.609 20 0 FAADHN C[C@@H]1CN(C[C@H]2CCN(S(C)(=O)=O)C2)C[C@H]1NC(=O)Cn1cnnn1 ZINC001079395781 679979225 /nfs/dbraw/zinc/97/92/25/679979225.db2.gz WPLBZCHFCRIPDQ-JHJVBQTASA-N 0 3 371.467 -1.609 20 0 FAADHN C[C@@H]1CN(CCCN2C(=O)CNC2=O)C[C@H]1NC(=O)Cn1cnnn1 ZINC001079396952 679979631 /nfs/dbraw/zinc/97/96/31/679979631.db2.gz NBYCNTQQJQQAFO-GHMZBOCLSA-N 0 3 350.383 -1.949 20 0 FAADHN C[C@@H]1CN(CCCN2C(=O)CNC2=O)C[C@H]1NC(=O)[C@H]1COCCO1 ZINC001079440910 679979273 /nfs/dbraw/zinc/97/92/73/679979273.db2.gz XWOIRQBCBZLARL-JHJVBQTASA-N 0 3 354.407 -1.220 20 0 FAADHN C[C@@H]1CN(CCCN2C(=O)CNC2=O)C[C@H]1NC(=O)[C@@H]1COCCO1 ZINC001079440911 679979551 /nfs/dbraw/zinc/97/95/51/679979551.db2.gz XWOIRQBCBZLARL-UPJWGTAASA-N 0 3 354.407 -1.220 20 0 FAADHN C[C@@H]1CN(C[C@H](O)CN2CCCC2=O)C[C@H]1NC(=O)[C@H]1CCC(=O)N1 ZINC001079493299 679980189 /nfs/dbraw/zinc/98/01/89/679980189.db2.gz HYHDWACJOYHQSE-XJFOESAGSA-N 0 3 352.435 -1.315 20 0 FAADHN C[C@@H]1CN(CCCN2C(=O)CNC2=O)C[C@H]1NC(=O)[C@H]1CCC(=O)N1 ZINC001079496267 679980263 /nfs/dbraw/zinc/98/02/63/679980263.db2.gz SQRITWZKGQMHFS-IJLUTSLNSA-N 0 3 351.407 -1.357 20 0 FAADHN C[C@@H]1CN(CCCN2C(=O)CNC2=O)C[C@H]1NC(=O)[C@H]1COC(=O)N1 ZINC001079649418 679981747 /nfs/dbraw/zinc/98/17/47/679981747.db2.gz IJZOFFNDEZNDKA-GMTAPVOTSA-N 0 3 353.379 -1.527 20 0 FAADHN C[C@@H]1CN(CCCN2C(=O)CNC2=O)C[C@H]1NC(=O)[C@@H]1COC(=O)N1 ZINC001079649419 679981701 /nfs/dbraw/zinc/98/17/01/679981701.db2.gz IJZOFFNDEZNDKA-MXWKQRLJSA-N 0 3 353.379 -1.527 20 0 FAADHN C[C@@H]1CN(C[C@@H]2CCN(S(C)(=O)=O)C2)C[C@H]1NC(=O)Cn1ncnn1 ZINC001079704202 679981228 /nfs/dbraw/zinc/98/12/28/679981228.db2.gz NDAAKRKENXGSGE-FRRDWIJNSA-N 0 3 371.467 -1.609 20 0 FAADHN C[C@@H]1CN(C[C@H]2CCN(S(C)(=O)=O)C2)C[C@H]1NC(=O)Cn1ncnn1 ZINC001079704203 679981647 /nfs/dbraw/zinc/98/16/47/679981647.db2.gz NDAAKRKENXGSGE-JHJVBQTASA-N 0 3 371.467 -1.609 20 0 FAADHN C[C@@H]1CN(C[C@H](O)CN2CCCC2=O)C[C@H]1NC(=O)Cn1ncnn1 ZINC001079704281 679981398 /nfs/dbraw/zinc/98/13/98/679981398.db2.gz RMJMGONWONIYHT-FRRDWIJNSA-N 0 3 351.411 -1.907 20 0 FAADHN C[C@@H]1CN(CCCN2C(=O)CNC2=O)C[C@H]1NC(=O)Cn1ncnn1 ZINC001079705354 679981296 /nfs/dbraw/zinc/98/12/96/679981296.db2.gz YUBJNJCUUCZRNT-GHMZBOCLSA-N 0 3 350.383 -1.949 20 0 FAADHN C[C@@H]1CN(C[C@H](O)CN2CCCC2=O)C[C@H]1NC(=O)Cn1nccn1 ZINC001079771579 679982258 /nfs/dbraw/zinc/98/22/58/679982258.db2.gz KFXQWFCOKZGGOG-HZSPNIEDSA-N 0 3 350.423 -1.302 20 0 FAADHN C[C@@H]1CN(C[C@@H]2CCN(S(C)(=O)=O)C2)C[C@H]1NC(=O)Cn1nccn1 ZINC001079771859 679982430 /nfs/dbraw/zinc/98/24/30/679982430.db2.gz XMWDLGCTCAGHHZ-HZSPNIEDSA-N 0 3 370.479 -1.004 20 0 FAADHN C[C@@H]1CN(C[C@H]2CCN(S(C)(=O)=O)C2)C[C@H]1NC(=O)Cn1nccn1 ZINC001079771860 679982549 /nfs/dbraw/zinc/98/25/49/679982549.db2.gz XMWDLGCTCAGHHZ-MGPQQGTHSA-N 0 3 370.479 -1.004 20 0 FAADHN C[C@@H]1CN(CCCN2C(=O)CNC2=O)C[C@H]1NC(=O)[C@H]1CCNC1=O ZINC001080263023 679988270 /nfs/dbraw/zinc/98/82/70/679988270.db2.gz ZXNMUYHDHBKGTQ-GRYCIOLGSA-N 0 3 351.407 -1.499 20 0 FAADHN C[C@@H]1CN(CCCN2C(=O)CNC2=O)C[C@H]1NC(=O)[C@@H]1CCNC1=O ZINC001080263024 679987992 /nfs/dbraw/zinc/98/79/92/679987992.db2.gz ZXNMUYHDHBKGTQ-IJLUTSLNSA-N 0 3 351.407 -1.499 20 0 FAADHN C[C@@H]1CN(CCCN2C(=O)CNC2=O)C[C@H]1NC(=O)[C@H]1CNC(=O)N1 ZINC001080363062 679989367 /nfs/dbraw/zinc/98/93/67/679989367.db2.gz NPEFCWXAEBGIGO-GMTAPVOTSA-N 0 3 352.395 -1.954 20 0 FAADHN C[C@@H]1CN(CCCN2C(=O)CNC2=O)C[C@H]1NC(=O)[C@@H]1CNC(=O)N1 ZINC001080363063 679989047 /nfs/dbraw/zinc/98/90/47/679989047.db2.gz NPEFCWXAEBGIGO-OUAUKWLOSA-N 0 3 352.395 -1.954 20 0 FAADHN C[C@@H]1CN(CC(=O)N2CCNC(=O)C2)C[C@H]1NC(=O)c1[nH]ncc1F ZINC001080398804 679989498 /nfs/dbraw/zinc/98/94/98/679989498.db2.gz MDMNGCIJWRHVEL-MWLCHTKSSA-N 0 3 352.370 -1.443 20 0 FAADHN C[C@@H]1CN(CCCN2C(=O)CNC2=O)C[C@H]1NC(=O)[C@H]1C[C@H]1C(N)=O ZINC001080460747 679990054 /nfs/dbraw/zinc/99/00/54/679990054.db2.gz QZEFBSQLAQXNEJ-WISYIIOYSA-N 0 3 351.407 -1.514 20 0 FAADHN C[C@@H]1CN(C[C@@H](O)CN2C(=O)CCC2=O)C[C@H]1NC(=O)c1nnc[nH]1 ZINC001080641491 679992227 /nfs/dbraw/zinc/99/22/27/679992227.db2.gz 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20 0 FAADHN NS(=O)(=O)c1n[n-]cc1C(=O)NC[C@H]1CC[C@@H]([NH2+][C@@H]2CCNC2=O)C1 ZINC001086799027 790841612 /nfs/dbraw/zinc/84/16/12/790841612.db2.gz UNBUNSYNCKGTOE-IQJOONFLSA-N 0 3 370.435 -1.566 20 0 FAADHN NS(=O)(=O)c1n[n-]cc1C(=O)NC[C@H]1CC[C@@H]([NH2+][C@H]2CCNC2=O)C1 ZINC001086799028 790841538 /nfs/dbraw/zinc/84/15/38/790841538.db2.gz UNBUNSYNCKGTOE-NGZCFLSTSA-N 0 3 370.435 -1.566 20 0 FAADHN C[C@@H]([NH2+][C@@H]1CC[C@H](CNC(=O)c2c[n-]nc2S(N)(=O)=O)C1)C(N)=O ZINC001086799037 790842031 /nfs/dbraw/zinc/84/20/31/790842031.db2.gz UVGOGCGNEFCYQO-HRDYMLBCSA-N 0 3 358.424 -1.581 20 0 FAADHN C[C@H]([NH2+][C@@H]1CC[C@H](CNC(=O)c2c[n-]nc2S(N)(=O)=O)C1)C(N)=O ZINC001086799038 790841716 /nfs/dbraw/zinc/84/17/16/790841716.db2.gz UVGOGCGNEFCYQO-XHNCKOQMSA-N 0 3 358.424 -1.581 20 0 FAADHN COCC(=O)N1C[C@@H](c2cnn(C)c2)[C@H](NCCN2CCNC2=O)C1 ZINC001086959194 790916483 /nfs/dbraw/zinc/91/64/83/790916483.db2.gz UQPPYVQGQZKYRR-UONOGXRCSA-N 0 3 350.423 -1.024 20 0 FAADHN Cn1cc([C@@H]2CN(C(=O)CC3CS(=O)(=O)C3)C[C@H]2NCCO)cn1 ZINC001086985548 790917171 /nfs/dbraw/zinc/91/71/71/790917171.db2.gz QACOAKVFCVQYPK-UONOGXRCSA-N 0 3 356.448 -1.269 20 0 FAADHN Cn1cc([C@@H]2CN(C(=O)[C@H]3CCS(=O)(=O)C3)C[C@H]2NCCO)cn1 ZINC001086986207 790916533 /nfs/dbraw/zinc/91/65/33/790916533.db2.gz CBNLXXQFJQVHNR-FPMFFAJLSA-N 0 3 356.448 -1.269 20 0 FAADHN Cn1cc([C@@H]2CN(C(=O)[C@@H]3CCS(=O)(=O)C3)C[C@H]2NCCO)cn1 ZINC001086986208 790916453 /nfs/dbraw/zinc/91/64/53/790916453.db2.gz CBNLXXQFJQVHNR-KWCYVHTRSA-N 0 3 356.448 -1.269 20 0 FAADHN Cn1cc([C@@H]2CN(C(=O)C(N)=O)C[C@H]2NC[C@H]2CCS(=O)(=O)C2)cn1 ZINC001086994279 790916803 /nfs/dbraw/zinc/91/68/03/790916803.db2.gz RYEMNRNBQDJVTQ-KGYLQXTDSA-N 0 3 369.447 -1.776 20 0 FAADHN Cn1cc([C@@H]2CN(C(=O)C(N)=O)C[C@H]2NC[C@@H]2CCS(=O)(=O)C2)cn1 ZINC001086994280 790917020 /nfs/dbraw/zinc/91/70/20/790917020.db2.gz RYEMNRNBQDJVTQ-WCFLWFBJSA-N 0 3 369.447 -1.776 20 0 FAADHN CCO[C@@H]1CN(C(=O)CS(C)(=O)=O)C[C@H]1CNCc1cnnn1C ZINC001087032496 790918189 /nfs/dbraw/zinc/91/81/89/790918189.db2.gz RRROKDBPJSJLKB-DGCLKSJQSA-N 0 3 359.452 -1.187 20 0 FAADHN CCO[C@@H]1CN(C(=O)C2CS(=O)(=O)C2)C[C@H]1CNCc1cnnn1C ZINC001087057487 790920604 /nfs/dbraw/zinc/92/06/04/790920604.db2.gz FIGJMYJXXIDEEJ-BXUZGUMPSA-N 0 3 371.463 -1.187 20 0 FAADHN CCO[C@@H]1CN(C(=O)c2cn[n-]n2)C[C@H]1C[NH2+][C@@H]1CCC(=O)NC1=O ZINC001087064508 790920455 /nfs/dbraw/zinc/92/04/55/790920455.db2.gz DSVNOKSPBGYIRG-CKYFFXLPSA-N 0 3 350.379 -1.323 20 0 FAADHN CCO[C@@H]1CN(C(=O)c2cn[n-]n2)C[C@H]1C[NH2+][C@H]1CCC(=O)NC1=O ZINC001087064509 790920134 /nfs/dbraw/zinc/92/01/34/790920134.db2.gz DSVNOKSPBGYIRG-JFGNBEQYSA-N 0 3 350.379 -1.323 20 0 FAADHN CCO[C@@H]1CN(C(=O)c2nc[n-]n2)C[C@H]1C[NH2+][C@@H]1CCC(=O)NC1=O ZINC001087092129 790921387 /nfs/dbraw/zinc/92/13/87/790921387.db2.gz XYGMLKJWZAXADI-GMTAPVOTSA-N 0 3 350.379 -1.323 20 0 FAADHN CCO[C@@H]1CN(C(=O)c2nc[n-]n2)C[C@H]1C[NH2+][C@H]1CCC(=O)NC1=O ZINC001087092130 790921714 /nfs/dbraw/zinc/92/17/14/790921714.db2.gz XYGMLKJWZAXADI-OUAUKWLOSA-N 0 3 350.379 -1.323 20 0 FAADHN C[C@@H]1CCN(C(=O)CN2CCOCC2=O)[C@H](CN[C@@H]2CCNC2=O)C1 ZINC001087175675 789656574 /nfs/dbraw/zinc/65/65/74/789656574.db2.gz AKAZSRMWFOGALN-HZSPNIEDSA-N 0 3 352.435 -1.050 20 0 FAADHN C[C@@H]1CCN(C(=O)CN2CCOCC2=O)[C@H](CN[C@H]2CCNC2=O)C1 ZINC001087175676 789656539 /nfs/dbraw/zinc/65/65/39/789656539.db2.gz AKAZSRMWFOGALN-RDBSUJKOSA-N 0 3 352.435 -1.050 20 0 FAADHN C[C@@H]1CCN(C(=O)Cn2ncn(C)c2=O)[C@H](CN[C@H]2CCNC2=O)C1 ZINC001087184018 789656678 /nfs/dbraw/zinc/65/66/78/789656678.db2.gz SQCRXSDJGFCQIW-AGIUHOORSA-N 0 3 350.423 -1.313 20 0 FAADHN C[C@@H]1CCN(C(=O)Cn2ncn(C)c2=O)[C@H](CN[C@@H]2CCNC2=O)C1 ZINC001087184019 789656665 /nfs/dbraw/zinc/65/66/65/789656665.db2.gz SQCRXSDJGFCQIW-FRRDWIJNSA-N 0 3 350.423 -1.313 20 0 FAADHN C[C@@H]1CCN(C(=O)[C@@H]2CCNC2=O)[C@H](C[NH2+]Cc2nc(=O)n(C)[n-]2)C1 ZINC001087198422 789657994 /nfs/dbraw/zinc/65/79/94/789657994.db2.gz LJZSNABQOBUZGD-GRYCIOLGSA-N 0 3 350.423 -1.039 20 0 FAADHN C[C@@H]1CCN(C(=O)[C@H]2CCNC2=O)[C@H](C[NH2+]Cc2nc(=O)n(C)[n-]2)C1 ZINC001087198423 789657852 /nfs/dbraw/zinc/65/78/52/789657852.db2.gz LJZSNABQOBUZGD-WOPDTQHZSA-N 0 3 350.423 -1.039 20 0 FAADHN C[C@@H]1CCN(C(=O)CN2CCNC(=O)C2)[C@H](CN[C@@H]2CCNC2=O)C1 ZINC001087198487 789658006 /nfs/dbraw/zinc/65/80/06/789658006.db2.gz NTWXKEIUGGLVGD-HZSPNIEDSA-N 0 3 351.451 -1.477 20 0 FAADHN C[C@@H]1CCN(C(=O)CN2CCNC(=O)C2)[C@H](CN[C@H]2CCNC2=O)C1 ZINC001087198488 789657762 /nfs/dbraw/zinc/65/77/62/789657762.db2.gz NTWXKEIUGGLVGD-RDBSUJKOSA-N 0 3 351.451 -1.477 20 0 FAADHN C[C@@H]1CCN(C(=O)[C@H]2CNC(=O)N2)[C@H](C[NH2+]Cc2nc(=O)n(C)[n-]2)C1 ZINC001087206642 789657418 /nfs/dbraw/zinc/65/74/18/789657418.db2.gz YEVDDFNALGWXGG-OUAUKWLOSA-N 0 3 351.411 -1.494 20 0 FAADHN C[C@@H]1CCN(C(=O)[C@@H]2CNC(=O)N2)[C@H](C[NH2+]Cc2nc(=O)n(C)[n-]2)C1 ZINC001087206643 789657674 /nfs/dbraw/zinc/65/76/74/789657674.db2.gz YEVDDFNALGWXGG-VWYCJHECSA-N 0 3 351.411 -1.494 20 0 FAADHN 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ZINC001087243681 789660654 /nfs/dbraw/zinc/66/06/54/789660654.db2.gz IBVLPQMCCZTSLN-WOPDTQHZSA-N 0 3 351.407 -1.357 20 0 FAADHN CC[C@@H]1[C@@H](NC(=O)CN2CN=NC2=O)CCN1CCN1CCNC1=O ZINC001087549225 790340134 /nfs/dbraw/zinc/34/01/34/790340134.db2.gz MDBVUYHOXAYBAX-NWDGAFQWSA-N 0 3 351.411 -1.022 20 0 FAADHN CC[C@@H]1[C@@H](NC(=O)[C@@H]2CCNC2=O)CCN1CCN1C(=O)CNC1=O ZINC001087686411 790342668 /nfs/dbraw/zinc/34/26/68/790342668.db2.gz BUPPKYZSQWEIHF-GRYCIOLGSA-N 0 3 351.407 -1.357 20 0 FAADHN CC[C@@H]1[C@@H](NC(=O)[C@H]2CCNC2=O)CCN1CCN1C(=O)CNC1=O ZINC001087686412 790341635 /nfs/dbraw/zinc/34/16/35/790341635.db2.gz BUPPKYZSQWEIHF-SDDRHHMPSA-N 0 3 351.407 -1.357 20 0 FAADHN CC[C@@H]1[C@@H](NC(=O)[C@H]2CNC(=O)N2)CCN1CCN1C(=O)CCC1=O ZINC001087708489 790342996 /nfs/dbraw/zinc/34/29/96/790342996.db2.gz FAWXDLHOZUNLJW-QJPTWQEYSA-N 0 3 351.407 -1.214 20 0 FAADHN CC[C@@H]1[C@@H](NC(=O)[C@@H]2CNC(=O)N2)CCN1CCN1C(=O)CCC1=O ZINC001087708490 790341562 /nfs/dbraw/zinc/34/15/62/790341562.db2.gz 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ZINC001088019253 790349781 /nfs/dbraw/zinc/34/97/81/790349781.db2.gz CKUPPSFXAPAXGR-FRRDWIJNSA-N 0 3 350.423 -1.374 20 0 FAADHN CC[C@H](C(N)=O)N1CC[C@@H]2CN(C(=O)CN3CCNC(=O)C3)C[C@@H]2C1 ZINC001088064927 790352123 /nfs/dbraw/zinc/35/21/23/790352123.db2.gz BNIUHIPGMCBRTG-HZSPNIEDSA-N 0 3 351.451 -1.538 20 0 FAADHN CC[C@@H](C(N)=O)N1CC[C@@H]2CN(C(=O)CN3CCNC(=O)C3)C[C@@H]2C1 ZINC001088064928 790351556 /nfs/dbraw/zinc/35/15/56/790351556.db2.gz BNIUHIPGMCBRTG-RDBSUJKOSA-N 0 3 351.451 -1.538 20 0 FAADHN O=C([C@@H]1CNC(=O)N1)N1C[C@H]2CCN(CCN3CCNC3=O)C[C@H]2C1 ZINC001088087432 790358953 /nfs/dbraw/zinc/35/89/53/790358953.db2.gz WPCPGJVRSXDOQI-AGIUHOORSA-N 0 3 350.423 -1.527 20 0 FAADHN O=C([C@H]1CNC(=O)N1)N1C[C@H]2CCN(CCN3CCNC3=O)C[C@H]2C1 ZINC001088087433 790359021 /nfs/dbraw/zinc/35/90/21/790359021.db2.gz WPCPGJVRSXDOQI-FRRDWIJNSA-N 0 3 350.423 -1.527 20 0 FAADHN CC1(C)NC(=O)N(CCN2CC[C@@H]3CN(C(=O)C(N)=O)C[C@@H]3C2)C1=O ZINC001088089095 790358325 /nfs/dbraw/zinc/35/83/25/790358325.db2.gz 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CC(=O)N1CC(C(=O)NC[C@@H]2CN([C@H]3CCC(=O)NC3=O)C[C@H]2C)C1 ZINC001092571618 790930022 /nfs/dbraw/zinc/93/00/22/790930022.db2.gz IUTJFQDXEAUUHJ-QKCSRTOESA-N 0 3 350.419 -1.046 20 0 FAADHN C[C@@H]1CN(CC(=O)N2CCOCC2)C[C@H]1CNC(=O)[C@H]1COC(=O)N1 ZINC001092580864 790929723 /nfs/dbraw/zinc/92/97/23/790929723.db2.gz RFIFJUVXOAEFPX-JHJVBQTASA-N 0 3 354.407 -1.362 20 0 FAADHN C[C@@H]1CN(CC(=O)N2CCOCC2)C[C@H]1CNC(=O)[C@@H]1COC(=O)N1 ZINC001092580866 790930407 /nfs/dbraw/zinc/93/04/07/790930407.db2.gz RFIFJUVXOAEFPX-UPJWGTAASA-N 0 3 354.407 -1.362 20 0 FAADHN C[C@@H]1CN(CC(=O)N2CCOCC2)C[C@H]1CNC(=O)[C@H]1CCNC1=O ZINC001092884292 790932927 /nfs/dbraw/zinc/93/29/27/790932927.db2.gz WMDBJZRICLXSIM-MCIONIFRSA-N 0 3 352.435 -1.335 20 0 FAADHN C[C@@H]1CN(CC(=O)N2CCOCC2)C[C@H]1CNC(=O)[C@@H]1CCNC1=O ZINC001092884293 790933134 /nfs/dbraw/zinc/93/31/34/790933134.db2.gz WMDBJZRICLXSIM-MGPQQGTHSA-N 0 3 352.435 -1.335 20 0 FAADHN C[C@@H]1CN(CCN2C(=O)CNC2=O)C[C@H]1CNC(=O)c1nnn(C)n1 ZINC001092893368 790933714 /nfs/dbraw/zinc/93/37/14/790933714.db2.gz QGYRJLKHOAZTGC-NXEZZACHSA-N 0 3 350.383 -1.940 20 0 FAADHN C[C@@H]1CN(CCN2CCCS2(=O)=O)C[C@H]1CNC(=O)c1nnn(C)n1 ZINC001092893403 790933959 /nfs/dbraw/zinc/93/39/59/790933959.db2.gz RCJCCEZMCPIQSN-VXGBXAGGSA-N 0 3 371.467 -1.457 20 0 FAADHN C[C@@H]1CN(CC(=O)N2CCOCC2)C[C@H]1CNC(=O)[C@H]1CNC(=O)N1 ZINC001092928592 790934766 /nfs/dbraw/zinc/93/47/66/790934766.db2.gz PGMSINYSOHPUQX-JHJVBQTASA-N 0 3 353.423 -1.789 20 0 FAADHN C[C@@H]1CN(CC(=O)N2CCOCC2)C[C@H]1CNC(=O)[C@@H]1CNC(=O)N1 ZINC001092928593 790934267 /nfs/dbraw/zinc/93/42/67/790934267.db2.gz PGMSINYSOHPUQX-UPJWGTAASA-N 0 3 353.423 -1.789 20 0 FAADHN C[C@@H]1CN(CC(=O)N2CCC2)C[C@H]1CNC(=O)[C@H]1CC[C@@H](C(N)=O)O1 ZINC001092964210 790933930 /nfs/dbraw/zinc/93/39/30/790933930.db2.gz DIYQGANTQLGKLW-YIYPIFLZSA-N 0 3 352.435 -1.064 20 0 FAADHN C[C@@H]1CN(CCN2CCCS2(=O)=O)C[C@H]1CNC(=O)[C@H]1C[C@H]1C(N)=O ZINC001092970662 790936037 /nfs/dbraw/zinc/93/60/37/790936037.db2.gz BBSBISANDWYPEL-SYQHCUMBSA-N 0 3 372.491 -1.173 20 0 FAADHN C[C@@H]1CN(CC(=O)N2CCOCC2)C[C@H]1CNC(=O)[C@H]1C[C@H]1C(N)=O ZINC001092971082 790935816 /nfs/dbraw/zinc/93/58/16/790935816.db2.gz UPBVERDCXAOXMH-SYQHCUMBSA-N 0 3 352.435 -1.349 20 0 FAADHN C[C@@H]1CN(CC(=O)N2CCC2)C[C@H]1CNC(=O)[C@@H]1CC(=O)NC(=O)N1 ZINC001093011971 790935195 /nfs/dbraw/zinc/93/51/95/790935195.db2.gz VLNAPFVPXULYIL-UTUOFQBUSA-N 0 3 351.407 -1.499 20 0 FAADHN C[C@H](C(N)=O)N1C[C@@H](CNC(=O)c2cn(C)c(=O)n(C)c2=O)[C@H](C)C1 ZINC001093017269 790935242 /nfs/dbraw/zinc/93/52/42/790935242.db2.gz XDUOMSGYLYFERF-GMTAPVOTSA-N 0 3 351.407 -1.745 20 0 FAADHN C[C@@H](C(N)=O)N1C[C@@H](CNC(=O)c2cn(C)c(=O)n(C)c2=O)[C@H](C)C1 ZINC001093017271 790936153 /nfs/dbraw/zinc/93/61/53/790936153.db2.gz XDUOMSGYLYFERF-OUAUKWLOSA-N 0 3 351.407 -1.745 20 0 FAADHN C[C@@H]1CN(CC(=O)N(C)C)C[C@H]1CNC(=O)[C@H]1CCN(C)S1(=O)=O ZINC001093046109 790935219 /nfs/dbraw/zinc/93/52/19/790935219.db2.gz WDUORELGIOFJAE-JHJVBQTASA-N 0 3 360.480 -1.207 20 0 FAADHN C[C@@H]1CN(CC(=O)N(C)C)C[C@H]1CNC(=O)[C@@H]1CCN(C)S1(=O)=O ZINC001093046110 790936103 /nfs/dbraw/zinc/93/61/03/790936103.db2.gz WDUORELGIOFJAE-UPJWGTAASA-N 0 3 360.480 -1.207 20 0 FAADHN C[C@@H]1CN([C@@H]2CCN(C)C2=O)C[C@H]1CNC(=O)C1CC(=O)NC(=O)C1 ZINC001093048345 790935520 /nfs/dbraw/zinc/93/55/20/790935520.db2.gz BQTQEDHJQKHGJN-RAIGVLPGSA-N 0 3 350.419 -1.046 20 0 FAADHN C[C@@H]1CN([C@H]2CCN(C)C2=O)C[C@H]1CNC(=O)C1CC(=O)NC(=O)C1 ZINC001093048347 790935267 /nfs/dbraw/zinc/93/52/67/790935267.db2.gz BQTQEDHJQKHGJN-RTXFEEFZSA-N 0 3 350.419 -1.046 20 0 FAADHN C[C@@H]1CN(CC(=O)N2CCC2)C[C@H]1CNC(=O)C1CC(=O)NC(=O)C1 ZINC001093053536 790936131 /nfs/dbraw/zinc/93/61/31/790936131.db2.gz YPCISLOWJPFGIF-DGCLKSJQSA-N 0 3 350.419 -1.044 20 0 FAADHN C[C@@H]1CN(CC(=O)N2CCOCC2)C[C@H]1CNC(=O)[C@@H]1CCC(=O)N1 ZINC001093143486 790937105 /nfs/dbraw/zinc/93/71/05/790937105.db2.gz KAJHGQINBAACPT-MCIONIFRSA-N 0 3 352.435 -1.192 20 0 FAADHN C[C@@H]1CN(CC(=O)N(C)C)C[C@H]1CNC(=O)c1cn(C)c(=O)[nH]c1=O ZINC001093191331 790937765 /nfs/dbraw/zinc/93/77/65/790937765.db2.gz MZOPFZRZYRDEBW-GHMZBOCLSA-N 0 3 351.407 -1.128 20 0 FAADHN CNC(=O)[C@@H](C)N1C[C@@H](CNC(=O)c2cn(C)c(=O)[nH]c2=O)[C@H](C)C1 ZINC001093191972 790936827 /nfs/dbraw/zinc/93/68/27/790936827.db2.gz WFOGUMFQOBXYCI-GMTAPVOTSA-N 0 3 351.407 -1.082 20 0 FAADHN CNC(=O)[C@H](C)N1C[C@@H](CNC(=O)c2cn(C)c(=O)[nH]c2=O)[C@H](C)C1 ZINC001093191973 790936986 /nfs/dbraw/zinc/93/69/86/790936986.db2.gz WFOGUMFQOBXYCI-OUAUKWLOSA-N 0 3 351.407 -1.082 20 0 FAADHN C[C@@H]1CN(CC(=O)N2CCC2)C[C@H]1CNC(=O)[C@H]1CCS(=O)(=O)N1 ZINC001093203184 790936953 /nfs/dbraw/zinc/93/69/53/790936953.db2.gz JZSXNERGIXAWPT-JHJVBQTASA-N 0 3 358.464 -1.406 20 0 FAADHN C[C@@H]1CN(CC(=O)N2CCC2)C[C@H]1CNC(=O)[C@@H]1CCS(=O)(=O)N1 ZINC001093203185 790936853 /nfs/dbraw/zinc/93/68/53/790936853.db2.gz JZSXNERGIXAWPT-UPJWGTAASA-N 0 3 358.464 -1.406 20 0 FAADHN CNC(=O)[C@@H](C)N1C[C@@H](CNC(=O)c2cn(CC(N)=O)nn2)[C@H](C)C1 ZINC001093223813 790937476 /nfs/dbraw/zinc/93/74/76/790937476.db2.gz HSNLSADRLVTCMV-GMTAPVOTSA-N 0 3 351.411 -1.804 20 0 FAADHN CNC(=O)[C@H](C)N1C[C@@H](CNC(=O)c2cn(CC(N)=O)nn2)[C@H](C)C1 ZINC001093223817 790937449 /nfs/dbraw/zinc/93/74/49/790937449.db2.gz HSNLSADRLVTCMV-OUAUKWLOSA-N 0 3 351.411 -1.804 20 0 FAADHN C[C@@H]1CN(CC(=O)N(C)C)C[C@H]1CNC(=O)c1cn(CC(N)=O)nn1 ZINC001093223897 790937161 /nfs/dbraw/zinc/93/71/61/790937161.db2.gz JBFLZFQVVQDWRL-GHMZBOCLSA-N 0 3 351.411 -1.851 20 0 FAADHN CC[C@H](C(N)=O)N1C[C@@H](CNC(=O)c2cn(CC(N)=O)nn2)[C@H](C)C1 ZINC001093224311 790938256 /nfs/dbraw/zinc/93/82/56/790938256.db2.gz PVUWTIXOVOYYLD-CKYFFXLPSA-N 0 3 351.411 -1.675 20 0 FAADHN CC[C@@H](C(N)=O)N1C[C@@H](CNC(=O)c2cn(CC(N)=O)nn2)[C@H](C)C1 ZINC001093224312 790938887 /nfs/dbraw/zinc/93/88/87/790938887.db2.gz PVUWTIXOVOYYLD-FOGDFJRCSA-N 0 3 351.411 -1.675 20 0 FAADHN CC(C)[C@@H]1N(C(=O)Cn2cnnn2)C[C@]12C[C@@H](O)[C@H](NCC(N)=O)C2 ZINC001093432322 790938210 /nfs/dbraw/zinc/93/82/10/790938210.db2.gz CQZFAQNPFSBNDL-FIXIBIHLSA-N 0 3 351.411 -1.876 20 0 FAADHN CC(C)[C@H]1N(C(=O)Cn2cnnn2)C[C@]12C[C@@H](O)[C@H](NCC(N)=O)C2 ZINC001093432323 790938198 /nfs/dbraw/zinc/93/81/98/790938198.db2.gz CQZFAQNPFSBNDL-FKGLVLAHSA-N 0 3 351.411 -1.876 20 0 FAADHN CC(C)[C@@H]1N(C(=O)Cn2cnnn2)C[C@@]12C[C@@H](O)[C@H](NCC(N)=O)C2 ZINC001093432324 790938325 /nfs/dbraw/zinc/93/83/25/790938325.db2.gz CQZFAQNPFSBNDL-HKCMKHECSA-N 0 3 351.411 -1.876 20 0 FAADHN CC(C)[C@H]1N(C(=O)Cn2cnnn2)C[C@@]12C[C@@H](O)[C@H](NCC(N)=O)C2 ZINC001093432325 790938684 /nfs/dbraw/zinc/93/86/84/790938684.db2.gz CQZFAQNPFSBNDL-YIKOMLBNSA-N 0 3 351.411 -1.876 20 0 FAADHN CC(C)[C@@H]1N(C(=O)CS(C)(=O)=O)C[C@]12C[C@@H](O)[C@H](NCC(N)=O)C2 ZINC001093436624 790938233 /nfs/dbraw/zinc/93/82/33/790938233.db2.gz JEWYKJYOZCVTDV-FIXIBIHLSA-N 0 3 361.464 -1.518 20 0 FAADHN CC(C)[C@H]1N(C(=O)CS(C)(=O)=O)C[C@]12C[C@@H](O)[C@H](NCC(N)=O)C2 ZINC001093436625 790938550 /nfs/dbraw/zinc/93/85/50/790938550.db2.gz JEWYKJYOZCVTDV-FKGLVLAHSA-N 0 3 361.464 -1.518 20 0 FAADHN CC(C)[C@@H]1N(C(=O)CS(C)(=O)=O)C[C@@]12C[C@@H](O)[C@H](NCC(N)=O)C2 ZINC001093436626 790938591 /nfs/dbraw/zinc/93/85/91/790938591.db2.gz JEWYKJYOZCVTDV-HKCMKHECSA-N 0 3 361.464 -1.518 20 0 FAADHN CC(C)[C@H]1N(C(=O)CS(C)(=O)=O)C[C@@]12C[C@@H](O)[C@H](NCC(N)=O)C2 ZINC001093436627 790938281 /nfs/dbraw/zinc/93/82/81/790938281.db2.gz JEWYKJYOZCVTDV-YIKOMLBNSA-N 0 3 361.464 -1.518 20 0 FAADHN CC(C)[C@@H]1N(C(=O)c2ncn(C)n2)C[C@]12C[C@@H](O)[C@H](NCC(N)=O)C2 ZINC001093443520 790938513 /nfs/dbraw/zinc/93/85/13/790938513.db2.gz RJWANFFAWQIGJI-BQNAKDMGSA-N 0 3 350.423 -1.120 20 0 FAADHN CC(C)[C@H]1N(C(=O)c2ncn(C)n2)C[C@]12C[C@@H](O)[C@H](NCC(N)=O)C2 ZINC001093443521 790938844 /nfs/dbraw/zinc/93/88/44/790938844.db2.gz RJWANFFAWQIGJI-MSIPSHCFSA-N 0 3 350.423 -1.120 20 0 FAADHN CC(C)[C@H]1N(C(=O)c2ncn(C)n2)C[C@@]12C[C@@H](O)[C@H](NCC(N)=O)C2 ZINC001093443522 790938610 /nfs/dbraw/zinc/93/86/10/790938610.db2.gz RJWANFFAWQIGJI-QQHRNGFRSA-N 0 3 350.423 -1.120 20 0 FAADHN CC(C)[C@@H]1N(C(=O)c2ncn(C)n2)C[C@@]12C[C@@H](O)[C@H](NCC(N)=O)C2 ZINC001093443523 790938665 /nfs/dbraw/zinc/93/86/65/790938665.db2.gz RJWANFFAWQIGJI-RLSLPTNOSA-N 0 3 350.423 -1.120 20 0 FAADHN CC(C)[C@@H]1N(C(=O)Cn2ncnn2)C[C@]12C[C@@H](O)[C@H](NCC(N)=O)C2 ZINC001093446050 790938573 /nfs/dbraw/zinc/93/85/73/790938573.db2.gz FHZZOJWRRFPKMW-FIXIBIHLSA-N 0 3 351.411 -1.876 20 0 FAADHN CC(C)[C@H]1N(C(=O)Cn2ncnn2)C[C@]12C[C@@H](O)[C@H](NCC(N)=O)C2 ZINC001093446051 790938717 /nfs/dbraw/zinc/93/87/17/790938717.db2.gz FHZZOJWRRFPKMW-FKGLVLAHSA-N 0 3 351.411 -1.876 20 0 FAADHN CC(C)[C@@H]1N(C(=O)Cn2ncnn2)C[C@@]12C[C@@H](O)[C@H](NCC(N)=O)C2 ZINC001093446054 790938531 /nfs/dbraw/zinc/93/85/31/790938531.db2.gz FHZZOJWRRFPKMW-HKCMKHECSA-N 0 3 351.411 -1.876 20 0 FAADHN CC(C)[C@H]1N(C(=O)Cn2ncnn2)C[C@@]12C[C@@H](O)[C@H](NCC(N)=O)C2 ZINC001093446056 790938421 /nfs/dbraw/zinc/93/84/21/790938421.db2.gz FHZZOJWRRFPKMW-YIKOMLBNSA-N 0 3 351.411 -1.876 20 0 FAADHN CC(C)[C@H]1N(C(=O)c2cn(C)nn2)C[C@]12C[C@@H](O)[C@H](NCC(N)=O)C2 ZINC001093446372 790938830 /nfs/dbraw/zinc/93/88/30/790938830.db2.gz HNEAXWUDACIRIZ-AEKOTVAKSA-N 0 3 350.423 -1.120 20 0 FAADHN CC(C)[C@@H]1N(C(=O)c2cn(C)nn2)C[C@]12C[C@@H](O)[C@H](NCC(N)=O)C2 ZINC001093446373 790938627 /nfs/dbraw/zinc/93/86/27/790938627.db2.gz HNEAXWUDACIRIZ-ILHHOCCXSA-N 0 3 350.423 -1.120 20 0 FAADHN CC(C)[C@H]1N(C(=O)c2cn(C)nn2)C[C@@]12C[C@@H](O)[C@H](NCC(N)=O)C2 ZINC001093446374 790938643 /nfs/dbraw/zinc/93/86/43/790938643.db2.gz HNEAXWUDACIRIZ-MWKWWEEBSA-N 0 3 350.423 -1.120 20 0 FAADHN CC(C)[C@@H]1N(C(=O)c2cn(C)nn2)C[C@@]12C[C@@H](O)[C@H](NCC(N)=O)C2 ZINC001093446375 790939766 /nfs/dbraw/zinc/93/97/66/790939766.db2.gz HNEAXWUDACIRIZ-UUFMSHNVSA-N 0 3 350.423 -1.120 20 0 FAADHN CC(C)[C@H]1N(C(=O)c2cnnn2C)C[C@]12C[C@@H](O)[C@H](NCC(N)=O)C2 ZINC001093446541 790939782 /nfs/dbraw/zinc/93/97/82/790939782.db2.gz IWPPODLODFCNOQ-AEKOTVAKSA-N 0 3 350.423 -1.120 20 0 FAADHN CC(C)[C@@H]1N(C(=O)c2cnnn2C)C[C@]12C[C@@H](O)[C@H](NCC(N)=O)C2 ZINC001093446542 790939386 /nfs/dbraw/zinc/93/93/86/790939386.db2.gz IWPPODLODFCNOQ-ILHHOCCXSA-N 0 3 350.423 -1.120 20 0 FAADHN CC(C)[C@H]1N(C(=O)c2cnnn2C)C[C@@]12C[C@@H](O)[C@H](NCC(N)=O)C2 ZINC001093446543 790939451 /nfs/dbraw/zinc/93/94/51/790939451.db2.gz IWPPODLODFCNOQ-MWKWWEEBSA-N 0 3 350.423 -1.120 20 0 FAADHN CC(C)[C@@H]1N(C(=O)c2cnnn2C)C[C@@]12C[C@@H](O)[C@H](NCC(N)=O)C2 ZINC001093446544 790939732 /nfs/dbraw/zinc/93/97/32/790939732.db2.gz IWPPODLODFCNOQ-UUFMSHNVSA-N 0 3 350.423 -1.120 20 0 FAADHN CC(C)[C@@H]1N(C(=O)Cn2nccn2)C[C@@]12C[C@@H](O)[C@H](NCC(N)=O)C2 ZINC001093449184 790939249 /nfs/dbraw/zinc/93/92/49/790939249.db2.gz NKZZZNCALMWPAP-AVRGHOLYSA-N 0 3 350.423 -1.271 20 0 FAADHN CC(C)[C@H]1N(C(=O)Cn2nccn2)C[C@]12C[C@@H](O)[C@H](NCC(N)=O)C2 ZINC001093449192 790939620 /nfs/dbraw/zinc/93/96/20/790939620.db2.gz NKZZZNCALMWPAP-BHTHQVBYSA-N 0 3 350.423 -1.271 20 0 FAADHN CC(C)[C@H]1N(C(=O)Cn2nccn2)C[C@@]12C[C@@H](O)[C@H](NCC(N)=O)C2 ZINC001093449193 790939525 /nfs/dbraw/zinc/93/95/25/790939525.db2.gz NKZZZNCALMWPAP-CZPYZCIJSA-N 0 3 350.423 -1.271 20 0 FAADHN CC(C)[C@@H]1N(C(=O)Cn2nccn2)C[C@]12C[C@@H](O)[C@H](NCC(N)=O)C2 ZINC001093449194 790939659 /nfs/dbraw/zinc/93/96/59/790939659.db2.gz NKZZZNCALMWPAP-MPTQWLOMSA-N 0 3 350.423 -1.271 20 0 FAADHN CC(C)[C@H]1N(C(=O)C(C)(C)C(N)=O)C[C@]12C[C@@H](O)[C@H](NCC(N)=O)C2 ZINC001093451603 790939834 /nfs/dbraw/zinc/93/98/34/790939834.db2.gz VYWUNMIYHKEKOJ-BIMLSOSBSA-N 0 3 354.451 -1.051 20 0 FAADHN CC(C)[C@@H]1N(C(=O)C(C)(C)C(N)=O)C[C@@]12C[C@@H](O)[C@H](NCC(N)=O)C2 ZINC001093451604 790939859 /nfs/dbraw/zinc/93/98/59/790939859.db2.gz VYWUNMIYHKEKOJ-GRRKEVBASA-N 0 3 354.451 -1.051 20 0 FAADHN CC(C)[C@@H]1N(C(=O)C(C)(C)C(N)=O)C[C@]12C[C@@H](O)[C@H](NCC(N)=O)C2 ZINC001093451605 790939604 /nfs/dbraw/zinc/93/96/04/790939604.db2.gz VYWUNMIYHKEKOJ-NRVFGDBUSA-N 0 3 354.451 -1.051 20 0 FAADHN CC(C)[C@H]1N(C(=O)C(C)(C)C(N)=O)C[C@@]12C[C@@H](O)[C@H](NCC(N)=O)C2 ZINC001093451606 790939549 /nfs/dbraw/zinc/93/95/49/790939549.db2.gz VYWUNMIYHKEKOJ-YAMOITTJSA-N 0 3 354.451 -1.051 20 0 FAADHN CC(C)[C@@H]1N(C(=O)c2nnn(C)n2)C[C@@]12C[C@@H](O)[C@H](NCC(N)=O)C2 ZINC001093454670 790940552 /nfs/dbraw/zinc/94/05/52/790940552.db2.gz GNVYPHSJLUYXMH-DSKWVYQCSA-N 0 3 351.411 -1.725 20 0 FAADHN CC(C)[C@@H]1N(C(=O)c2nnn(C)n2)C[C@]12C[C@@H](O)[C@H](NCC(N)=O)C2 ZINC001093454671 790940868 /nfs/dbraw/zinc/94/08/68/790940868.db2.gz GNVYPHSJLUYXMH-FCIGDQIPSA-N 0 3 351.411 -1.725 20 0 FAADHN CC(C)[C@H]1N(C(=O)c2nnn(C)n2)C[C@@]12C[C@@H](O)[C@H](NCC(N)=O)C2 ZINC001093454672 790940899 /nfs/dbraw/zinc/94/08/99/790940899.db2.gz GNVYPHSJLUYXMH-NDLNZWKESA-N 0 3 351.411 -1.725 20 0 FAADHN CC(C)[C@H]1N(C(=O)c2nnn(C)n2)C[C@]12C[C@@H](O)[C@H](NCC(N)=O)C2 ZINC001093454673 790941232 /nfs/dbraw/zinc/94/12/32/790941232.db2.gz GNVYPHSJLUYXMH-NOBRSGAKSA-N 0 3 351.411 -1.725 20 0 FAADHN CC(C)[C@H]1N(C(=O)C(N)=O)C[C@@]12C[C@@H](O)[C@H](NCc1cnnn1C)C2 ZINC001093461823 790939580 /nfs/dbraw/zinc/93/95/80/790939580.db2.gz LKZOXGXDMUQBRZ-BRXULGCHSA-N 0 3 350.423 -1.234 20 0 FAADHN CC(C)[C@@H]1N(C(=O)C(N)=O)C[C@]12C[C@@H](O)[C@H](NCc1cnnn1C)C2 ZINC001093461826 790939741 /nfs/dbraw/zinc/93/97/41/790939741.db2.gz LKZOXGXDMUQBRZ-FOCJUVANSA-N 0 3 350.423 -1.234 20 0 FAADHN CC(C)[C@H]1N(C(=O)C(N)=O)C[C@]12C[C@@H](O)[C@H](NCc1cnnn1C)C2 ZINC001093461828 790939510 /nfs/dbraw/zinc/93/95/10/790939510.db2.gz LKZOXGXDMUQBRZ-JXFSHQFZSA-N 0 3 350.423 -1.234 20 0 FAADHN CC(C)[C@@H]1N(C(=O)C(N)=O)C[C@@]12C[C@@H](O)[C@H](NCc1cnnn1C)C2 ZINC001093461829 790939302 /nfs/dbraw/zinc/93/93/02/790939302.db2.gz LKZOXGXDMUQBRZ-NFFDBFGFSA-N 0 3 350.423 -1.234 20 0 FAADHN CC(C)[C@@H]1N(C(=O)C(N)=O)C[C@@]12C[C@@H](O)[C@H](NCC(=O)N1CCC1)C2 ZINC001093461906 790939824 /nfs/dbraw/zinc/93/98/24/790939824.db2.gz METRIEPBGQAHPV-ALYFQZSWSA-N 0 3 352.435 -1.330 20 0 FAADHN CC(C)[C@H]1N(C(=O)C(N)=O)C[C@@]12C[C@@H](O)[C@H](NCC(=O)N1CCC1)C2 ZINC001093461912 790939902 /nfs/dbraw/zinc/93/99/02/790939902.db2.gz METRIEPBGQAHPV-CTWCOEIASA-N 0 3 352.435 -1.330 20 0 FAADHN CC(C)[C@H]1N(C(=O)C(N)=O)C[C@]12C[C@@H](O)[C@H](NCC(=O)N1CCC1)C2 ZINC001093461915 790939721 /nfs/dbraw/zinc/93/97/21/790939721.db2.gz METRIEPBGQAHPV-LGIULTMTSA-N 0 3 352.435 -1.330 20 0 FAADHN CC(C)[C@@H]1N(C(=O)C(N)=O)C[C@]12C[C@@H](O)[C@H](NCC(=O)N1CCC1)C2 ZINC001093461917 790939713 /nfs/dbraw/zinc/93/97/13/790939713.db2.gz METRIEPBGQAHPV-WOKLECCJSA-N 0 3 352.435 -1.330 20 0 FAADHN CC(C)[C@@H]1N(C(=O)C2(C(N)=O)CC2)C[C@]12C[C@@H](O)[C@H](NCC(N)=O)C2 ZINC001093462951 790939431 /nfs/dbraw/zinc/93/94/31/790939431.db2.gz RSXNELURFMHNKG-BQNAKDMGSA-N 0 3 352.435 -1.297 20 0 FAADHN CC(C)[C@H]1N(C(=O)C2(C(N)=O)CC2)C[C@]12C[C@@H](O)[C@H](NCC(N)=O)C2 ZINC001093462968 790940763 /nfs/dbraw/zinc/94/07/63/790940763.db2.gz RSXNELURFMHNKG-MSIPSHCFSA-N 0 3 352.435 -1.297 20 0 FAADHN CC(C)[C@H]1N(C(=O)C2(C(N)=O)CC2)C[C@@]12C[C@@H](O)[C@H](NCC(N)=O)C2 ZINC001093462970 790940850 /nfs/dbraw/zinc/94/08/50/790940850.db2.gz RSXNELURFMHNKG-QQHRNGFRSA-N 0 3 352.435 -1.297 20 0 FAADHN CC(C)[C@@H]1N(C(=O)C2(C(N)=O)CC2)C[C@@]12C[C@@H](O)[C@H](NCC(N)=O)C2 ZINC001093462971 790940914 /nfs/dbraw/zinc/94/09/14/790940914.db2.gz RSXNELURFMHNKG-RLSLPTNOSA-N 0 3 352.435 -1.297 20 0 FAADHN CC(C)[C@H]1N(C(=O)c2cnn(C)n2)C[C@]12C[C@@H](O)[C@H](NCC(N)=O)C2 ZINC001093470478 790940781 /nfs/dbraw/zinc/94/07/81/790940781.db2.gz VCBZNFJZIZLDMU-AEKOTVAKSA-N 0 3 350.423 -1.120 20 0 FAADHN CC(C)[C@@H]1N(C(=O)c2cnn(C)n2)C[C@]12C[C@@H](O)[C@H](NCC(N)=O)C2 ZINC001093470479 790940368 /nfs/dbraw/zinc/94/03/68/790940368.db2.gz VCBZNFJZIZLDMU-ILHHOCCXSA-N 0 3 350.423 -1.120 20 0 FAADHN CC(C)[C@H]1N(C(=O)c2cnn(C)n2)C[C@@]12C[C@@H](O)[C@H](NCC(N)=O)C2 ZINC001093470480 790941182 /nfs/dbraw/zinc/94/11/82/790941182.db2.gz VCBZNFJZIZLDMU-MWKWWEEBSA-N 0 3 350.423 -1.120 20 0 FAADHN CC(C)[C@@H]1N(C(=O)c2cnn(C)n2)C[C@@]12C[C@@H](O)[C@H](NCC(N)=O)C2 ZINC001093470481 790940346 /nfs/dbraw/zinc/94/03/46/790940346.db2.gz VCBZNFJZIZLDMU-UUFMSHNVSA-N 0 3 350.423 -1.120 20 0 FAADHN CC(C)[C@@H]1N(C(=O)Cn2cncn2)C[C@@]12C[C@@H](O)[C@H](NCC(N)=O)C2 ZINC001093478998 790941079 /nfs/dbraw/zinc/94/10/79/790941079.db2.gz SUYMSZRWZNZDER-AVRGHOLYSA-N 0 3 350.423 -1.271 20 0 FAADHN CC(C)[C@H]1N(C(=O)Cn2cncn2)C[C@]12C[C@@H](O)[C@H](NCC(N)=O)C2 ZINC001093479000 790941043 /nfs/dbraw/zinc/94/10/43/790941043.db2.gz SUYMSZRWZNZDER-BHTHQVBYSA-N 0 3 350.423 -1.271 20 0 FAADHN CC(C)[C@H]1N(C(=O)Cn2cncn2)C[C@@]12C[C@@H](O)[C@H](NCC(N)=O)C2 ZINC001093479001 790940801 /nfs/dbraw/zinc/94/08/01/790940801.db2.gz SUYMSZRWZNZDER-CZPYZCIJSA-N 0 3 350.423 -1.271 20 0 FAADHN CC(C)[C@@H]1N(C(=O)Cn2cncn2)C[C@]12C[C@@H](O)[C@H](NCC(N)=O)C2 ZINC001093479003 790940508 /nfs/dbraw/zinc/94/05/08/790940508.db2.gz SUYMSZRWZNZDER-MPTQWLOMSA-N 0 3 350.423 -1.271 20 0 FAADHN C[C@@H]1CN(C(=O)CN2CCOCC2=O)C[C@H]1CNCc1cn(C)nn1 ZINC001093827714 790941912 /nfs/dbraw/zinc/94/19/12/790941912.db2.gz XFQFVXHUNHMQMD-CHWSQXEVSA-N 0 3 350.423 -1.142 20 0 FAADHN C[C@@H]1CN(C(=O)C(N)=O)C[C@H]1CNCc1cn(C[C@@H]2CCOC2)nn1 ZINC001094007697 790943298 /nfs/dbraw/zinc/94/32/98/790943298.db2.gz CAQSZLQTTLYMTL-FRRDWIJNSA-N 0 3 350.423 -1.016 20 0 FAADHN C[C@@H]1CN(C(=O)C(N)=O)C[C@H]1CNCc1cn(C[C@H]2CCOC2)nn1 ZINC001094007698 790943254 /nfs/dbraw/zinc/94/32/54/790943254.db2.gz CAQSZLQTTLYMTL-JHJVBQTASA-N 0 3 350.423 -1.016 20 0 FAADHN C[C@@H]1CN(C(=O)c2c[n-]nc2S(N)(=O)=O)C[C@H]1C[NH2+][C@@H]1CCNC1=O ZINC001094029888 790944843 /nfs/dbraw/zinc/94/48/43/790944843.db2.gz XHEBLSOLYMTYCN-FXPVBKGRSA-N 0 3 370.435 -1.757 20 0 FAADHN C[C@@H]1CN(C(=O)c2c[n-]nc2S(N)(=O)=O)C[C@H]1C[NH2+][C@H]1CCNC1=O ZINC001094029889 790944375 /nfs/dbraw/zinc/94/43/75/790944375.db2.gz XHEBLSOLYMTYCN-KKZNHRDASA-N 0 3 370.435 -1.757 20 0 FAADHN Cc1nnc(CNC[C@@H]2CN(C(=O)[C@@H]3CCS(=O)(=O)N3)C[C@H]2C)[nH]1 ZINC001094227665 790945996 /nfs/dbraw/zinc/94/59/96/790945996.db2.gz QESRHZCHAYELEF-JLLWLGSASA-N 0 3 356.452 -1.011 20 0 FAADHN Cc1nnc(CNC[C@@H]2CN(C(=O)[C@H]3CCS(=O)(=O)N3)C[C@H]2C)[nH]1 ZINC001094227666 790945499 /nfs/dbraw/zinc/94/54/99/790945499.db2.gz QESRHZCHAYELEF-YUSALJHKSA-N 0 3 356.452 -1.011 20 0 FAADHN C[C@@H]1CN(C(=O)[C@H]2CCS(=O)(=O)N2)C[C@H]1CNCc1cn(C)nn1 ZINC001094227679 790945631 /nfs/dbraw/zinc/94/56/31/790945631.db2.gz QWUHBJSLTBVIGP-NQBHXWOUSA-N 0 3 356.452 -1.309 20 0 FAADHN C[C@@H]1CN(C(=O)[C@@H]2CCS(=O)(=O)N2)C[C@H]1CNCc1cn(C)nn1 ZINC001094227680 790946174 /nfs/dbraw/zinc/94/61/74/790946174.db2.gz QWUHBJSLTBVIGP-WZRBSPASSA-N 0 3 356.452 -1.309 20 0 FAADHN CC[C@@H]1[C@@H](C(=O)N2CCN(CC(N)=O)[C@H]3CS(=O)(=O)C[C@H]32)CCN1C ZINC001094634217 790955552 /nfs/dbraw/zinc/95/55/52/790955552.db2.gz QVOZIHVKCUQQCL-RFQIPJPRSA-N 0 3 372.491 -1.488 20 0 FAADHN CNC(=O)CN(CCO)C1CCN(C(=O)[C@H]2CN(C)C[C@@H](C)O2)CC1 ZINC001098404203 790664256 /nfs/dbraw/zinc/66/42/56/790664256.db2.gz HUZZIHCSGSNDAG-UKRRQHHQSA-N 0 3 356.467 -1.263 20 0 FAADHN O=C(N[C@]12CCC[C@H]1CN(CCN1CCNC1=O)C2)[C@@H]1CNC(=O)N1 ZINC001099006893 792586851 /nfs/dbraw/zinc/58/68/51/792586851.db2.gz QHUUKLYZRMFQLG-MKBNYLNASA-N 0 3 350.423 -1.336 20 0 FAADHN O=C(N[C@]12CCC[C@H]1CN(CCN1CCNC1=O)C2)[C@H]1CNC(=O)N1 ZINC001099006894 792587011 /nfs/dbraw/zinc/58/70/11/792587011.db2.gz QHUUKLYZRMFQLG-OZVIIMIRSA-N 0 3 350.423 -1.336 20 0 FAADHN CS(=O)(=O)N1CC[C@@H](CN2C[C@@H]3CCC[C@]3(NC(=O)C(N)=O)C2)C1 ZINC001099008578 792586987 /nfs/dbraw/zinc/58/69/87/792586987.db2.gz KFZRDDQQRFCOLW-HUBLWGQQSA-N 0 3 358.464 -1.276 20 0 FAADHN CS(=O)(=O)N1CC[C@H](CN2C[C@@H]3CCC[C@]3(NC(=O)C(N)=O)C2)C1 ZINC001099008586 792586971 /nfs/dbraw/zinc/58/69/71/792586971.db2.gz KFZRDDQQRFCOLW-XUJVJEKNSA-N 0 3 358.464 -1.276 20 0 FAADHN O=C(N[C@]12CCC[C@H]1CN(CCn1cncn1)C2)[C@H]1CCS(=O)(=O)N1 ZINC001099168400 792587620 /nfs/dbraw/zinc/58/76/20/792587620.db2.gz SFXONTCFKVIRBF-GUTXKFCHSA-N 0 3 368.463 -1.060 20 0 FAADHN O=C(N[C@]12CCC[C@H]1CN(CCn1cncn1)C2)[C@@H]1CCS(=O)(=O)N1 ZINC001099168401 792587843 /nfs/dbraw/zinc/58/78/43/792587843.db2.gz SFXONTCFKVIRBF-YDHLFZDLSA-N 0 3 368.463 -1.060 20 0 FAADHN CN(C)C(=O)Cn1cc(C(=O)N[C@]23CCC[C@H]2CN(CCO)C3)nn1 ZINC001099175747 792587869 /nfs/dbraw/zinc/58/78/69/792587869.db2.gz FYRFBSUSFZOGSG-LRDDRELGSA-N 0 3 350.423 -1.057 20 0 FAADHN O=C(Cn1cnnn1)N1C[C@@H](C(F)(F)F)[C@H](NCCn2cncn2)C1 ZINC001099208612 792589078 /nfs/dbraw/zinc/58/90/78/792589078.db2.gz AFUCDFXFISTCAL-NXEZZACHSA-N 0 3 359.316 -1.056 20 0 FAADHN NC(=O)CC(=O)N1C[C@@H](C(F)(F)F)[C@H](NCCN2C(=O)CCC2=O)C1 ZINC001099226565 792589153 /nfs/dbraw/zinc/58/91/53/792589153.db2.gz AFYXSYVILPDFJK-RKDXNWHRSA-N 0 3 364.324 -1.010 20 0 FAADHN NC(=O)CC(=O)N1C[C@@H](C(F)(F)F)[C@H](NCCN2CCNC2=O)C1 ZINC001099226569 792589216 /nfs/dbraw/zinc/58/92/16/792589216.db2.gz ALBPECOKGINDSM-RKDXNWHRSA-N 0 3 351.329 -1.134 20 0 FAADHN NC(=O)CC(=O)N1C[C@@H](C(F)(F)F)[C@H](NCCN2C(=O)CNC2=O)C1 ZINC001099227013 790456493 /nfs/dbraw/zinc/45/64/93/790456493.db2.gz QDIFWHBYDLZRNX-HTQZYQBOSA-N 0 3 365.312 -1.608 20 0 FAADHN O=C(Cn1ncnn1)N1C[C@@H](C(F)(F)F)[C@H](NCCn2cncn2)C1 ZINC001099252415 792588902 /nfs/dbraw/zinc/58/89/02/792588902.db2.gz MUWHYAJNRQZFID-NXEZZACHSA-N 0 3 359.316 -1.056 20 0 FAADHN C[C@H](O)CN[C@@H]1CN(C(=O)Cn2cnc(C(N)=O)n2)C[C@H]1C(F)(F)F ZINC001099252895 792589329 /nfs/dbraw/zinc/58/93/29/792589329.db2.gz FTOKIMBWSVTYGT-DJLDLDEBSA-N 0 3 364.328 -1.263 20 0 FAADHN C[C@@H](O)CN[C@@H]1CN(C(=O)Cn2cnc(C(N)=O)n2)C[C@H]1C(F)(F)F ZINC001099252900 792589529 /nfs/dbraw/zinc/58/95/29/792589529.db2.gz FTOKIMBWSVTYGT-IWSPIJDZSA-N 0 3 364.328 -1.263 20 0 FAADHN NC(=O)c1ncn(CC(=O)N2C[C@@H](C(F)(F)F)[C@H](NCCO)C2)n1 ZINC001099253228 790465399 /nfs/dbraw/zinc/46/53/99/790465399.db2.gz QLYCTSQLQHDFFJ-HTQZYQBOSA-N 0 3 350.301 -1.652 20 0 FAADHN O=C(CN1CCCS1(=O)=O)N1C[C@@H](C(F)(F)F)[C@H](NCCO)C1 ZINC001099260166 792590097 /nfs/dbraw/zinc/59/00/97/792590097.db2.gz YQAPHXILROGNJD-NXEZZACHSA-N 0 3 359.370 -1.007 20 0 FAADHN Cn1c(=O)ccn(CC(=O)N2C[C@@H](C(F)(F)F)[C@H](NCCO)C2)c1=O ZINC001099260449 792590395 /nfs/dbraw/zinc/59/03/95/792590395.db2.gz KADBNPNWOACAGV-NXEZZACHSA-N 0 3 364.324 -1.482 20 0 FAADHN CN1CCN(CC(=O)N2C[C@@H](C(F)(F)F)[C@H](NCCO)C2)CC1=O ZINC001099272918 792590125 /nfs/dbraw/zinc/59/01/25/792590125.db2.gz WXNSNJLMFGKXIX-GHMZBOCLSA-N 0 3 352.357 -1.268 20 0 FAADHN C[C@H](O)CN[C@@H]1CN(C(=O)Cn2ncn(C)c2=O)C[C@H]1C(F)(F)F ZINC001099273494 792590529 /nfs/dbraw/zinc/59/05/29/792590529.db2.gz UBTVLQHNWXOGGW-IVZWLZJFSA-N 0 3 351.329 -1.059 20 0 FAADHN C[C@@H](O)CN[C@@H]1CN(C(=O)Cn2ncn(C)c2=O)C[C@H]1C(F)(F)F ZINC001099273495 792590608 /nfs/dbraw/zinc/59/06/08/792590608.db2.gz UBTVLQHNWXOGGW-OPRDCNLKSA-N 0 3 351.329 -1.059 20 0 FAADHN O=C(Cn1ccc(=O)[nH]c1=O)N1C[C@@H](C(F)(F)F)[C@H](NCCO)C1 ZINC001099275642 792590625 /nfs/dbraw/zinc/59/06/25/792590625.db2.gz KRKAYSLWHGTDHH-RKDXNWHRSA-N 0 3 350.297 -1.080 20 0 FAADHN Cn1cnn(CCC(=O)N2C[C@@H](C(F)(F)F)[C@H](NCCO)C2)c1=O ZINC001099284510 792590060 /nfs/dbraw/zinc/59/00/60/792590060.db2.gz DMMUBLHHXAYNOX-NXEZZACHSA-N 0 3 351.329 -1.057 20 0 FAADHN C[C@@H](O)CN[C@@H]1CN(C(=O)CN2CCNC(=O)C2)C[C@H]1C(F)(F)F ZINC001099288430 790471494 /nfs/dbraw/zinc/47/14/94/790471494.db2.gz LEKFZNUFWQFTSS-GMTAPVOTSA-N 0 3 352.357 -1.222 20 0 FAADHN C[C@H](O)CN[C@@H]1CN(C(=O)CN2CCNC(=O)C2)C[C@H]1C(F)(F)F ZINC001099288433 790471107 /nfs/dbraw/zinc/47/11/07/790471107.db2.gz LEKFZNUFWQFTSS-HBNTYKKESA-N 0 3 352.357 -1.222 20 0 FAADHN O=C([C@@H]1CNC(=O)N1)N1C[C@@H](C(F)(F)F)[C@H](NCCn2cncn2)C1 ZINC001099298127 792590457 /nfs/dbraw/zinc/59/04/57/792590457.db2.gz SYCGXAFMWSXGKF-KXUCPTDWSA-N 0 3 361.328 -1.062 20 0 FAADHN O=C([C@H]1CNC(=O)N1)N1C[C@@H](C(F)(F)F)[C@H](NCCn2cncn2)C1 ZINC001099298129 792591380 /nfs/dbraw/zinc/59/13/80/792591380.db2.gz SYCGXAFMWSXGKF-OPRDCNLKSA-N 0 3 361.328 -1.062 20 0 FAADHN Cn1cc(C(=O)N2C[C@@H](C(F)(F)F)[C@H](NCCO)C2)c(=O)n(C)c1=O ZINC001099317060 792591416 /nfs/dbraw/zinc/59/14/16/792591416.db2.gz PKTBXZDLZWKISU-NXEZZACHSA-N 0 3 364.324 -1.331 20 0 FAADHN CN1C(=O)C(=O)N(CC(=O)N2C[C@@H](C(F)(F)F)[C@H](NCCO)C2)C1=O ZINC001099317312 792591586 /nfs/dbraw/zinc/59/15/86/792591586.db2.gz YHHXDOLNHITPJT-HTQZYQBOSA-N 0 3 366.296 -1.622 20 0 FAADHN O=C(C1CC2(C1)NC(=O)NC2=O)N1C[C@@H](C(F)(F)F)[C@H](NCCO)C1 ZINC001099320437 792591182 /nfs/dbraw/zinc/59/11/82/792591182.db2.gz QKLBDQMHZUUNMU-CNLDYIBBSA-N 0 3 364.324 -1.054 20 0 FAADHN CN1CC[C@@H](C(=O)N2C[C@@H](C(F)(F)F)[C@H](NCCO)C2)S1(=O)=O ZINC001099321571 792591598 /nfs/dbraw/zinc/59/15/98/792591598.db2.gz BQLPPFQAQVDRLZ-BBBLOLIVSA-N 0 3 359.370 -1.009 20 0 FAADHN CN1CC[C@H](C(=O)N2C[C@@H](C(F)(F)F)[C@H](NCCO)C2)S1(=O)=O ZINC001099321572 792591425 /nfs/dbraw/zinc/59/14/25/792591425.db2.gz BQLPPFQAQVDRLZ-OPRDCNLKSA-N 0 3 359.370 -1.009 20 0 FAADHN C[C@H](O)CN[C@@H]1CN(C(=O)CN2CC(=O)NC2=O)C[C@H]1C(F)(F)F ZINC001099322979 792591447 /nfs/dbraw/zinc/59/14/47/792591447.db2.gz OLLZRRAZJGODFL-DJLDLDEBSA-N 0 3 352.313 -1.102 20 0 FAADHN C[C@@H](O)CN[C@@H]1CN(C(=O)CN2CC(=O)NC2=O)C[C@H]1C(F)(F)F ZINC001099322980 792591230 /nfs/dbraw/zinc/59/12/30/792591230.db2.gz OLLZRRAZJGODFL-IWSPIJDZSA-N 0 3 352.313 -1.102 20 0 FAADHN O=C(CN1CCC(=O)NC1=O)N1C[C@@H](C(F)(F)F)[C@H](NCCO)C1 ZINC001099330000 792591369 /nfs/dbraw/zinc/59/13/69/792591369.db2.gz BOXQFETZMZXQQV-RKDXNWHRSA-N 0 3 352.313 -1.101 20 0 FAADHN CN1C(=O)CN(CC(=O)N2C[C@@H](C(F)(F)F)[C@H](NCCO)C2)C1=O ZINC001099330956 792591439 /nfs/dbraw/zinc/59/14/39/792591439.db2.gz MYVFDZSCBGZOIB-RKDXNWHRSA-N 0 3 352.313 -1.148 20 0 FAADHN Cc1nn(CC(=O)N2C[C@@H](C(F)(F)F)[C@H](NCCO)C2)c(=O)n1C ZINC001099336101 792592243 /nfs/dbraw/zinc/59/22/43/792592243.db2.gz IJQXSICVFWTNRB-NXEZZACHSA-N 0 3 351.329 -1.139 20 0 FAADHN C[C@H](O)CN[C@@H]1CN(C(=O)CN2C(=O)CNC2=O)C[C@H]1C(F)(F)F ZINC001099338501 792592658 /nfs/dbraw/zinc/59/26/58/792592658.db2.gz BTWYLZASQLCOCL-DJLDLDEBSA-N 0 3 352.313 -1.102 20 0 FAADHN C[C@@H](O)CN[C@@H]1CN(C(=O)CN2C(=O)CNC2=O)C[C@H]1C(F)(F)F ZINC001099338502 792592517 /nfs/dbraw/zinc/59/25/17/792592517.db2.gz BTWYLZASQLCOCL-IWSPIJDZSA-N 0 3 352.313 -1.102 20 0 FAADHN O=C(CC[C@@H]1NC(=O)NC1=O)N1C[C@@H](C(F)(F)F)[C@H](NCCO)C1 ZINC001099338969 792592673 /nfs/dbraw/zinc/59/26/73/792592673.db2.gz QEOHFDRIRHUPBR-HRDYMLBCSA-N 0 3 352.313 -1.054 20 0 FAADHN O=C(CC[C@H]1NC(=O)NC1=O)N1C[C@@H](C(F)(F)F)[C@H](NCCO)C1 ZINC001099338970 792592555 /nfs/dbraw/zinc/59/25/55/792592555.db2.gz QEOHFDRIRHUPBR-IWSPIJDZSA-N 0 3 352.313 -1.054 20 0 FAADHN CN1CC(=O)N(CC(=O)N2C[C@@H](C(F)(F)F)[C@H](NCCO)C2)C1=O ZINC001099339411 792592424 /nfs/dbraw/zinc/59/24/24/792592424.db2.gz XGAPBYGPVJEMHY-RKDXNWHRSA-N 0 3 352.313 -1.148 20 0 FAADHN C[C@H](O)CN[C@@H]1CN(C(=O)c2cn(CC(N)=O)nn2)C[C@H]1C(F)(F)F ZINC001099345541 792592103 /nfs/dbraw/zinc/59/21/03/792592103.db2.gz GIRKWJIFRYYMJB-DJLDLDEBSA-N 0 3 364.328 -1.263 20 0 FAADHN C[C@@H](O)CN[C@@H]1CN(C(=O)c2cn(CC(N)=O)nn2)C[C@H]1C(F)(F)F ZINC001099345542 792592119 /nfs/dbraw/zinc/59/21/19/792592119.db2.gz GIRKWJIFRYYMJB-IWSPIJDZSA-N 0 3 364.328 -1.263 20 0 FAADHN NC(=O)Cn1cc(C(=O)N2C[C@@H](C(F)(F)F)[C@H](NCCO)C2)nn1 ZINC001099345627 790474093 /nfs/dbraw/zinc/47/40/93/790474093.db2.gz KXYASMBOZDQXIR-HTQZYQBOSA-N 0 3 350.301 -1.652 20 0 FAADHN CC(=O)NCC(=O)N1C[C@H]2CN(CCN3C(=O)CNC3=O)C[C@@]2(C)C1 ZINC001101112153 792593459 /nfs/dbraw/zinc/59/34/59/792593459.db2.gz PEGRNJOVJLFVRN-WBMJQRKESA-N 0 3 351.407 -1.545 20 0 FAADHN C[C@@]12CN(CCN3C(=O)CNC3=O)C[C@@H]1CN(C(=O)CNC(N)=O)C2 ZINC001101124141 792594401 /nfs/dbraw/zinc/59/44/01/792594401.db2.gz MSGFUBVUQUHDCZ-BMIGLBTASA-N 0 3 352.395 -2.013 20 0 FAADHN C[C@@]12CN(CCN3C(=O)CCC3=O)C[C@@H]1CN(C(=O)CNC(N)=O)C2 ZINC001101124264 792594190 /nfs/dbraw/zinc/59/41/90/792594190.db2.gz SIKMACZGWHTTEE-BZNIZROVSA-N 0 3 351.407 -1.416 20 0 FAADHN CCS(=O)(=O)NCCCN1C[C@@H]2CN(C(=O)CC(N)=O)C[C@]2(C)C1 ZINC001101181678 792595532 /nfs/dbraw/zinc/59/55/32/792595532.db2.gz BVZHILKHUHXKQV-DOMZBBRYSA-N 0 3 360.480 -1.029 20 0 FAADHN CN(C)S(=O)(=O)CCCN1C[C@@H]2CN(C(=O)CC(N)=O)C[C@]2(C)C1 ZINC001101182699 792596309 /nfs/dbraw/zinc/59/63/09/792596309.db2.gz ATWCCCCIRFJPAH-DOMZBBRYSA-N 0 3 360.480 -1.076 20 0 FAADHN CNC(=O)CC(=O)N1C[C@H]2CN(CCN3C(=O)CNC3=O)C[C@@]2(C)C1 ZINC001101211959 792596141 /nfs/dbraw/zinc/59/61/41/792596141.db2.gz NOSOTRIPABLHAO-BZNIZROVSA-N 0 3 351.407 -1.545 20 0 FAADHN C[C@H](NC(N)=O)C(=O)N1C[C@H]2CN(CCN3CCNC3=O)C[C@@]2(C)C1 ZINC001101213218 792596201 /nfs/dbraw/zinc/59/62/01/792596201.db2.gz ZBKLFNQIBCEDKA-OZVIIMIRSA-N 0 3 352.439 -1.151 20 0 FAADHN CC[C@H](C(N)=O)N1C[C@@H]2CN(C(=O)CCS(=O)(=O)NC)C[C@]2(C)C1 ZINC001101237196 792597476 /nfs/dbraw/zinc/59/74/76/792597476.db2.gz GXBWCTNTJNOMDZ-JMSVASOKSA-N 0 3 360.480 -1.030 20 0 FAADHN CC[C@@H](C(N)=O)N1C[C@@H]2CN(C(=O)CCS(=O)(=O)NC)C[C@]2(C)C1 ZINC001101237197 792597094 /nfs/dbraw/zinc/59/70/94/792597094.db2.gz GXBWCTNTJNOMDZ-XUJVJEKNSA-N 0 3 360.480 -1.030 20 0 FAADHN CC[C@H](C(N)=O)N1C[C@@H]2CN(C(=O)CCNS(C)(=O)=O)C[C@]2(C)C1 ZINC001101256292 792598456 /nfs/dbraw/zinc/59/84/56/792598456.db2.gz OKNFTQFPWZCNCL-JMSVASOKSA-N 0 3 360.480 -1.030 20 0 FAADHN CC[C@@H](C(N)=O)N1C[C@@H]2CN(C(=O)CCNS(C)(=O)=O)C[C@]2(C)C1 ZINC001101256293 789687905 /nfs/dbraw/zinc/68/79/05/789687905.db2.gz OKNFTQFPWZCNCL-XUJVJEKNSA-N 0 3 360.480 -1.030 20 0 FAADHN CC[C@H](C(N)=O)N1C[C@@H]2CN(C(=O)CN(C)S(C)(=O)=O)C[C@]2(C)C1 ZINC001101257275 792598380 /nfs/dbraw/zinc/59/83/80/792598380.db2.gz NDBKUXCSRIJWKR-JMSVASOKSA-N 0 3 360.480 -1.078 20 0 FAADHN CC[C@@H](C(N)=O)N1C[C@@H]2CN(C(=O)CN(C)S(C)(=O)=O)C[C@]2(C)C1 ZINC001101257276 792599178 /nfs/dbraw/zinc/59/91/78/792599178.db2.gz NDBKUXCSRIJWKR-XUJVJEKNSA-N 0 3 360.480 -1.078 20 0 FAADHN CC[C@H](C(N)=O)N1C[C@@H]2CN(C(=O)CNS(=O)(=O)CC)C[C@]2(C)C1 ZINC001101257530 792599355 /nfs/dbraw/zinc/59/93/55/792599355.db2.gz YTCKASXAUDBVRQ-JMSVASOKSA-N 0 3 360.480 -1.030 20 0 FAADHN CC[C@@H](C(N)=O)N1C[C@@H]2CN(C(=O)CNS(=O)(=O)CC)C[C@]2(C)C1 ZINC001101257531 792599410 /nfs/dbraw/zinc/59/94/10/792599410.db2.gz YTCKASXAUDBVRQ-XUJVJEKNSA-N 0 3 360.480 -1.030 20 0 FAADHN CNC(=O)NCC(=O)N1C[C@H]2CN(CCN3CCNC3=O)C[C@@]2(C)C1 ZINC001101259578 792599151 /nfs/dbraw/zinc/59/91/51/792599151.db2.gz ADDBYVJHRRKWKG-WBMJQRKESA-N 0 3 352.439 -1.279 20 0 FAADHN CC[C@H](C(N)=O)N1C[C@@H]2CN(C(=O)CNS(=O)(=O)NC)C[C@]2(C)C1 ZINC001101313569 792600540 /nfs/dbraw/zinc/60/05/40/792600540.db2.gz DAIMNNMXCAALSY-GYSYKLTISA-N 0 3 361.468 -1.916 20 0 FAADHN CC[C@@H](C(N)=O)N1C[C@@H]2CN(C(=O)CNS(=O)(=O)NC)C[C@]2(C)C1 ZINC001101313570 792601063 /nfs/dbraw/zinc/60/10/63/792601063.db2.gz DAIMNNMXCAALSY-SUNKGSAMSA-N 0 3 361.468 -1.916 20 0 FAADHN CNS(=O)(=O)NCC(=O)N1C[C@H]2CN(Cc3cnn(C)c3)C[C@@]2(C)C1 ZINC001101313643 792601843 /nfs/dbraw/zinc/60/18/43/792601843.db2.gz HQFAZJUYUFBLGM-HIFRSBDPSA-N 0 3 370.479 -1.246 20 0 FAADHN CC[C@H](C(N)=O)N1C[C@@H]2CN(C(=O)CS(=O)(=O)N(C)C)C[C@]2(C)C1 ZINC001101449776 792606256 /nfs/dbraw/zinc/60/62/56/792606256.db2.gz LDADXNPBQBEEMN-JMSVASOKSA-N 0 3 360.480 -1.078 20 0 FAADHN CC[C@@H](C(N)=O)N1C[C@@H]2CN(C(=O)CS(=O)(=O)N(C)C)C[C@]2(C)C1 ZINC001101449777 792606149 /nfs/dbraw/zinc/60/61/49/792606149.db2.gz LDADXNPBQBEEMN-XUJVJEKNSA-N 0 3 360.480 -1.078 20 0 FAADHN C[C@@]12CN(CCN3CCNC3=O)C[C@@H]1CN(C(=O)CCNC(N)=O)C2 ZINC001101457821 792606797 /nfs/dbraw/zinc/60/67/97/792606797.db2.gz SXLCMTGHSNXLMP-WBMJQRKESA-N 0 3 352.439 -1.150 20 0 FAADHN CNS(=O)(=O)CC(=O)N1C[C@H]2CN([C@H](C)C(=O)N(C)C)C[C@@]2(C)C1 ZINC001101465466 792607525 /nfs/dbraw/zinc/60/75/25/792607525.db2.gz JHCBRQVBWIBMOO-JMSVASOKSA-N 0 3 360.480 -1.207 20 0 FAADHN CNS(=O)(=O)CC(=O)N1C[C@H]2CN([C@@H](C)C(=O)N(C)C)C[C@@]2(C)C1 ZINC001101465467 792607402 /nfs/dbraw/zinc/60/74/02/792607402.db2.gz JHCBRQVBWIBMOO-ZOWXZIJZSA-N 0 3 360.480 -1.207 20 0 FAADHN CC(=O)NCC(=O)NC[C@@H]1CN(CCN2CCCS2(=O)=O)C[C@H]1C ZINC001101684548 792608442 /nfs/dbraw/zinc/60/84/42/792608442.db2.gz JLWSSQDLOKPYGC-TZMCWYRMSA-N 0 3 360.480 -1.158 20 0 FAADHN C[C@@H](C(=O)NC(N)=O)N1C[C@@H](CNC(=O)CN2CCCC2=O)[C@H](C)C1 ZINC001101708467 792608575 /nfs/dbraw/zinc/60/85/75/792608575.db2.gz KJUWJVVMKWLRCC-GRYCIOLGSA-N 0 3 353.423 -1.124 20 0 FAADHN C[C@H](C(=O)NC(N)=O)N1C[C@@H](CNC(=O)CN2CCCC2=O)[C@H](C)C1 ZINC001101708468 792607765 /nfs/dbraw/zinc/60/77/65/792607765.db2.gz KJUWJVVMKWLRCC-IJLUTSLNSA-N 0 3 353.423 -1.124 20 0 FAADHN C[C@@H]1CN(CCN2CCCS2(=O)=O)C[C@H]1CNC(=O)CNC(N)=O ZINC001101710878 792608529 /nfs/dbraw/zinc/60/85/29/792608529.db2.gz BBVIRCFTZHSGBS-VXGBXAGGSA-N 0 3 361.468 -1.626 20 0 FAADHN COCCCNC(=O)[C@H](C)N1C[C@@H](CNC(=O)CNC(N)=O)[C@H](C)C1 ZINC001101713866 792609535 /nfs/dbraw/zinc/60/95/35/792609535.db2.gz ZQXCROJOTHBXOR-FRRDWIJNSA-N 0 3 357.455 -1.120 20 0 FAADHN COCCCNC(=O)[C@@H](C)N1C[C@@H](CNC(=O)CNC(N)=O)[C@H](C)C1 ZINC001101713867 792609901 /nfs/dbraw/zinc/60/99/01/792609901.db2.gz ZQXCROJOTHBXOR-JHJVBQTASA-N 0 3 357.455 -1.120 20 0 FAADHN C[C@@H]1CN(CC(=O)N2CCOCC2)C[C@H]1CNC(=O)Cn1cnnn1 ZINC001101716728 792609989 /nfs/dbraw/zinc/60/99/89/792609989.db2.gz HNSIOUHXLHZXCN-CHWSQXEVSA-N 0 3 351.411 -1.784 20 0 FAADHN C[C@@H]1CN(C[C@@H]2CCS(=O)(=O)C2)C[C@H]1CNC(=O)Cn1cnnn1 ZINC001101716876 792609922 /nfs/dbraw/zinc/60/99/22/792609922.db2.gz KIOVNZOWBNAEGI-FRRDWIJNSA-N 0 3 356.452 -1.208 20 0 FAADHN C[C@@H]1CN(C[C@H]2CCS(=O)(=O)C2)C[C@H]1CNC(=O)Cn1cnnn1 ZINC001101716877 792609581 /nfs/dbraw/zinc/60/95/81/792609581.db2.gz KIOVNZOWBNAEGI-JHJVBQTASA-N 0 3 356.452 -1.208 20 0 FAADHN C[C@@H]1CN(CCN2CCCS2(=O)=O)C[C@H]1CNC(=O)Cn1cnnn1 ZINC001101717195 792609883 /nfs/dbraw/zinc/60/98/83/792609883.db2.gz TYUMJOPFYKUHMB-CHWSQXEVSA-N 0 3 371.467 -1.607 20 0 FAADHN C[C@@H]1CN(CCN(C)S(C)(=O)=O)C[C@H]1CNC(=O)Cn1cnnn1 ZINC001101717223 792609368 /nfs/dbraw/zinc/60/93/68/792609368.db2.gz VLBFMQICHCQVBX-VXGBXAGGSA-N 0 3 359.456 -1.751 20 0 FAADHN C[C@@H](C(=O)NC(N)=O)N1C[C@@H](CNC(=O)CCn2cncn2)[C@H](C)C1 ZINC001101734632 792609197 /nfs/dbraw/zinc/60/91/97/792609197.db2.gz OSRRDMLVGSFSSJ-GRYCIOLGSA-N 0 3 351.411 -1.064 20 0 FAADHN C[C@H](C(=O)NC(N)=O)N1C[C@@H](CNC(=O)CCn2cncn2)[C@H](C)C1 ZINC001101734633 792609056 /nfs/dbraw/zinc/60/90/56/792609056.db2.gz OSRRDMLVGSFSSJ-IJLUTSLNSA-N 0 3 351.411 -1.064 20 0 FAADHN C[C@@H]1CN(CCN(C)S(C)(=O)=O)C[C@H]1CNC(=O)[C@@H]1COCCO1 ZINC001101746622 792609145 /nfs/dbraw/zinc/60/91/45/792609145.db2.gz HBTIDWQLTCNNAK-MCIONIFRSA-N 0 3 363.480 -1.023 20 0 FAADHN C[C@@H]1CN(CCN(C)S(C)(=O)=O)C[C@H]1CNC(=O)[C@H]1COCCO1 ZINC001101746623 792609436 /nfs/dbraw/zinc/60/94/36/792609436.db2.gz HBTIDWQLTCNNAK-MGPQQGTHSA-N 0 3 363.480 -1.023 20 0 FAADHN C[C@H](C(=O)NC(N)=O)N1C[C@@H](CNC(=O)CNC(=O)C2CC2)[C@H](C)C1 ZINC001101764224 792611157 /nfs/dbraw/zinc/61/11/57/792611157.db2.gz XOKBLXNJDFFESM-CKYFFXLPSA-N 0 3 353.423 -1.220 20 0 FAADHN C[C@@H](C(=O)NC(N)=O)N1C[C@@H](CNC(=O)CNC(=O)C2CC2)[C@H](C)C1 ZINC001101764225 792611194 /nfs/dbraw/zinc/61/11/94/792611194.db2.gz XOKBLXNJDFFESM-JFGNBEQYSA-N 0 3 353.423 -1.220 20 0 FAADHN COC(=O)NCC(=O)NC[C@@H]1CN(CCN(C)S(C)(=O)=O)C[C@H]1C ZINC001101769839 792611348 /nfs/dbraw/zinc/61/13/48/792611348.db2.gz PYAOYZGCRDKCIQ-VXGBXAGGSA-N 0 3 364.468 -1.082 20 0 FAADHN COC(=O)NCC(=O)NC[C@@H]1CN(CC(=O)N2CCOCC2)C[C@H]1C ZINC001101769906 792611266 /nfs/dbraw/zinc/61/12/66/792611266.db2.gz RVKKZLOOMZUTNT-CHWSQXEVSA-N 0 3 356.423 -1.115 20 0 FAADHN C[C@@H]1CN(CCN(C)S(C)(=O)=O)C[C@H]1CNC(=O)[C@H]1CCC(=O)N1 ZINC001101810411 792611029 /nfs/dbraw/zinc/61/10/29/792611029.db2.gz GCZXBQJMZPKNEQ-JHJVBQTASA-N 0 3 360.480 -1.160 20 0 FAADHN C[C@@H]1CN(Cc2cc(=O)n(C)c(=O)n2C)C[C@H]1CNC(=O)CC(N)=O ZINC001101837758 792611293 /nfs/dbraw/zinc/61/12/93/792611293.db2.gz MBJZPKMAWRMGOY-GHMZBOCLSA-N 0 3 351.407 -1.857 20 0 FAADHN C[C@@H]1CN(CCNS(C)(=O)=O)C[C@H]1CNC(=O)[C@@H]1CN(C)CCO1 ZINC001101844211 792612424 /nfs/dbraw/zinc/61/24/24/792612424.db2.gz QGSQTQJYCCNZJI-MCIONIFRSA-N 0 3 362.496 -1.450 20 0 FAADHN C[C@@H]1CN(CCNS(C)(=O)=O)C[C@H]1CNC(=O)[C@H]1CN(C)CCO1 ZINC001101844212 792611609 /nfs/dbraw/zinc/61/16/09/792611609.db2.gz QGSQTQJYCCNZJI-MGPQQGTHSA-N 0 3 362.496 -1.450 20 0 FAADHN CNC(=O)NC(=O)CN1C[C@@H](CNC(=O)CCc2nnc[nH]2)[C@H](C)C1 ZINC001101865368 792612119 /nfs/dbraw/zinc/61/21/19/792612119.db2.gz LDJSQBJZMUJEJJ-GHMZBOCLSA-N 0 3 351.411 -1.123 20 0 FAADHN C[C@@H]1CN(CCNS(C)(=O)=O)C[C@H]1CNC(=O)CCc1nnc[nH]1 ZINC001101866378 792612075 /nfs/dbraw/zinc/61/20/75/792612075.db2.gz HAKGLUXBUTUTAW-VXGBXAGGSA-N 0 3 358.468 -1.029 20 0 FAADHN C[C@@H](C(=O)NC(N)=O)N1C[C@@H](CNC(=O)CN2CCOCC2)[C@H](C)C1 ZINC001101886335 792612669 /nfs/dbraw/zinc/61/26/69/792612669.db2.gz LOIMXCLQJXQZMI-FRRDWIJNSA-N 0 3 355.439 -1.414 20 0 FAADHN C[C@H](C(=O)NC(N)=O)N1C[C@@H](CNC(=O)CN2CCOCC2)[C@H](C)C1 ZINC001101886336 792612687 /nfs/dbraw/zinc/61/26/87/792612687.db2.gz LOIMXCLQJXQZMI-JHJVBQTASA-N 0 3 355.439 -1.414 20 0 FAADHN C[C@@H]1CN([C@H]2CCC(=O)NC2=O)C[C@H]1CNC(=O)CN1CCOCC1 ZINC001101889467 792612786 /nfs/dbraw/zinc/61/27/86/792612786.db2.gz DNVMZMBLLHWHBC-MCIONIFRSA-N 0 3 352.435 -1.192 20 0 FAADHN C[C@@H]1CN([C@@H]2CCC(=O)NC2=O)C[C@H]1CNC(=O)CN1CCOCC1 ZINC001101889468 792611756 /nfs/dbraw/zinc/61/17/56/792611756.db2.gz DNVMZMBLLHWHBC-MGPQQGTHSA-N 0 3 352.435 -1.192 20 0 FAADHN C[C@@H](C(=O)NC(N)=O)N1C[C@@H](CNC(=O)CN2CN=NC2=O)[C@H](C)C1 ZINC001101893923 792612593 /nfs/dbraw/zinc/61/25/93/792612593.db2.gz YAYXYDYPCTVPLP-KXUCPTDWSA-N 0 3 353.383 -1.749 20 0 FAADHN C[C@H](C(=O)NC(N)=O)N1C[C@@H](CNC(=O)CN2CN=NC2=O)[C@H](C)C1 ZINC001101893924 792612717 /nfs/dbraw/zinc/61/27/17/792612717.db2.gz YAYXYDYPCTVPLP-OPRDCNLKSA-N 0 3 353.383 -1.749 20 0 FAADHN C[C@@H](C(=O)NC(N)=O)N1C[C@@H](CNC(=O)c2cnn(C)c2N)[C@H](C)C1 ZINC001101897858 792612373 /nfs/dbraw/zinc/61/23/73/792612373.db2.gz RBJAJHUIAXXLPN-KXUCPTDWSA-N 0 3 351.411 -1.117 20 0 FAADHN C[C@H](C(=O)NC(N)=O)N1C[C@@H](CNC(=O)c2cnn(C)c2N)[C@H](C)C1 ZINC001101897859 792611738 /nfs/dbraw/zinc/61/17/38/792611738.db2.gz RBJAJHUIAXXLPN-OPRDCNLKSA-N 0 3 351.411 -1.117 20 0 FAADHN C[C@@H]1CN([C@@H]2CCC(=O)NC2=O)C[C@H]1CNC(=O)CN1CN=NC1=O ZINC001101902534 792612465 /nfs/dbraw/zinc/61/24/65/792612465.db2.gz UGTYPNPZINBMQL-GMTAPVOTSA-N 0 3 350.379 -1.527 20 0 FAADHN C[C@@H]1CN([C@H]2CCC(=O)NC2=O)C[C@H]1CNC(=O)CN1CN=NC1=O ZINC001101902535 792612699 /nfs/dbraw/zinc/61/26/99/792612699.db2.gz UGTYPNPZINBMQL-MXWKQRLJSA-N 0 3 350.379 -1.527 20 0 FAADHN CNC(=O)CC(=O)NC[C@@H]1CN(CCN2CCCS2(=O)=O)C[C@H]1C ZINC001101908490 792613283 /nfs/dbraw/zinc/61/32/83/792613283.db2.gz XAXOODVZJRUIKH-CHWSQXEVSA-N 0 3 360.480 -1.158 20 0 FAADHN C[C@@H]1CN(CCNS(C)(=O)=O)C[C@H]1CNC(=O)c1cc(=O)n(C)o1 ZINC001101909411 792613532 /nfs/dbraw/zinc/61/35/32/792613532.db2.gz MRFFLBNLNGPQKP-GHMZBOCLSA-N 0 3 360.436 -1.175 20 0 FAADHN C[C@@H](C(=O)NC(N)=O)N1C[C@@H](CNC(=O)c2cc(=O)n(C)o2)[C@H](C)C1 ZINC001101909639 792613973 /nfs/dbraw/zinc/61/39/73/792613973.db2.gz VMDPLSUROYNGPB-KXUCPTDWSA-N 0 3 353.379 -1.141 20 0 FAADHN C[C@H](C(=O)NC(N)=O)N1C[C@@H](CNC(=O)c2cc(=O)n(C)o2)[C@H](C)C1 ZINC001101909640 792613299 /nfs/dbraw/zinc/61/32/99/792613299.db2.gz VMDPLSUROYNGPB-OPRDCNLKSA-N 0 3 353.379 -1.141 20 0 FAADHN CC(=O)N1CC(C(=O)NC[C@@H]2CN([C@H](C)C(=O)NC(N)=O)C[C@H]2C)C1 ZINC001101909645 792613254 /nfs/dbraw/zinc/61/32/54/792613254.db2.gz VWTXYGTYNZYHQL-CKYFFXLPSA-N 0 3 353.423 -1.268 20 0 FAADHN CC(=O)N1CC(C(=O)NC[C@@H]2CN([C@@H](C)C(=O)NC(N)=O)C[C@H]2C)C1 ZINC001101909646 792613475 /nfs/dbraw/zinc/61/34/75/792613475.db2.gz VWTXYGTYNZYHQL-JFGNBEQYSA-N 0 3 353.423 -1.268 20 0 FAADHN C[C@@H](C(=O)NC(N)=O)N1C[C@@H](CNC(=O)CCn2ccnn2)[C@H](C)C1 ZINC001101911690 792613931 /nfs/dbraw/zinc/61/39/31/792613931.db2.gz OIULRMNMFASPPH-GRYCIOLGSA-N 0 3 351.411 -1.064 20 0 FAADHN C[C@H](C(=O)NC(N)=O)N1C[C@@H](CNC(=O)CCn2ccnn2)[C@H](C)C1 ZINC001101911691 792613592 /nfs/dbraw/zinc/61/35/92/792613592.db2.gz OIULRMNMFASPPH-IJLUTSLNSA-N 0 3 351.411 -1.064 20 0 FAADHN C[C@H](NC(N)=O)C(=O)NC[C@@H]1CN(CCN(C)S(C)(=O)=O)C[C@H]1C ZINC001101911781 792613762 /nfs/dbraw/zinc/61/37/62/792613762.db2.gz TZBNNJHWQVNUTI-GRYCIOLGSA-N 0 3 363.484 -1.381 20 0 FAADHN C[C@H](NC(N)=O)C(=O)NC[C@@H]1CN(CC(=O)N2CCOCC2)C[C@H]1C ZINC001101911854 792613443 /nfs/dbraw/zinc/61/34/43/792613443.db2.gz XQLNNBNJNKGCQN-FRRDWIJNSA-N 0 3 355.439 -1.414 20 0 FAADHN C[C@@H]1CN(CCN(C)S(C)(=O)=O)C[C@H]1CNC(=O)[C@H]1COC(=O)N1 ZINC001101927816 792613399 /nfs/dbraw/zinc/61/33/99/792613399.db2.gz NMKZOKCGJOHMPC-IJLUTSLNSA-N 0 3 362.452 -1.330 20 0 FAADHN C[C@@H]1CN(CCN(C)S(C)(=O)=O)C[C@H]1CNC(=O)[C@@H]1COC(=O)N1 ZINC001101927820 792613778 /nfs/dbraw/zinc/61/37/78/792613778.db2.gz NMKZOKCGJOHMPC-UTUOFQBUSA-N 0 3 362.452 -1.330 20 0 FAADHN CNC(=O)NCCC(=O)NC[C@@H]1CN([C@H](C)C(=O)NC(N)=O)C[C@H]1C ZINC001101939298 792613338 /nfs/dbraw/zinc/61/33/38/792613338.db2.gz LQCYXBDXLYKIDC-GMTAPVOTSA-N 0 3 356.427 -1.427 20 0 FAADHN CNC(=O)NCCC(=O)NC[C@@H]1CN([C@@H](C)C(=O)NC(N)=O)C[C@H]1C ZINC001101939299 792613236 /nfs/dbraw/zinc/61/32/36/792613236.db2.gz LQCYXBDXLYKIDC-OUAUKWLOSA-N 0 3 356.427 -1.427 20 0 FAADHN CNC(=O)NCCC(=O)NC[C@@H]1CN([C@@H]2CCC(=O)NC2=O)C[C@H]1C ZINC001101939311 792613104 /nfs/dbraw/zinc/61/31/04/792613104.db2.gz MEVMZWXSYJQRIX-IJLUTSLNSA-N 0 3 353.423 -1.205 20 0 FAADHN CNC(=O)NCCC(=O)NC[C@@H]1CN([C@H]2CCC(=O)NC2=O)C[C@H]1C ZINC001101939312 792613947 /nfs/dbraw/zinc/61/39/47/792613947.db2.gz MEVMZWXSYJQRIX-UTUOFQBUSA-N 0 3 353.423 -1.205 20 0 FAADHN Cc1nnc(CC(=O)NC[C@@H]2CN([C@H](C)C(=O)NC(N)=O)C[C@H]2C)[nH]1 ZINC001101955674 792615056 /nfs/dbraw/zinc/61/50/56/792615056.db2.gz BBZLPSJYLRSPPQ-FXPVBKGRSA-N 0 3 351.411 -1.077 20 0 FAADHN Cc1nnc(CC(=O)NC[C@@H]2CN([C@@H](C)C(=O)NC(N)=O)C[C@H]2C)[nH]1 ZINC001101955675 792614982 /nfs/dbraw/zinc/61/49/82/792614982.db2.gz BBZLPSJYLRSPPQ-WCABBAIRSA-N 0 3 351.411 -1.077 20 0 FAADHN Cc1nnc(CC(=O)NC[C@@H]2CN(CCNS(C)(=O)=O)C[C@H]2C)[nH]1 ZINC001101955810 792615018 /nfs/dbraw/zinc/61/50/18/792615018.db2.gz HYMMUGOXBZWZJM-ZYHUDNBSSA-N 0 3 358.468 -1.111 20 0 FAADHN C[C@@H](C(N)=O)N1C[C@@H](CNC(=O)CN(C)S(=O)(=O)N(C)C)[C@H](C)C1 ZINC001101963294 792614785 /nfs/dbraw/zinc/61/47/85/792614785.db2.gz TYQQMLULYRXYJF-GRYCIOLGSA-N 0 3 363.484 -1.718 20 0 FAADHN C[C@H](C(N)=O)N1C[C@@H](CNC(=O)CN(C)S(=O)(=O)N(C)C)[C@H](C)C1 ZINC001101963295 792615239 /nfs/dbraw/zinc/61/52/39/792615239.db2.gz TYQQMLULYRXYJF-IJLUTSLNSA-N 0 3 363.484 -1.718 20 0 FAADHN CNS(=O)(=O)CCC(=O)NC[C@@H]1CN([C@@H]2CCN(C)C2=O)C[C@H]1C ZINC001101966569 792615041 /nfs/dbraw/zinc/61/50/41/792615041.db2.gz REVVACXOXWKNKU-JHJVBQTASA-N 0 3 360.480 -1.160 20 0 FAADHN CNS(=O)(=O)CCC(=O)NC[C@@H]1CN([C@H]2CCN(C)C2=O)C[C@H]1C ZINC001101966570 792614450 /nfs/dbraw/zinc/61/44/50/792614450.db2.gz REVVACXOXWKNKU-UPJWGTAASA-N 0 3 360.480 -1.160 20 0 FAADHN CNS(=O)(=O)CCC(=O)NC[C@@H]1CN([C@@H]2CCCNC2=O)C[C@H]1C ZINC001101966667 792615088 /nfs/dbraw/zinc/61/50/88/792615088.db2.gz WTCJZVCILGOWAL-JHJVBQTASA-N 0 3 360.480 -1.112 20 0 FAADHN CNS(=O)(=O)CCC(=O)NC[C@@H]1CN([C@H]2CCCNC2=O)C[C@H]1C ZINC001101966668 792614370 /nfs/dbraw/zinc/61/43/70/792614370.db2.gz WTCJZVCILGOWAL-UPJWGTAASA-N 0 3 360.480 -1.112 20 0 FAADHN CNS(=O)(=O)CCC(=O)NC[C@@H]1CN(CC(=O)N2CCC2)C[C@H]1C ZINC001101969302 790399379 /nfs/dbraw/zinc/39/93/79/790399379.db2.gz PPFAZMWJPPNKQW-CHWSQXEVSA-N 0 3 360.480 -1.158 20 0 FAADHN C[C@@H]1CN(C[C@@H]2CCS(=O)(=O)C2)C[C@H]1CNC(=O)Cn1ncnn1 ZINC001101979914 792615078 /nfs/dbraw/zinc/61/50/78/792615078.db2.gz JAKXILALVMPOQL-FRRDWIJNSA-N 0 3 356.452 -1.208 20 0 FAADHN C[C@@H]1CN(C[C@H]2CCS(=O)(=O)C2)C[C@H]1CNC(=O)Cn1ncnn1 ZINC001101979915 792615199 /nfs/dbraw/zinc/61/51/99/792615199.db2.gz JAKXILALVMPOQL-JHJVBQTASA-N 0 3 356.452 -1.208 20 0 FAADHN C[C@@H]1CN(CCN(C)S(C)(=O)=O)C[C@H]1CNC(=O)Cn1ncnn1 ZINC001101980071 792615068 /nfs/dbraw/zinc/61/50/68/792615068.db2.gz LFPXZTPCBJGAGA-VXGBXAGGSA-N 0 3 359.456 -1.751 20 0 FAADHN C[C@@H]1CN(CCN2CCCS2(=O)=O)C[C@H]1CNC(=O)Cn1ncnn1 ZINC001101980121 792615669 /nfs/dbraw/zinc/61/56/69/792615669.db2.gz OPRMCZWOJAMUOE-CHWSQXEVSA-N 0 3 371.467 -1.607 20 0 FAADHN C[C@@H]1CN(CC(=O)N2CCOCC2)C[C@H]1CNC(=O)Cn1ncnn1 ZINC001101980525 792615960 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C[C@@H]1CN([C@@H]2CCCNC2=O)C[C@H]1CNC(=O)CN1CCNC(=O)C1 ZINC001102215080 792628767 /nfs/dbraw/zinc/62/87/67/792628767.db2.gz JPWXIOJOAXPHPZ-MGPQQGTHSA-N 0 3 351.451 -1.619 20 0 FAADHN CCN(C)C(=O)CN1C[C@@H](CNC(=O)CN2CCNC(=O)C2)[C@H](C)C1 ZINC001102215715 792627951 /nfs/dbraw/zinc/62/79/51/792627951.db2.gz VWEGNTMYUIEOQN-ZIAGYGMSSA-N 0 3 353.467 -1.419 20 0 FAADHN C[C@@H]1CN(CC(=O)N2CCC2)C[C@H]1CNC(=O)CN1CCNC(=O)C1 ZINC001102215798 792628236 /nfs/dbraw/zinc/62/82/36/792628236.db2.gz ZOQUXEMQHZTMKA-ZIAGYGMSSA-N 0 3 351.451 -1.665 20 0 FAADHN C[C@@H]1CN([C@H]2CCN(C)C2=O)C[C@H]1CNC(=O)CN1CCNC(=O)C1 ZINC001102217761 792628092 /nfs/dbraw/zinc/62/80/92/792628092.db2.gz BYYORQNPCXMVMO-MCIONIFRSA-N 0 3 351.451 -1.667 20 0 FAADHN C[C@@H]1CN([C@@H]2CCN(C)C2=O)C[C@H]1CNC(=O)CN1CCNC(=O)C1 ZINC001102217762 792628351 /nfs/dbraw/zinc/62/83/51/792628351.db2.gz BYYORQNPCXMVMO-MGPQQGTHSA-N 0 3 351.451 -1.667 20 0 FAADHN C[C@@H](C(=O)N(C)C)N1C[C@@H](CNC(=O)CN2CCNC(=O)C2)[C@H](C)C1 ZINC001102218037 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792642101 /nfs/dbraw/zinc/64/21/01/792642101.db2.gz GWWVPILCFUIDOL-MXWKQRLJSA-N 0 3 360.436 -1.975 20 0 FAADHN CNS(=O)(=O)CC(=O)NC[C@@H]1CN([C@@H](C)C(=O)NC2CC2)C[C@H]1C ZINC001102583518 792641652 /nfs/dbraw/zinc/64/16/52/792641652.db2.gz OCKRHJWODNKKMA-GRYCIOLGSA-N 0 3 360.480 -1.113 20 0 FAADHN CNS(=O)(=O)CC(=O)NC[C@@H]1CN([C@H](C)C(=O)NC2CC2)C[C@H]1C ZINC001102583519 792642368 /nfs/dbraw/zinc/64/23/68/792642368.db2.gz OCKRHJWODNKKMA-IJLUTSLNSA-N 0 3 360.480 -1.113 20 0 FAADHN CNS(=O)(=O)CC(=O)NC[C@@H]1CN(CCNC(=O)C2CC2)C[C@H]1C ZINC001102583541 792641970 /nfs/dbraw/zinc/64/19/70/792641970.db2.gz OPUOIUMTVQAONV-DGCLKSJQSA-N 0 3 360.480 -1.254 20 0 FAADHN CCN1CC[C@@H](N2C[C@@H](CNC(=O)CS(=O)(=O)NC)[C@H](C)C2)C1=O ZINC001102583736 792643613 /nfs/dbraw/zinc/64/36/13/792643613.db2.gz YIPIKGYCBLWXQS-JHJVBQTASA-N 0 3 360.480 -1.160 20 0 FAADHN CCN1CC[C@H](N2C[C@@H](CNC(=O)CS(=O)(=O)NC)[C@H](C)C2)C1=O ZINC001102583737 792643348 /nfs/dbraw/zinc/64/33/48/792643348.db2.gz YIPIKGYCBLWXQS-UPJWGTAASA-N 0 3 360.480 -1.160 20 0 FAADHN CCN1CCO[C@@H](C(=O)NC[C@@H]2CN(CC(=O)NC(N)=O)C[C@H]2C)C1 ZINC001102588717 792642903 /nfs/dbraw/zinc/64/29/03/792642903.db2.gz KOTXNKLVIYAIJZ-JHJVBQTASA-N 0 3 355.439 -1.414 20 0 FAADHN CCN1CCO[C@H](C(=O)NC[C@@H]2CN(CC(=O)NC(N)=O)C[C@H]2C)C1 ZINC001102588718 792643668 /nfs/dbraw/zinc/64/36/68/792643668.db2.gz KOTXNKLVIYAIJZ-UPJWGTAASA-N 0 3 355.439 -1.414 20 0 FAADHN C[C@@H]1CN([C@@H]2CCNC2=O)C[C@H]1CNC(=O)CCS(=O)(=O)N(C)C ZINC001102593770 792643720 /nfs/dbraw/zinc/64/37/20/792643720.db2.gz LEGHTZMBDUTWTE-JHJVBQTASA-N 0 3 360.480 -1.160 20 0 FAADHN C[C@@H]1CN([C@H]2CCNC2=O)C[C@H]1CNC(=O)CCS(=O)(=O)N(C)C ZINC001102593771 792643181 /nfs/dbraw/zinc/64/31/81/792643181.db2.gz LEGHTZMBDUTWTE-UPJWGTAASA-N 0 3 360.480 -1.160 20 0 FAADHN C[C@@H](C(N)=O)N1C[C@@H](CNC(=O)CNC(=O)Cn2cncn2)[C@H](C)C1 ZINC001102596463 792643447 /nfs/dbraw/zinc/64/34/47/792643447.db2.gz HEFFSZIODBBLNH-GRYCIOLGSA-N 0 3 351.411 -2.048 20 0 FAADHN C[C@H](C(N)=O)N1C[C@@H](CNC(=O)CNC(=O)Cn2cncn2)[C@H](C)C1 ZINC001102596464 792642847 /nfs/dbraw/zinc/64/28/47/792642847.db2.gz HEFFSZIODBBLNH-IJLUTSLNSA-N 0 3 351.411 -2.048 20 0 FAADHN C[C@@H]1CN(CC(=O)N2CCC2)C[C@H]1CNC(=O)C[C@H]1CC(=O)NC1=O ZINC001102622816 792644590 /nfs/dbraw/zinc/64/45/90/792644590.db2.gz JMFKJKCQTKTUOT-FRRDWIJNSA-N 0 3 350.419 -1.044 20 0 FAADHN C[C@@H]1CN(CC(=O)N2CCC2)C[C@H]1CNC(=O)C[C@@H]1CC(=O)NC1=O ZINC001102622817 792644637 /nfs/dbraw/zinc/64/46/37/792644637.db2.gz JMFKJKCQTKTUOT-JHJVBQTASA-N 0 3 350.419 -1.044 20 0 FAADHN CCOCCNC(=O)CN1C[C@@H](C)[C@H](CCNC(=O)CNC(N)=O)C1 ZINC001102655114 792644249 /nfs/dbraw/zinc/64/42/49/792644249.db2.gz RAQMOLUOWQDNQT-CHWSQXEVSA-N 0 3 357.455 -1.118 20 0 FAADHN CCS(=O)(=O)NCCN1C[C@@H](C)[C@H](CCNC(=O)CNC(N)=O)C1 ZINC001102655137 792644186 /nfs/dbraw/zinc/64/41/86/792644186.db2.gz RYPYFOJVXHWOIA-VXGBXAGGSA-N 0 3 363.484 -1.332 20 0 FAADHN C[C@@H]1CN(CC(=O)N2CCOCC2)C[C@H]1CCNC(=O)CNC(N)=O ZINC001102655194 792644001 /nfs/dbraw/zinc/64/40/01/792644001.db2.gz VAYJHFZEHQTXFL-CHWSQXEVSA-N 0 3 355.439 -1.412 20 0 FAADHN COCCCNC(=O)CN1C[C@@H](C)[C@H](CCNC(=O)CNC(N)=O)C1 ZINC001102655233 792645147 /nfs/dbraw/zinc/64/51/47/792645147.db2.gz WWXHLSCHKSXPMN-CHWSQXEVSA-N 0 3 357.455 -1.118 20 0 FAADHN CCNC(=O)NC(=O)CN1C[C@@H](C)[C@H](CCNC(=O)CNC(N)=O)C1 ZINC001102655247 792644522 /nfs/dbraw/zinc/64/45/22/792644522.db2.gz XIJSBMJJFAZWAM-GHMZBOCLSA-N 0 3 356.427 -1.425 20 0 FAADHN CNC(=O)NC(=O)[C@@H](C)N1C[C@@H](C)[C@H](CCNC(=O)CNC(N)=O)C1 ZINC001102655455 792644845 /nfs/dbraw/zinc/64/48/45/792644845.db2.gz HGTPQXGDEZIDJL-GMTAPVOTSA-N 0 3 356.427 -1.427 20 0 FAADHN CNC(=O)NC(=O)[C@H](C)N1C[C@@H](C)[C@H](CCNC(=O)CNC(N)=O)C1 ZINC001102655456 792644717 /nfs/dbraw/zinc/64/47/17/792644717.db2.gz HGTPQXGDEZIDJL-OUAUKWLOSA-N 0 3 356.427 -1.427 20 0 FAADHN CNC(=O)NC(=O)CN1C[C@@H](C)[C@H](CCNC(=O)Cn2cnnn2)C1 ZINC001102656456 792645050 /nfs/dbraw/zinc/64/50/50/792645050.db2.gz BAVAMPMFKSOKGG-GHMZBOCLSA-N 0 3 352.399 -1.797 20 0 FAADHN C[C@@H]1CN(CC(=O)NC(N)=O)C[C@H]1CCNC(=O)CN1CCCC1=O ZINC001102657264 792644445 /nfs/dbraw/zinc/64/44/45/792644445.db2.gz IRGSADDDVQBDOP-VXGBXAGGSA-N 0 3 353.423 -1.122 20 0 FAADHN C[C@H](C(=O)NC(N)=O)N1C[C@@H](C)[C@H](CCNC(=O)Cn2cnnn2)C1 ZINC001102657398 792644054 /nfs/dbraw/zinc/64/40/54/792644054.db2.gz OSAQMGTXJWEJMI-GMTAPVOTSA-N 0 3 352.399 -1.669 20 0 FAADHN C[C@@H](C(=O)NC(N)=O)N1C[C@@H](C)[C@H](CCNC(=O)Cn2cnnn2)C1 ZINC001102657399 792645070 /nfs/dbraw/zinc/64/50/70/792645070.db2.gz OSAQMGTXJWEJMI-OUAUKWLOSA-N 0 3 352.399 -1.669 20 0 FAADHN C[C@@H]1CN(CCNS(C)(=O)=O)C[C@H]1CCNC(=O)Cn1cnnn1 ZINC001102657610 792644163 /nfs/dbraw/zinc/64/41/63/792644163.db2.gz ZQFSPLYJALTAJH-VXGBXAGGSA-N 0 3 359.456 -1.704 20 0 FAADHN C[C@@H]1CN(CC(=O)NC(N)=O)C[C@H]1CCNC(=O)CCn1cncn1 ZINC001102672070 792645008 /nfs/dbraw/zinc/64/50/08/792645008.db2.gz LFCRTRTVJGRMTA-VXGBXAGGSA-N 0 3 351.411 -1.063 20 0 FAADHN CNC(=O)NC(=O)CN1C[C@@H](C)[C@H](CCNC(=O)CN(C)C(C)=O)C1 ZINC001102677799 792644205 /nfs/dbraw/zinc/64/42/05/792644205.db2.gz GMCSQSWIMSWOLH-DGCLKSJQSA-N 0 3 355.439 -1.006 20 0 FAADHN CNC(=O)NC(=O)CN1C[C@@H](C)[C@H](CCNC(=O)[C@H]2COCCO2)C1 ZINC001102685187 792644132 /nfs/dbraw/zinc/64/41/32/792644132.db2.gz XLNWLMKBBHNNOR-JHJVBQTASA-N 0 3 356.423 -1.068 20 0 FAADHN CNC(=O)NC(=O)CN1C[C@@H](C)[C@H](CCNC(=O)[C@@H]2COCCO2)C1 ZINC001102685188 792644275 /nfs/dbraw/zinc/64/42/75/792644275.db2.gz XLNWLMKBBHNNOR-UPJWGTAASA-N 0 3 356.423 -1.068 20 0 FAADHN C[C@@H]1CN(CC(=O)NC(N)=O)C[C@H]1CCNC(=O)CNC(=O)C1CC1 ZINC001102707612 792644077 /nfs/dbraw/zinc/64/40/77/792644077.db2.gz YGIAGLFDJQZDJC-ZYHUDNBSSA-N 0 3 353.423 -1.218 20 0 FAADHN CNC(=O)NC(=O)CN1C[C@@H](C)[C@H](CCNC(=O)CNC(=O)OC)C1 ZINC001102716778 792645032 /nfs/dbraw/zinc/64/50/32/792645032.db2.gz NMDNEZUBFYTCFE-GHMZBOCLSA-N 0 3 357.411 -1.128 20 0 FAADHN COC(=O)NCC(=O)NCC[C@@H]1CN(CCNS(C)(=O)=O)C[C@H]1C ZINC001102717008 792645127 /nfs/dbraw/zinc/64/51/27/792645127.db2.gz YBFKAXQFKLOPAR-VXGBXAGGSA-N 0 3 364.468 -1.034 20 0 FAADHN C[C@@H]1CN(CCNS(C)(=O)=O)C[C@H]1CCNC(=O)[C@H]1CCC(=O)N1 ZINC001102777325 792646515 /nfs/dbraw/zinc/64/65/15/792646515.db2.gz FXXSZSDTDWLFAF-JHJVBQTASA-N 0 3 360.480 -1.112 20 0 FAADHN CNC(=O)NC(=O)CN1C[C@@H](C)[C@H](CCNC(=O)[C@H]2CCC(=O)N2)C1 ZINC001102777551 792645772 /nfs/dbraw/zinc/64/57/72/792645772.db2.gz QTSHBWCTHVKQMK-IJLUTSLNSA-N 0 3 353.423 -1.205 20 0 FAADHN C[C@@H]1CN(CC(=O)NC(=O)NC2CC2)C[C@H]1CCNC(=O)CC(N)=O ZINC001102801967 792645363 /nfs/dbraw/zinc/64/53/63/792645363.db2.gz NDGIEPBXBZRVGB-GHMZBOCLSA-N 0 3 353.423 -1.076 20 0 FAADHN C[C@@H]1CN(CC(=O)NC(N)=O)C[C@H]1CCNC(=O)[C@H]1CN(C)CCO1 ZINC001102818808 792645569 /nfs/dbraw/zinc/64/55/69/792645569.db2.gz IARPHQFBQNSNIJ-JHJVBQTASA-N 0 3 355.439 -1.414 20 0 FAADHN C[C@@H]1CN(CC(=O)NC(N)=O)C[C@H]1CCNC(=O)[C@@H]1CN(C)CCO1 ZINC001102818809 792646188 /nfs/dbraw/zinc/64/61/88/792646188.db2.gz IARPHQFBQNSNIJ-UPJWGTAASA-N 0 3 355.439 -1.414 20 0 FAADHN C[C@@H]1CN(CC(=O)NC(N)=O)C[C@H]1CCNC(=O)[C@H]1CCNC(=O)C1 ZINC001102855036 792645306 /nfs/dbraw/zinc/64/53/06/792645306.db2.gz FXGNLGZPYXLECA-GRYCIOLGSA-N 0 3 353.423 -1.218 20 0 FAADHN C[C@@H]1CN(CC(=O)NC(N)=O)C[C@H]1CCNC(=O)[C@@H]1CCNC(=O)C1 ZINC001102855037 792646473 /nfs/dbraw/zinc/64/64/73/792646473.db2.gz FXGNLGZPYXLECA-IJLUTSLNSA-N 0 3 353.423 -1.218 20 0 FAADHN C[C@@H]1CN(CC(=O)NC(N)=O)C[C@H]1CCNC(=O)CN1CCOCC1 ZINC001102879799 792646409 /nfs/dbraw/zinc/64/64/09/792646409.db2.gz OHDQONGTMXXXJE-CHWSQXEVSA-N 0 3 355.439 -1.412 20 0 FAADHN C[C@@H]1CN(CC(=O)NC(N)=O)C[C@H]1CCNC(=O)[C@H]1COCCN1C ZINC001102883514 792645800 /nfs/dbraw/zinc/64/58/00/792645800.db2.gz UYKQEKHGSXZXKT-JHJVBQTASA-N 0 3 355.439 -1.414 20 0 FAADHN C[C@@H]1CN(CC(=O)NC(N)=O)C[C@H]1CCNC(=O)[C@@H]1COCCN1C ZINC001102883515 792646059 /nfs/dbraw/zinc/64/60/59/792646059.db2.gz UYKQEKHGSXZXKT-UPJWGTAASA-N 0 3 355.439 -1.414 20 0 FAADHN C[C@@H]1CN(CC(=O)NC(N)=O)C[C@H]1CCNC(=O)CN1CN=NC1=O ZINC001102889786 792645485 /nfs/dbraw/zinc/64/54/85/792645485.db2.gz RTXJEROTHVGASR-NXEZZACHSA-N 0 3 353.383 -1.747 20 0 FAADHN C[C@@H]1CN(CC(=O)NC(N)=O)C[C@H]1CCNC(=O)c1cnn(C)c1N ZINC001102893173 792646233 /nfs/dbraw/zinc/64/62/33/792646233.db2.gz FIXCDRTUUWEJHM-NXEZZACHSA-N 0 3 351.411 -1.115 20 0 FAADHN CNC(=O)NC(=O)CN1C[C@@H](C)[C@H](CCNC(=O)[C@H](C)NC(N)=O)C1 ZINC001102904928 792645832 /nfs/dbraw/zinc/64/58/32/792645832.db2.gz BHBXJDZDAOUOHX-OUAUKWLOSA-N 0 3 356.427 -1.427 20 0 FAADHN C[C@H](NC(N)=O)C(=O)NCC[C@@H]1CN(CCNS(C)(=O)=O)C[C@H]1C ZINC001102906502 792645998 /nfs/dbraw/zinc/64/59/98/792645998.db2.gz NNGBUWKKYBOPSW-GRYCIOLGSA-N 0 3 363.484 -1.333 20 0 FAADHN C[C@@H]1CN(CC(=O)NC(N)=O)C[C@H]1CCNC(=O)CCn1ccnn1 ZINC001102914757 792646488 /nfs/dbraw/zinc/64/64/88/792646488.db2.gz FEUFIBOGPLPAGF-VXGBXAGGSA-N 0 3 351.411 -1.063 20 0 FAADHN CC(=O)N1CC(C(=O)NCC[C@@H]2CN(CC(=O)NC(N)=O)C[C@H]2C)C1 ZINC001102915183 792646086 /nfs/dbraw/zinc/64/60/86/792646086.db2.gz SWCFGFVFFAMOTE-ZYHUDNBSSA-N 0 3 353.423 -1.266 20 0 FAADHN C[C@@H]1CN(CC(=O)NC(N)=O)C[C@H]1CCNC(=O)c1cc(=O)n(C)o1 ZINC001102915540 792646424 /nfs/dbraw/zinc/64/64/24/792646424.db2.gz HCKUFEYDVUGINO-NXEZZACHSA-N 0 3 353.379 -1.139 20 0 FAADHN CNC(=O)NC(=O)CN1C[C@@H](C)[C@H](CCNC(=O)c2cnnn2C)C1 ZINC001102934425 792645738 /nfs/dbraw/zinc/64/57/38/792645738.db2.gz ZDBIYVWZLWUVSW-GHMZBOCLSA-N 0 3 351.411 -1.042 20 0 FAADHN CNC(=O)NC(=O)CN1C[C@@H](C)[C@H](CCNC(=O)[C@H]2COC(=O)N2)C1 ZINC001102936279 792646250 /nfs/dbraw/zinc/64/62/50/792646250.db2.gz DJSVTINHSJGOMQ-GMTAPVOTSA-N 0 3 355.395 -1.375 20 0 FAADHN CNC(=O)NC(=O)CN1C[C@@H](C)[C@H](CCNC(=O)[C@@H]2COC(=O)N2)C1 ZINC001102936283 792645642 /nfs/dbraw/zinc/64/56/42/792645642.db2.gz DJSVTINHSJGOMQ-MXWKQRLJSA-N 0 3 355.395 -1.375 20 0 FAADHN C[C@@H]1CN(CCNS(C)(=O)=O)C[C@H]1CCNC(=O)[C@H]1COC(=O)N1 ZINC001102936485 792646440 /nfs/dbraw/zinc/64/64/40/792646440.db2.gz HYFSVWPDVNPKBJ-IJLUTSLNSA-N 0 3 362.452 -1.282 20 0 FAADHN C[C@@H]1CN(CCNS(C)(=O)=O)C[C@H]1CCNC(=O)[C@@H]1COC(=O)N1 ZINC001102936486 792645432 /nfs/dbraw/zinc/64/54/32/792645432.db2.gz HYFSVWPDVNPKBJ-UTUOFQBUSA-N 0 3 362.452 -1.282 20 0 FAADHN CNC(=O)NC(=O)CN1C[C@@H](C)[C@H](CCNC(=O)c2cn(C)nn2)C1 ZINC001102943714 792646378 /nfs/dbraw/zinc/64/63/78/792646378.db2.gz DTNKXQPIVRGHII-GHMZBOCLSA-N 0 3 351.411 -1.042 20 0 FAADHN CNC(=O)NC(=O)CN1C[C@@H](C)[C@H](CCNC(=O)c2ncn(C)n2)C1 ZINC001102945637 792645343 /nfs/dbraw/zinc/64/53/43/792645343.db2.gz AMSFERKGHVXVFR-GHMZBOCLSA-N 0 3 351.411 -1.042 20 0 FAADHN CNC(=O)NCCC(=O)NCC[C@@H]1CN(CC(=O)NC(N)=O)C[C@H]1C ZINC001102948715 792646037 /nfs/dbraw/zinc/64/60/37/792646037.db2.gz SQKYSBJQIPMCNQ-GHMZBOCLSA-N 0 3 356.427 -1.425 20 0 FAADHN C[C@@H]1CN(CC(N)=O)C[C@H]1CCNC(=O)CN(C)S(=O)(=O)N(C)C ZINC001102975289 792646114 /nfs/dbraw/zinc/64/61/14/792646114.db2.gz LBULIYAAVYFCIO-VXGBXAGGSA-N 0 3 363.484 -1.716 20 0 FAADHN C[C@H](CC(=O)NCC[C@@H]1CN(CC(=O)NC(N)=O)C[C@H]1C)NC(N)=O ZINC001102979002 792646312 /nfs/dbraw/zinc/64/63/12/792646312.db2.gz QBFOTNYDGUDSJT-GMTAPVOTSA-N 0 3 356.427 -1.298 20 0 FAADHN C[C@@H](CC(=O)NCC[C@@H]1CN(CC(=O)NC(N)=O)C[C@H]1C)NC(N)=O ZINC001102979003 792645967 /nfs/dbraw/zinc/64/59/67/792645967.db2.gz QBFOTNYDGUDSJT-OUAUKWLOSA-N 0 3 356.427 -1.298 20 0 FAADHN CNC(=O)NC(=O)CN1C[C@@H](C)[C@H](CCNC(=O)Cn2ncnn2)C1 ZINC001102991652 792646282 /nfs/dbraw/zinc/64/62/82/792646282.db2.gz VVEUHDXGPFMLLK-GHMZBOCLSA-N 0 3 352.399 -1.797 20 0 FAADHN C[C@H](C(=O)NC(N)=O)N1C[C@@H](C)[C@H](CCNC(=O)Cn2ncnn2)C1 ZINC001102992903 792646352 /nfs/dbraw/zinc/64/63/52/792646352.db2.gz KJDKAVDHVOAWBC-GMTAPVOTSA-N 0 3 352.399 -1.669 20 0 FAADHN C[C@@H](C(=O)NC(N)=O)N1C[C@@H](C)[C@H](CCNC(=O)Cn2ncnn2)C1 ZINC001102992904 792645860 /nfs/dbraw/zinc/64/58/60/792645860.db2.gz KJDKAVDHVOAWBC-OUAUKWLOSA-N 0 3 352.399 -1.669 20 0 FAADHN C[C@@H]1CN(CCNS(C)(=O)=O)C[C@H]1CCNC(=O)Cn1ncnn1 ZINC001102993169 792645703 /nfs/dbraw/zinc/64/57/03/792645703.db2.gz ZVAVVDWRCOUCAK-VXGBXAGGSA-N 0 3 359.456 -1.704 20 0 FAADHN CNC(=O)CN1C[C@@H](C)[C@H](CCNC(=O)Cn2cnc(C(N)=O)n2)C1 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CCCNC(=O)CN[C@@H]1C[C@]2(CN(C(=O)C(N)=O)[C@@H]2C(C)C)C[C@H]1O ZINC001105652367 790404258 /nfs/dbraw/zinc/40/42/58/790404258.db2.gz LKTJIKYJCYCUCF-CTWCOEIASA-N 0 3 354.451 -1.036 20 0 FAADHN CCCNC(=O)CN[C@@H]1C[C@@]2(CN(C(=O)C(N)=O)[C@@H]2C(C)C)C[C@H]1O ZINC001105652368 790404191 /nfs/dbraw/zinc/40/41/91/790404191.db2.gz LKTJIKYJCYCUCF-LGIULTMTSA-N 0 3 354.451 -1.036 20 0 FAADHN CCCNC(=O)CN[C@@H]1C[C@@]2(CN(C(=O)C(N)=O)[C@H]2C(C)C)C[C@H]1O ZINC001105652369 790404226 /nfs/dbraw/zinc/40/42/26/790404226.db2.gz LKTJIKYJCYCUCF-WOKLECCJSA-N 0 3 354.451 -1.036 20 0 FAADHN CC(C)[C@@H]1N(C(=O)C(N)=O)C[C@@]12C[C@@H](O)[C@H](NCC(=O)NC1CC1)C2 ZINC001105653346 790404061 /nfs/dbraw/zinc/40/40/61/790404061.db2.gz UMMQEOMGSLENMK-ALYFQZSWSA-N 0 3 352.435 -1.284 20 0 FAADHN CC(C)[C@H]1N(C(=O)C(N)=O)C[C@@]12C[C@@H](O)[C@H](NCC(=O)NC1CC1)C2 ZINC001105653347 790403991 /nfs/dbraw/zinc/40/39/91/790403991.db2.gz UMMQEOMGSLENMK-CTWCOEIASA-N 0 3 352.435 -1.284 20 0 FAADHN CC(C)[C@H]1N(C(=O)C(N)=O)C[C@]12C[C@@H](O)[C@H](NCC(=O)NC1CC1)C2 ZINC001105653348 790403969 /nfs/dbraw/zinc/40/39/69/790403969.db2.gz UMMQEOMGSLENMK-LGIULTMTSA-N 0 3 352.435 -1.284 20 0 FAADHN CC(C)[C@@H]1N(C(=O)C(N)=O)C[C@]12C[C@@H](O)[C@H](NCC(=O)NC1CC1)C2 ZINC001105653349 790404154 /nfs/dbraw/zinc/40/41/54/790404154.db2.gz UMMQEOMGSLENMK-WOKLECCJSA-N 0 3 352.435 -1.284 20 0 FAADHN CC(C)[C@H]1N(C(=O)C(N)=O)C[C@]12C[C@@H](O)[C@H](NCCS(C)(=O)=O)C2 ZINC001105653638 790405344 /nfs/dbraw/zinc/40/53/44/790405344.db2.gz YADIATXDNVYCJI-BLTAXRJOSA-N 0 3 361.464 -1.518 20 0 FAADHN CC(C)[C@@H]1N(C(=O)C(N)=O)C[C@]12C[C@@H](O)[C@H](NCCS(C)(=O)=O)C2 ZINC001105653639 790405285 /nfs/dbraw/zinc/40/52/85/790405285.db2.gz YADIATXDNVYCJI-FJJYHAOUSA-N 0 3 361.464 -1.518 20 0 FAADHN CC(C)[C@@H]1N(C(=O)C(N)=O)C[C@@]12C[C@@H](O)[C@H](NCCS(C)(=O)=O)C2 ZINC001105653640 790405127 /nfs/dbraw/zinc/40/51/27/790405127.db2.gz YADIATXDNVYCJI-MCYUEQNJSA-N 0 3 361.464 -1.518 20 0 FAADHN CC(C)[C@H]1N(C(=O)C(N)=O)C[C@@]12C[C@@H](O)[C@H](NCCS(C)(=O)=O)C2 ZINC001105653641 790405119 /nfs/dbraw/zinc/40/51/19/790405119.db2.gz YADIATXDNVYCJI-RTWAVKEYSA-N 0 3 361.464 -1.518 20 0 FAADHN CCN(C)C(=O)CN[C@@H]1C[C@]2(CN(C(=O)C(N)=O)[C@H]2C(C)C)C[C@H]1O ZINC001105653666 790405338 /nfs/dbraw/zinc/40/53/38/790405338.db2.gz YQHJJSRVDZNXDY-ALYFQZSWSA-N 0 3 354.451 -1.084 20 0 FAADHN CCN(C)C(=O)CN[C@@H]1C[C@]2(CN(C(=O)C(N)=O)[C@@H]2C(C)C)C[C@H]1O ZINC001105653667 790405331 /nfs/dbraw/zinc/40/53/31/790405331.db2.gz YQHJJSRVDZNXDY-CTWCOEIASA-N 0 3 354.451 -1.084 20 0 FAADHN CCN(C)C(=O)CN[C@@H]1C[C@@]2(CN(C(=O)C(N)=O)[C@@H]2C(C)C)C[C@H]1O ZINC001105653668 790405366 /nfs/dbraw/zinc/40/53/66/790405366.db2.gz YQHJJSRVDZNXDY-LGIULTMTSA-N 0 3 354.451 -1.084 20 0 FAADHN CCN(C)C(=O)CN[C@@H]1C[C@@]2(CN(C(=O)C(N)=O)[C@H]2C(C)C)C[C@H]1O ZINC001105653669 790405353 /nfs/dbraw/zinc/40/53/53/790405353.db2.gz YQHJJSRVDZNXDY-WOKLECCJSA-N 0 3 354.451 -1.084 20 0 FAADHN CC(C)[C@@H]1N(C(=O)C(N)=O)C[C@@]12C[C@@H](O)[C@H](NCC(=O)NC(N)=O)C2 ZINC001105653686 790405106 /nfs/dbraw/zinc/40/51/06/790405106.db2.gz YXWMQEFPSFDYMB-LIEMUPCESA-N 0 3 355.395 -2.367 20 0 FAADHN CC(C)[C@H]1N(C(=O)C(N)=O)C[C@]12C[C@@H](O)[C@H](NCC(=O)NC(N)=O)C2 ZINC001105653687 790405211 /nfs/dbraw/zinc/40/52/11/790405211.db2.gz YXWMQEFPSFDYMB-QFKQNQDGSA-N 0 3 355.395 -2.367 20 0 FAADHN CC(C)[C@@H]1N(C(=O)C(N)=O)C[C@]12C[C@@H](O)[C@H](NCC(=O)NC(N)=O)C2 ZINC001105653688 790405267 /nfs/dbraw/zinc/40/52/67/790405267.db2.gz YXWMQEFPSFDYMB-VKQTUNLWSA-N 0 3 355.395 -2.367 20 0 FAADHN CC(C)[C@H]1N(C(=O)C(N)=O)C[C@@]12C[C@@H](O)[C@H](NCC(=O)NC(N)=O)C2 ZINC001105653689 790405189 /nfs/dbraw/zinc/40/51/89/790405189.db2.gz YXWMQEFPSFDYMB-XBMUNGEKSA-N 0 3 355.395 -2.367 20 0 FAADHN CC(C)[C@H]1N(C(=O)CC(=O)N(C)C)C[C@]12C[C@@H](O)[C@H](NCC(N)=O)C2 ZINC001105660981 790406981 /nfs/dbraw/zinc/40/69/81/790406981.db2.gz CAKKBOSEJASBPW-SKNMWMDOSA-N 0 3 354.451 -1.084 20 0 FAADHN CC(C)[C@@H]1N(C(=O)CC(=O)N(C)C)C[C@]12C[C@@H](O)[C@H](NCC(N)=O)C2 ZINC001105660982 790407405 /nfs/dbraw/zinc/40/74/05/790407405.db2.gz CAKKBOSEJASBPW-UDVXPWBQSA-N 0 3 354.451 -1.084 20 0 FAADHN CC(C)[C@H]1N(C(=O)CC(=O)N(C)C)C[C@@]12C[C@@H](O)[C@H](NCC(N)=O)C2 ZINC001105660983 790406954 /nfs/dbraw/zinc/40/69/54/790406954.db2.gz CAKKBOSEJASBPW-YLGOIMDESA-N 0 3 354.451 -1.084 20 0 FAADHN CC(C)[C@@H]1N(C(=O)CC(=O)N(C)C)C[C@@]12C[C@@H](O)[C@H](NCC(N)=O)C2 ZINC001105660984 790406915 /nfs/dbraw/zinc/40/69/15/790406915.db2.gz CAKKBOSEJASBPW-YQPCPPDFSA-N 0 3 354.451 -1.084 20 0 FAADHN CC(C)[C@H]1N(C(=O)CCNC(N)=O)C[C@]12C[C@@H](O)[C@H](NCC(N)=O)C2 ZINC001105668132 790409331 /nfs/dbraw/zinc/40/93/31/790409331.db2.gz HXMYJDBGNVYBEA-JDOCFBBISA-N 0 3 355.439 -1.504 20 0 FAADHN CC(C)[C@H]1N(C(=O)CCNC(N)=O)C[C@@]12C[C@@H](O)[C@H](NCC(N)=O)C2 ZINC001105668133 790409882 /nfs/dbraw/zinc/40/98/82/790409882.db2.gz HXMYJDBGNVYBEA-MMYVAXCBSA-N 0 3 355.439 -1.504 20 0 FAADHN CC(C)[C@@H]1N(C(=O)CCNC(N)=O)C[C@@]12C[C@@H](O)[C@H](NCC(N)=O)C2 ZINC001105668134 790409142 /nfs/dbraw/zinc/40/91/42/790409142.db2.gz HXMYJDBGNVYBEA-TWINXVHLSA-N 0 3 355.439 -1.504 20 0 FAADHN CC(C)[C@@H]1N(C(=O)CCNC(N)=O)C[C@]12C[C@@H](O)[C@H](NCC(N)=O)C2 ZINC001105668135 790409412 /nfs/dbraw/zinc/40/94/12/790409412.db2.gz HXMYJDBGNVYBEA-XYJYNPGVSA-N 0 3 355.439 -1.504 20 0 FAADHN C[C@@H]1CN(C(=O)Cn2cnnn2)C[C@H]1CNCC(=O)Nc1nncs1 ZINC001105805153 790420543 /nfs/dbraw/zinc/42/05/43/790420543.db2.gz OBABPNYMTLZZKU-NXEZZACHSA-N 0 3 365.423 -1.153 20 0 FAADHN C[C@@H]1CN(C(=O)CNC(N)=O)C[C@H]1CNCC(=O)Nc1nncs1 ZINC001105811164 790422164 /nfs/dbraw/zinc/42/21/64/790422164.db2.gz QNHZJKKIFAPZPE-RKDXNWHRSA-N 0 3 355.424 -1.171 20 0 FAADHN CNC(=O)NC(=O)C[NH2+]C[C@@H]1CN(C(=O)CCc2nnc[n-]2)C[C@H]1C ZINC001105990643 790426232 /nfs/dbraw/zinc/42/62/32/790426232.db2.gz RBRQUWZZWADGBS-GHMZBOCLSA-N 0 3 351.411 -1.123 20 0 FAADHN CNS(=O)(=O)CCC(=O)N1C[C@@H](CNCc2cn(C)nn2)[C@H](C)C1 ZINC001106123443 790440128 /nfs/dbraw/zinc/44/01/28/790440128.db2.gz UBCPNERFIHOKMB-VXGBXAGGSA-N 0 3 358.468 -1.062 20 0 FAADHN C[C@@H]1CN(C(=O)Cn2ncnn2)C[C@H]1CNCC(=O)Nc1nncs1 ZINC001106136212 790445246 /nfs/dbraw/zinc/44/52/46/790445246.db2.gz XAOLAIPCURMGIG-NXEZZACHSA-N 0 3 365.423 -1.153 20 0 FAADHN CCS(=O)(=O)NCC(=O)N1C[C@@H](CNCc2cn(C)nn2)[C@H](C)C1 ZINC001106202746 790448592 /nfs/dbraw/zinc/44/85/92/790448592.db2.gz CGSMDJWLUXCZPU-VXGBXAGGSA-N 0 3 358.468 -1.062 20 0 FAADHN C[C@@H]1CN(C(=O)CCNS(C)(=O)=O)C[C@H]1CNCc1cn(C)nn1 ZINC001106204159 790449610 /nfs/dbraw/zinc/44/96/10/790449610.db2.gz HSMSHAPATWEZAJ-VXGBXAGGSA-N 0 3 358.468 -1.062 20 0 FAADHN C[C@@H]1CN(C(=O)CN(C)S(C)(=O)=O)C[C@H]1CNCc1cn(C)nn1 ZINC001106204493 790449505 /nfs/dbraw/zinc/44/95/05/790449505.db2.gz WSGDZUQVLDVZKB-VXGBXAGGSA-N 0 3 358.468 -1.109 20 0 FAADHN CNC(=O)NC(=O)C[NH2+]C[C@@H]1CN(C(=O)c2cnc[n-]c2=O)C[C@H]1C ZINC001106296914 790453011 /nfs/dbraw/zinc/45/30/11/790453011.db2.gz JZCBHAGQTQGWMD-NXEZZACHSA-N 0 3 350.379 -1.065 20 0 FAADHN CC(=O)NCC(=O)NCC(=O)N1C[C@@H](CNCc2cnns2)[C@H](C)C1 ZINC001106332522 790453973 /nfs/dbraw/zinc/45/39/73/790453973.db2.gz LRUCQZFFTOMDIF-ZYHUDNBSSA-N 0 3 368.463 -1.026 20 0 FAADHN CNS(=O)(=O)NCC(=O)N1C[C@@H](CNCc2nnc(C)[nH]2)[C@H](C)C1 ZINC001106479924 790457498 /nfs/dbraw/zinc/45/74/98/790457498.db2.gz XQESMYVPYTVABL-MWLCHTKSSA-N 0 3 359.456 -1.649 20 0 FAADHN CNS(=O)(=O)NCC(=O)N1C[C@@H](CNCc2cnns2)[C@H](C)C1 ZINC001106481822 790457087 /nfs/dbraw/zinc/45/70/87/790457087.db2.gz XHZWKCBLCHMAOI-NXEZZACHSA-N 0 3 362.481 -1.224 20 0 FAADHN CNS(=O)(=O)NCC(=O)N1C[C@@H](CNCc2ccn(C)n2)[C@H](C)C1 ZINC001106482047 790457461 /nfs/dbraw/zinc/45/74/61/790457461.db2.gz CUCUUFDBMMBNSS-VXGBXAGGSA-N 0 3 358.468 -1.342 20 0 FAADHN CNS(=O)(=O)NCC(=O)N1C[C@@H](CNCc2nccn2C)[C@H](C)C1 ZINC001106482267 790458386 /nfs/dbraw/zinc/45/83/86/790458386.db2.gz FVOCEQSZXVLGNZ-VXGBXAGGSA-N 0 3 358.468 -1.342 20 0 FAADHN CNS(=O)(=O)NCC(=O)N1C[C@@H](CNCc2cn(C)nn2)[C@H](C)C1 ZINC001106482934 790457285 /nfs/dbraw/zinc/45/72/85/790457285.db2.gz OZXHHNDEMWEAAG-GHMZBOCLSA-N 0 3 359.456 -1.947 20 0 FAADHN C[C@@H]1CN(C(=O)c2nnn(C)n2)C[C@H]1CNCC(=O)Nc1nncs1 ZINC001106545852 790459666 /nfs/dbraw/zinc/45/96/66/790459666.db2.gz LMEROYATIMMSQM-RKDXNWHRSA-N 0 3 365.423 -1.002 20 0 FAADHN Cc1nc[n-]c(=O)c1C(=O)N1C[C@@H](C[NH2+]CC(=O)NC(N)=O)[C@H](C)C1 ZINC001106567139 790460058 /nfs/dbraw/zinc/46/00/58/790460058.db2.gz XDHBSFRAYJGPRU-PSASIEDQSA-N 0 3 350.379 -1.017 20 0 FAADHN C[C@@H]1CN(C(=O)[C@@H]2CNC(=O)N2)C[C@H]1CNCC(=O)Nc1nncs1 ZINC001106601812 790461186 /nfs/dbraw/zinc/46/11/86/790461186.db2.gz FCMRYCACSJXTNH-BBBLOLIVSA-N 0 3 367.435 -1.158 20 0 FAADHN C[C@@H]1CN(C(=O)[C@H]2CNC(=O)N2)C[C@H]1CNCC(=O)Nc1nncs1 ZINC001106601813 790461200 /nfs/dbraw/zinc/46/12/00/790461200.db2.gz FCMRYCACSJXTNH-OPRDCNLKSA-N 0 3 367.435 -1.158 20 0 FAADHN CNC(=O)C[NH2+]C[C@@H]1CN(C(=O)c2c[n-]nc2S(N)(=O)=O)C[C@H]1C ZINC001106652692 790462154 /nfs/dbraw/zinc/46/21/54/790462154.db2.gz DTQUNSUDNYTRHV-RKDXNWHRSA-N 0 3 358.424 -1.899 20 0 FAADHN C[C@H]([NH2+]C[C@@H]1CN(C(=O)c2c[n-]nc2S(N)(=O)=O)C[C@H]1C)C(N)=O ZINC001106653081 790462365 /nfs/dbraw/zinc/46/23/65/790462365.db2.gz XGUPSPHSQPZEJD-HRDYMLBCSA-N 0 3 358.424 -1.771 20 0 FAADHN C[C@@H]([NH2+]C[C@@H]1CN(C(=O)c2c[n-]nc2S(N)(=O)=O)C[C@H]1C)C(N)=O ZINC001106653082 790462053 /nfs/dbraw/zinc/46/20/53/790462053.db2.gz XGUPSPHSQPZEJD-IWSPIJDZSA-N 0 3 358.424 -1.771 20 0 FAADHN C[C@H](NS(C)(=O)=O)C(=O)N1C[C@@H](CNCc2cn(C)nn2)[C@H](C)C1 ZINC001106703697 790464695 /nfs/dbraw/zinc/46/46/95/790464695.db2.gz USIXIQXOTDAOLB-GRYCIOLGSA-N 0 3 358.468 -1.063 20 0 FAADHN C[C@@H](NS(C)(=O)=O)C(=O)N1C[C@@H](CNCc2cn(C)nn2)[C@H](C)C1 ZINC001106703698 790464367 /nfs/dbraw/zinc/46/43/67/790464367.db2.gz USIXIQXOTDAOLB-IJLUTSLNSA-N 0 3 358.468 -1.063 20 0 FAADHN C[C@@H]1CN(C(=O)CS(=O)(=O)N(C)C)C[C@H]1CNCc1cn(C)nn1 ZINC001106933710 790487981 /nfs/dbraw/zinc/48/79/81/790487981.db2.gz FHOXLORUFJCXFH-VXGBXAGGSA-N 0 3 358.468 -1.109 20 0 FAADHN NC(=O)C(=O)NC[C@]12CCC[C@H]1N(CCN1CCCS1(=O)=O)CC2 ZINC001107529726 790497040 /nfs/dbraw/zinc/49/70/40/790497040.db2.gz AQBLPGZAITUHGV-IUODEOHRSA-N 0 3 358.464 -1.132 20 0 FAADHN CNS(=O)(=O)CC(=O)NC[C@]12CCC[C@H]1N(CC(=O)N(C)C)CC2 ZINC001107636524 790499215 /nfs/dbraw/zinc/49/92/15/790499215.db2.gz BFSQRSWNZZWSAQ-IUODEOHRSA-N 0 3 360.480 -1.015 20 0 FAADHN CNC(=O)CN1CCN(C(=O)CCCN(C)C)[C@@H]2CS(=O)(=O)C[C@@H]21 ZINC001108481187 790693618 /nfs/dbraw/zinc/69/36/18/790693618.db2.gz AYWAURTVHOVOJA-QWHCGFSZSA-N 0 3 360.480 -1.616 20 0 FAADHN CN(C)CC1(C(=O)N2CCN(CC(N)=O)[C@H]3CS(=O)(=O)C[C@H]32)CC1 ZINC001108481195 790693690 /nfs/dbraw/zinc/69/36/90/790693690.db2.gz BJDJNCBKTDDXGH-NWDGAFQWSA-N 0 3 358.464 -1.877 20 0 FAADHN CCN(C)CCC(=O)N1CCN(CC(=O)NC)[C@H]2CS(=O)(=O)C[C@H]21 ZINC001108487963 790697338 /nfs/dbraw/zinc/69/73/38/790697338.db2.gz YJWISNXESHASMH-QWHCGFSZSA-N 0 3 360.480 -1.616 20 0 FAADHN CCCN(C)CCC(=O)N1CCN(CC(N)=O)[C@H]2CS(=O)(=O)C[C@H]21 ZINC001108488358 790697355 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ZINC001111076660 792557243 /nfs/dbraw/zinc/55/72/43/792557243.db2.gz RCVXOKVRGRMLGM-XQHKEYJVSA-N 0 3 364.468 -1.889 20 0 FAADHN COC[C@@H](O)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)C[C@H](NC(C)=O)C(N)=O)C2 ZINC001111107918 792557160 /nfs/dbraw/zinc/55/71/60/792557160.db2.gz BOCQEUODGWWXLS-BJJPWKGXSA-N 0 3 356.423 -1.905 20 0 FAADHN COC[C@H](O)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)C[C@H](NC(C)=O)C(N)=O)C2 ZINC001111107919 792557098 /nfs/dbraw/zinc/55/70/98/792557098.db2.gz BOCQEUODGWWXLS-POQQGIQPSA-N 0 3 356.423 -1.905 20 0 FAADHN CCS(=O)(=O)N(C)CC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2C[C@H](O)COC ZINC001111209742 792559034 /nfs/dbraw/zinc/55/90/34/792559034.db2.gz FRCLOSXUYAPVNK-RQJABVFESA-N 0 3 363.480 -1.003 20 0 FAADHN CCS(=O)(=O)N(C)CC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2C[C@@H](O)COC ZINC001111209743 792559410 /nfs/dbraw/zinc/55/94/10/792559410.db2.gz FRCLOSXUYAPVNK-SYQHCUMBSA-N 0 3 363.480 -1.003 20 0 FAADHN COC[C@H](O)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)CN1CCC(=O)NC1=O)C2 ZINC001111237978 792560318 /nfs/dbraw/zinc/56/03/18/792560318.db2.gz DWOHUVHQGJWQGM-LPWJVIDDSA-N 0 3 354.407 -1.343 20 0 FAADHN COC[C@@H](O)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)CN1CCC(=O)NC1=O)C2 ZINC001111237979 792560634 /nfs/dbraw/zinc/56/06/34/792560634.db2.gz DWOHUVHQGJWQGM-XQHKEYJVSA-N 0 3 354.407 -1.343 20 0 FAADHN COCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@H](C)NC(=O)Cn1cnnn1)C2 ZINC001111248525 792560113 /nfs/dbraw/zinc/56/01/13/792560113.db2.gz DXXZJPRCEFZDBR-LOWDOPEQSA-N 0 3 351.411 -1.454 20 0 FAADHN C[C@H](NC(=O)Cn1cnnn1)C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CCCO ZINC001111248664 792560291 /nfs/dbraw/zinc/56/02/91/792560291.db2.gz KCZFGFVWZYIHNW-LOWDOPEQSA-N 0 3 351.411 -1.718 20 0 FAADHN COCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H](C)NC(=O)Cn1cnnn1)C2 ZINC001111263188 792560583 /nfs/dbraw/zinc/56/05/83/792560583.db2.gz DXXZJPRCEFZDBR-LPWJVIDDSA-N 0 3 351.411 -1.454 20 0 FAADHN C[C@@H](NC(=O)Cn1cnnn1)C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CCCO ZINC001111263279 792560422 /nfs/dbraw/zinc/56/04/22/792560422.db2.gz 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792658286 /nfs/dbraw/zinc/65/82/86/792658286.db2.gz CPDNWFPOWBLUFF-ZBEGNZNMSA-N 0 3 351.407 -1.355 20 0 FAADHN CNC(=O)NCC(=O)N[C@]12CCC[C@H]1CN(CCN1CCNC1=O)C2 ZINC001111771393 792659527 /nfs/dbraw/zinc/65/95/27/792659527.db2.gz CQYHOUWWZUKHTQ-LRDDRELGSA-N 0 3 352.439 -1.089 20 0 FAADHN CNS(=O)(=O)NCC(=O)N[C@]12CCC[C@H]1CN(CCn1cncn1)C2 ZINC001111821065 792660754 /nfs/dbraw/zinc/66/07/54/792660754.db2.gz IVYHVQQQFAHNNP-JSGCOSHPSA-N 0 3 371.467 -1.697 20 0 FAADHN NC(=O)C(=O)N[C@]12CCC[C@H]1CN(C[C@@H](O)COC1CCOCC1)C2 ZINC001111856651 792662157 /nfs/dbraw/zinc/66/21/57/792662157.db2.gz AWTFSDOBTUQLSP-AHIWAGSCSA-N 0 3 355.435 -1.001 20 0 FAADHN NC(=O)C(=O)N[C@]12CCC[C@H]1CN(C[C@H](O)COC1CCOCC1)C2 ZINC001111856652 792661840 /nfs/dbraw/zinc/66/18/40/792661840.db2.gz AWTFSDOBTUQLSP-DCGLDWPTSA-N 0 3 355.435 -1.001 20 0 FAADHN CN1CC(C(=O)N[C@]23CCC[C@H]2CN(CC(=O)NC(N)=O)C3)=NC1=O ZINC001111859844 792661585 /nfs/dbraw/zinc/66/15/85/792661585.db2.gz DSVHQYYBNZJQCF-VFZGTOFNSA-N 0 3 350.379 -1.095 20 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792663449 /nfs/dbraw/zinc/66/34/49/792663449.db2.gz VPTAEMKFIYUXAZ-GUTXKFCHSA-N 0 3 363.480 -1.144 20 0 FAADHN COC[C@@H](O)CN1C[C@@H]2CCC[C@]2(NC(=O)CS(=O)(=O)N(C)C)C1 ZINC001111961384 792662962 /nfs/dbraw/zinc/66/29/62/792662962.db2.gz VPTAEMKFIYUXAZ-YDHLFZDLSA-N 0 3 363.480 -1.144 20 0 FAADHN CNS(=O)(=O)CC(=O)N[C@]12CCC[C@H]1CN([C@H]1CCCNC1=O)C2 ZINC001111988758 789663574 /nfs/dbraw/zinc/66/35/74/789663574.db2.gz RIEDFUYEGUFYIO-HUBLWGQQSA-N 0 3 358.464 -1.215 20 0 FAADHN CNS(=O)(=O)CC(=O)N[C@]12CCC[C@H]1CN([C@@H]1CCCNC1=O)C2 ZINC001111988759 789664122 /nfs/dbraw/zinc/66/41/22/789664122.db2.gz RIEDFUYEGUFYIO-ZOWXZIJZSA-N 0 3 358.464 -1.215 20 0 FAADHN CNS(=O)(=O)CC(=O)N[C@]12CCC[C@H]1CN([C@H]1CCN(C)C1=O)C2 ZINC001111988928 789664156 /nfs/dbraw/zinc/66/41/56/789664156.db2.gz UWYUDQDHSIZQIQ-HUBLWGQQSA-N 0 3 358.464 -1.263 20 0 FAADHN CNS(=O)(=O)CC(=O)N[C@]12CCC[C@H]1CN([C@@H]1CCN(C)C1=O)C2 ZINC001111988929 789664109 /nfs/dbraw/zinc/66/41/09/789664109.db2.gz UWYUDQDHSIZQIQ-ZOWXZIJZSA-N 0 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/nfs/dbraw/zinc/68/00/53/792680053.db2.gz FYAKYEBWFOJAKY-UHFFFAOYSA-N 0 3 372.495 -1.159 20 0 FAADHN NS(=O)(=O)[C@@H]1CCN(CCOCCN2CC[C@H](S(N)(=O)=O)C2)C1 ZINC001116455533 792686253 /nfs/dbraw/zinc/68/62/53/792686253.db2.gz BRKVGXNMPUUBAA-TXEJJXNPSA-N 0 3 370.497 -2.271 20 0 FAADHN COCCN1CCC(NC(=O)C(=O)NC[C@H](C)S(N)(=O)=O)CC1 ZINC001116527807 792687530 /nfs/dbraw/zinc/68/75/30/792687530.db2.gz FJTKCUKMQMZJPK-JTQLQIEISA-N 0 3 350.441 -1.993 20 0 FAADHN COCCN1CCC(NC(=O)C(=O)NC[C@@H](C)S(N)(=O)=O)CC1 ZINC001116527808 792688783 /nfs/dbraw/zinc/68/87/83/792688783.db2.gz FJTKCUKMQMZJPK-SNVBAGLBSA-N 0 3 350.441 -1.993 20 0 FAADHN CNC(=O)Cn1cnc(NC(=O)C(=O)NC[C@@H](C)N2CCCCC2)n1 ZINC001116536186 792688567 /nfs/dbraw/zinc/68/85/67/792688567.db2.gz CSVKEZDHNOWNJX-LLVKDONJSA-N 0 3 351.411 -1.047 20 0 FAADHN CNC(=O)Cn1cnc(NC(=O)C(=O)NC[C@H](C)N2CCCCC2)n1 ZINC001116536187 792688592 /nfs/dbraw/zinc/68/85/92/792688592.db2.gz CSVKEZDHNOWNJX-NSHDSACASA-N 0 3 351.411 -1.047 20 0 FAADHN C[C@H](CNC(=O)C(=O)Nc1ncn(CC(=O)N(C)C)n1)N1CCCC1 ZINC001116536393 792688813 /nfs/dbraw/zinc/68/88/13/792688813.db2.gz LRTPHRUAJNRTHK-LLVKDONJSA-N 0 3 351.411 -1.095 20 0 FAADHN C[C@@H](CNC(=O)C(=O)Nc1ncn(CC(=O)N(C)C)n1)N1CCCC1 ZINC001116536394 792688660 /nfs/dbraw/zinc/68/86/60/792688660.db2.gz LRTPHRUAJNRTHK-NSHDSACASA-N 0 3 351.411 -1.095 20 0 FAADHN CNC(=O)Cn1cnc(NC(=O)C(=O)NCCN2CCC(C)CC2)n1 ZINC001116536536 792688521 /nfs/dbraw/zinc/68/85/21/792688521.db2.gz NFYKINRMAMVNHC-UHFFFAOYSA-N 0 3 351.411 -1.189 20 0 FAADHN CC(C)(CC(N)=O)NCC(=O)N1CCN([C@@H]2CCS(=O)(=O)C2)CC1 ZINC001116560485 792689703 /nfs/dbraw/zinc/68/97/03/792689703.db2.gz OOYHYQINPBQNFY-GFCCVEGCSA-N 0 3 360.480 -1.439 20 0 FAADHN CC(C)(CC(N)=O)NCC(=O)N1CCN([C@H]2CCS(=O)(=O)C2)CC1 ZINC001116560486 792689290 /nfs/dbraw/zinc/68/92/90/792689290.db2.gz OOYHYQINPBQNFY-LBPRGKRZSA-N 0 3 360.480 -1.439 20 0 FAADHN C[C@H](C(=O)N1CCN(S(=O)(=O)c2nc[n-]n2)CC1)[NH+]1CCN(C)CC1 ZINC001116576085 792689428 /nfs/dbraw/zinc/68/94/28/792689428.db2.gz PHSLCSKFFMCKPN-GFCCVEGCSA-N 0 3 371.467 -1.727 20 0 FAADHN C[C@@H](C(=O)N1CCN(S(=O)(=O)c2nc[n-]n2)CC1)[NH+]1CCN(C)CC1 ZINC001116576086 792689318 /nfs/dbraw/zinc/68/93/18/792689318.db2.gz PHSLCSKFFMCKPN-LBPRGKRZSA-N 0 3 371.467 -1.727 20 0 FAADHN CN1CC[C@@](O)(CNC(=O)NCCNS(=O)(=O)Cc2ccon2)C1 ZINC001116594244 792689631 /nfs/dbraw/zinc/68/96/31/792689631.db2.gz GJMIGQMKRBFZNN-CYBMUJFWSA-N 0 3 361.424 -1.540 20 0 FAADHN CN1CC[C@](O)(CNC(=O)NCCNS(=O)(=O)Cc2ccon2)C1 ZINC001116594246 792689240 /nfs/dbraw/zinc/68/92/40/792689240.db2.gz GJMIGQMKRBFZNN-ZDUSSCGKSA-N 0 3 361.424 -1.540 20 0 FAADHN CN1CC[C@](O)(CNC(=O)c2ccc(S(=O)(=O)CC(N)=O)cc2)C1 ZINC001116616350 792690363 /nfs/dbraw/zinc/69/03/63/792690363.db2.gz HDNWCFYRIOEXTN-HNNXBMFYSA-N 0 3 355.416 -1.258 20 0 FAADHN CN1CC[C@@](O)(CNC(=O)c2ccc(S(=O)(=O)CC(N)=O)cc2)C1 ZINC001116616351 792690531 /nfs/dbraw/zinc/69/05/31/792690531.db2.gz HDNWCFYRIOEXTN-OAHLLOKOSA-N 0 3 355.416 -1.258 20 0 FAADHN Cn1c2[n-]c(CCC(=O)NC[C@@]3(O)CC[N@@H+](C)C3)nc2c(=O)[nH]c1=O ZINC001116617082 792690597 /nfs/dbraw/zinc/69/05/97/792690597.db2.gz VUACHHQYGVYGBE-HNNXBMFYSA-N 0 3 350.379 -1.522 20 0 FAADHN Cn1c2[n-]c(CCC(=O)NC[C@@]3(O)CC[N@H+](C)C3)nc2c(=O)[nH]c1=O ZINC001116617082 792690590 /nfs/dbraw/zinc/69/05/90/792690590.db2.gz VUACHHQYGVYGBE-HNNXBMFYSA-N 0 3 350.379 -1.522 20 0 FAADHN Cn1c2[n-]c(CCC(=O)NC[C@]3(O)CC[N@@H+](C)C3)nc2c(=O)[nH]c1=O ZINC001116617084 792690140 /nfs/dbraw/zinc/69/01/40/792690140.db2.gz VUACHHQYGVYGBE-OAHLLOKOSA-N 0 3 350.379 -1.522 20 0 FAADHN Cn1c2[n-]c(CCC(=O)NC[C@]3(O)CC[N@H+](C)C3)nc2c(=O)[nH]c1=O ZINC001116617084 792690137 /nfs/dbraw/zinc/69/01/37/792690137.db2.gz VUACHHQYGVYGBE-OAHLLOKOSA-N 0 3 350.379 -1.522 20 0 FAADHN CC[C@H](CN1CCCC1)NC(=O)C(=O)Nc1ncn(CC(=O)NC)n1 ZINC001116729593 792692861 /nfs/dbraw/zinc/69/28/61/792692861.db2.gz FYPVZHPPMGVWNV-LLVKDONJSA-N 0 3 351.411 -1.047 20 0 FAADHN CC[C@@H](CN1CCCC1)NC(=O)C(=O)Nc1ncn(CC(=O)NC)n1 ZINC001116729594 792692976 /nfs/dbraw/zinc/69/29/76/792692976.db2.gz FYPVZHPPMGVWNV-NSHDSACASA-N 0 3 351.411 -1.047 20 0 FAADHN CN(C)[C@H](CNC(=O)C(=O)NCCNS(C)(=O)=O)Cc1ccccc1 ZINC001116969584 792699062 /nfs/dbraw/zinc/69/90/62/792699062.db2.gz HVSXZMCIGPGEPG-AWEZNQCLSA-N 0 3 370.475 -1.059 20 0 FAADHN CN(C)[C@@H](CNC(=O)C(=O)NCCNS(C)(=O)=O)Cc1ccccc1 ZINC001116969585 792699265 /nfs/dbraw/zinc/69/92/65/792699265.db2.gz HVSXZMCIGPGEPG-CQSZACIVSA-N 0 3 370.475 -1.059 20 0 FAADHN CN1CCN(C)[C@@H](CNC(=O)C(=O)NCCCCN2CCOCC2)C1 ZINC001117022505 792701035 /nfs/dbraw/zinc/70/10/35/792701035.db2.gz KAZRSHRUQVOMHK-HNNXBMFYSA-N 0 3 355.483 -1.423 20 0 FAADHN CN1CCN(C)[C@H](CNC(=O)C(=O)NCCCCN2CCOCC2)C1 ZINC001117022506 792700941 /nfs/dbraw/zinc/70/09/41/792700941.db2.gz KAZRSHRUQVOMHK-OAHLLOKOSA-N 0 3 355.483 -1.423 20 0 FAADHN CN1CCN(CCCCNC(=O)C(=O)NCC(=O)N2CCCC2)CC1 ZINC001117023672 792701063 /nfs/dbraw/zinc/70/10/63/792701063.db2.gz UQXRETLTQZMOEH-UHFFFAOYSA-N 0 3 353.467 -1.131 20 0 FAADHN CN(C)[C@]1(CNC(=O)C(=O)N(C)CC(=O)N2CCOCC2)CCSC1 ZINC001117030526 792701799 /nfs/dbraw/zinc/70/17/99/792701799.db2.gz KGFDDMVDODTOCH-INIZCTEOSA-N 0 3 372.491 -1.143 20 0 FAADHN CN(C)[C@@]1(CNC(=O)C(=O)N(C)CC(=O)N2CCOCC2)CCSC1 ZINC001117030527 792701753 /nfs/dbraw/zinc/70/17/53/792701753.db2.gz KGFDDMVDODTOCH-MRXNPFEDSA-N 0 3 372.491 -1.143 20 0 FAADHN CN(C)[C@]1(CNC(=O)C(=O)NC[C@H]2CC[C@H](C(N)=O)O2)CCSC1 ZINC001117032517 792701527 /nfs/dbraw/zinc/70/15/27/792701527.db2.gz YVYFXJSHJJNLJN-HFAKWTLXSA-N 0 3 358.464 -1.311 20 0 FAADHN CN(C)[C@]1(CNC(=O)C(=O)NC[C@@H]2CC[C@@H](C(N)=O)O2)CCSC1 ZINC001117032518 792701774 /nfs/dbraw/zinc/70/17/74/792701774.db2.gz YVYFXJSHJJNLJN-PGUXBMHVSA-N 0 3 358.464 -1.311 20 0 FAADHN CN(C)[C@]1(CNC(=O)C(=O)NC[C@@H]2CC[C@H](C(N)=O)O2)CCSC1 ZINC001117032519 792701872 /nfs/dbraw/zinc/70/18/72/792701872.db2.gz YVYFXJSHJJNLJN-RWSFTLGLSA-N 0 3 358.464 -1.311 20 0 FAADHN CN(C)[C@]1(CNC(=O)C(=O)NC[C@H]2CC[C@@H](C(N)=O)O2)CCSC1 ZINC001117032520 792702112 /nfs/dbraw/zinc/70/21/12/792702112.db2.gz YVYFXJSHJJNLJN-ZETOZRRWSA-N 0 3 358.464 -1.311 20 0 FAADHN C[C@H](CO)N(C[C@H](C)O)C(=O)C(=O)NCCCCN1CCN(C)CC1 ZINC001117042805 792702855 /nfs/dbraw/zinc/70/28/55/792702855.db2.gz CRMFTLILAZARPV-CABCVRRESA-N 0 3 358.483 -1.280 20 0 FAADHN C[C@H](O)CN(C(=O)C(=O)NCCCCN1CCN(C)CC1)[C@@H](C)CO ZINC001117042806 792702694 /nfs/dbraw/zinc/70/26/94/792702694.db2.gz CRMFTLILAZARPV-GJZGRUSLSA-N 0 3 358.483 -1.280 20 0 FAADHN C[C@@H](O)CN(C(=O)C(=O)NCCCCN1CCN(C)CC1)[C@H](C)CO ZINC001117042807 792703044 /nfs/dbraw/zinc/70/30/44/792703044.db2.gz CRMFTLILAZARPV-HUUCEWRRSA-N 0 3 358.483 -1.280 20 0 FAADHN C[C@@H](O)CN(C(=O)C(=O)NCCCCN1CCN(C)CC1)[C@@H](C)CO ZINC001117042808 792702987 /nfs/dbraw/zinc/70/29/87/792702987.db2.gz CRMFTLILAZARPV-LSDHHAIUSA-N 0 3 358.483 -1.280 20 0 FAADHN C[C@@H](CNC(=O)C(=O)N1CC[C@H](S(C)(=O)=O)C1)CN1CCN(C)CC1 ZINC001117060499 792703738 /nfs/dbraw/zinc/70/37/38/792703738.db2.gz ZDINCFVSAOGOFL-KBPBESRZSA-N 0 3 374.507 -1.368 20 0 FAADHN C[C@H](CNC(=O)C(=O)N1CC[C@H](S(C)(=O)=O)C1)CN1CCN(C)CC1 ZINC001117060500 792704042 /nfs/dbraw/zinc/70/40/42/792704042.db2.gz ZDINCFVSAOGOFL-KGLIPLIRSA-N 0 3 374.507 -1.368 20 0 FAADHN C[C@@H](CNC(=O)C(=O)N1CC[C@@H](S(C)(=O)=O)C1)CN1CCN(C)CC1 ZINC001117060501 792703792 /nfs/dbraw/zinc/70/37/92/792703792.db2.gz ZDINCFVSAOGOFL-UONOGXRCSA-N 0 3 374.507 -1.368 20 0 FAADHN C[C@H](CNC(=O)C(=O)N1CC[C@@H](S(C)(=O)=O)C1)CN1CCN(C)CC1 ZINC001117060502 792703840 /nfs/dbraw/zinc/70/38/40/792703840.db2.gz ZDINCFVSAOGOFL-ZIAGYGMSSA-N 0 3 374.507 -1.368 20 0 FAADHN C[C@H](CNC(=O)C(=O)NCCNC(=O)C1CC1)CN1CCN(C)CC1 ZINC001117085482 792704837 /nfs/dbraw/zinc/70/48/37/792704837.db2.gz GLNWJXVNCAYFLW-CYBMUJFWSA-N 0 3 353.467 -1.372 20 0 FAADHN C[C@@H](CNC(=O)C(=O)NCCNC(=O)C1CC1)CN1CCN(C)CC1 ZINC001117085483 792704647 /nfs/dbraw/zinc/70/46/47/792704647.db2.gz GLNWJXVNCAYFLW-ZDUSSCGKSA-N 0 3 353.467 -1.372 20 0 FAADHN C[C@H](CNC(=O)C(=O)N1CC[C@@H](NC(N)=O)C1)CN1CCN(C)CC1 ZINC001117086286 792706077 /nfs/dbraw/zinc/70/60/77/792706077.db2.gz USDOUBVJHGGRLI-CHWSQXEVSA-N 0 3 354.455 -1.745 20 0 FAADHN C[C@H](CNC(=O)C(=O)N1CC[C@H](NC(N)=O)C1)CN1CCN(C)CC1 ZINC001117086287 792705948 /nfs/dbraw/zinc/70/59/48/792705948.db2.gz USDOUBVJHGGRLI-OLZOCXBDSA-N 0 3 354.455 -1.745 20 0 FAADHN C[C@@H](CNC(=O)C(=O)N1CC[C@@H](NC(N)=O)C1)CN1CCN(C)CC1 ZINC001117086288 792705616 /nfs/dbraw/zinc/70/56/16/792705616.db2.gz USDOUBVJHGGRLI-QWHCGFSZSA-N 0 3 354.455 -1.745 20 0 FAADHN C[C@@H](CNC(=O)C(=O)N1CC[C@H](NC(N)=O)C1)CN1CCN(C)CC1 ZINC001117086289 792705734 /nfs/dbraw/zinc/70/57/34/792705734.db2.gz USDOUBVJHGGRLI-STQMWFEESA-N 0 3 354.455 -1.745 20 0 FAADHN C[C@H](CNC(=O)C(=O)N[C@H](C)CS(C)(=O)=O)CN1CCN(C)CC1 ZINC001117086447 792705513 /nfs/dbraw/zinc/70/55/13/792705513.db2.gz XWJRHZQQOFONTQ-CHWSQXEVSA-N 0 3 362.496 -1.465 20 0 FAADHN C[C@H](CNC(=O)C(=O)N[C@@H](C)CS(C)(=O)=O)CN1CCN(C)CC1 ZINC001117086448 792705922 /nfs/dbraw/zinc/70/59/22/792705922.db2.gz XWJRHZQQOFONTQ-OLZOCXBDSA-N 0 3 362.496 -1.465 20 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792773207 /nfs/dbraw/zinc/77/32/07/792773207.db2.gz LRJQQFFBIMUPDO-SUMWQHHRSA-N 0 3 354.451 -1.304 20 0 FAADHN CN(C)CCN1CCN(C(=O)C(=O)N(C)Cc2cn(C)nn2)CC1=O ZINC001118525902 792774096 /nfs/dbraw/zinc/77/40/96/792774096.db2.gz SDZLIIVZHLARPA-UHFFFAOYSA-N 0 3 351.411 -1.994 20 0 FAADHN C[C@@H]1CN(C(=O)C(=O)N2C[C@@H]3CCN(C)[C@@H]3C2)CCN1S(C)(=O)=O ZINC001118533161 792774023 /nfs/dbraw/zinc/77/40/23/792774023.db2.gz NBMZDABHFMCQJK-FRRDWIJNSA-N 0 3 358.464 -1.359 20 0 FAADHN NS(=O)(=O)CCNC(=O)C(=O)Nc1ccc([C@H]2CNCCO2)cc1 ZINC001118541569 792773912 /nfs/dbraw/zinc/77/39/12/792773912.db2.gz IIRZNEZBRIZDJH-GFCCVEGCSA-N 0 3 356.404 -1.309 20 0 FAADHN NS(=O)(=O)CCNC(=O)C(=O)Nc1ccc([C@@H]2CNCCO2)cc1 ZINC001118541571 792773979 /nfs/dbraw/zinc/77/39/79/792773979.db2.gz IIRZNEZBRIZDJH-LBPRGKRZSA-N 0 3 356.404 -1.309 20 0 FAADHN CN1CCN(C(=O)CCNC(=O)NCc2nc(C[NH3+])cc(=O)[n-]2)CC1 ZINC001118545701 792774904 /nfs/dbraw/zinc/77/49/04/792774904.db2.gz NRWLTHSTIPNPNB-UHFFFAOYSA-N 0 3 351.411 -1.396 20 0 FAADHN COC[C@H]1CN(C(=O)C(=O)NCc2nc(C[NH3+])cc(=O)[n-]2)C[C@H](C)O1 ZINC001118553340 792775548 /nfs/dbraw/zinc/77/55/48/792775548.db2.gz AIWFYTIEMQLFGH-GXSJLCMTSA-N 0 3 353.379 -1.481 20 0 FAADHN COC[C@@H]1CN(C(=O)C(=O)NCc2nc(C[NH3+])cc(=O)[n-]2)C[C@@H](C)O1 ZINC001118553341 792775628 /nfs/dbraw/zinc/77/56/28/792775628.db2.gz AIWFYTIEMQLFGH-KOLCDFICSA-N 0 3 353.379 -1.481 20 0 FAADHN COC[C@H]1CN(C(=O)C(=O)NCc2nc(C[NH3+])cc(=O)[n-]2)C[C@@H](C)O1 ZINC001118553342 792775609 /nfs/dbraw/zinc/77/56/09/792775609.db2.gz AIWFYTIEMQLFGH-MWLCHTKSSA-N 0 3 353.379 -1.481 20 0 FAADHN COC[C@@H]1CN(C(=O)C(=O)NCc2nc(C[NH3+])cc(=O)[n-]2)C[C@H](C)O1 ZINC001118553343 792775771 /nfs/dbraw/zinc/77/57/71/792775771.db2.gz AIWFYTIEMQLFGH-ONGXEEELSA-N 0 3 353.379 -1.481 20 0 FAADHN CN1CCN(C(=O)C(=O)NCCS(=O)(=O)CC(F)(F)F)[C@H](CN)C1 ZINC001118553969 792775802 /nfs/dbraw/zinc/77/58/02/792775802.db2.gz ZRNRVIDZGJHWQG-SECBINFHSA-N 0 3 374.385 -1.819 20 0 FAADHN CN1CCN(C(=O)C(=O)NCCS(=O)(=O)CC(F)(F)F)[C@@H](CN)C1 ZINC001118553976 792775525 /nfs/dbraw/zinc/77/55/25/792775525.db2.gz ZRNRVIDZGJHWQG-VIFPVBQESA-N 0 3 374.385 -1.819 20 0 FAADHN CN(C)S(=O)(=O)NCC(=O)N1CCC(N2CCC[C@@H]2C(N)=O)CC1 ZINC001118576028 792777696 /nfs/dbraw/zinc/77/76/96/792777696.db2.gz RYWCXMKPUZDEIW-GFCCVEGCSA-N 0 3 361.468 -1.677 20 0 FAADHN CN(C)S(=O)(=O)NCC(=O)N1CCC(N2CCC[C@H]2C(N)=O)CC1 ZINC001118576029 792777564 /nfs/dbraw/zinc/77/75/64/792777564.db2.gz RYWCXMKPUZDEIW-LBPRGKRZSA-N 0 3 361.468 -1.677 20 0 FAADHN O=C([C@@H]1CC(=O)N([C@H]2CCS(=O)(=O)C2)C1)N1CCOC2(CNC2)C1 ZINC001118579702 792777403 /nfs/dbraw/zinc/77/74/03/792777403.db2.gz QTVLYWUOUNTEPZ-NEPJUHHUSA-N 0 3 357.432 -1.777 20 0 FAADHN O=C([C@H]1CC(=O)N([C@@H]2CCS(=O)(=O)C2)C1)N1CCOC2(CNC2)C1 ZINC001118579703 792777725 /nfs/dbraw/zinc/77/77/25/792777725.db2.gz QTVLYWUOUNTEPZ-NWDGAFQWSA-N 0 3 357.432 -1.777 20 0 FAADHN O=C([C@H]1CC(=O)N([C@H]2CCS(=O)(=O)C2)C1)N1CCOC2(CNC2)C1 ZINC001118579704 792777274 /nfs/dbraw/zinc/77/72/74/792777274.db2.gz QTVLYWUOUNTEPZ-RYUDHWBXSA-N 0 3 357.432 -1.777 20 0 FAADHN O=C([C@@H]1CC(=O)N([C@@H]2CCS(=O)(=O)C2)C1)N1CCOC2(CNC2)C1 ZINC001118579705 792777666 /nfs/dbraw/zinc/77/76/66/792777666.db2.gz QTVLYWUOUNTEPZ-VXGBXAGGSA-N 0 3 357.432 -1.777 20 0 FAADHN C[C@H](CNC(=O)C(=O)N(C)C[C@H]1COCCO1)CN1CCN(C)CC1 ZINC001118597866 792778144 /nfs/dbraw/zinc/77/81/44/792778144.db2.gz CAJPIFVURMOXGV-CABCVRRESA-N 0 3 356.467 -1.140 20 0 FAADHN C[C@@H](CNC(=O)C(=O)N(C)C[C@H]1COCCO1)CN1CCN(C)CC1 ZINC001118597871 792778340 /nfs/dbraw/zinc/77/83/40/792778340.db2.gz CAJPIFVURMOXGV-GJZGRUSLSA-N 0 3 356.467 -1.140 20 0 FAADHN C[C@H](CNC(=O)C(=O)N(C)C[C@@H]1COCCO1)CN1CCN(C)CC1 ZINC001118597872 792778491 /nfs/dbraw/zinc/77/84/91/792778491.db2.gz CAJPIFVURMOXGV-HUUCEWRRSA-N 0 3 356.467 -1.140 20 0 FAADHN C[C@@H](CNC(=O)C(=O)N(C)C[C@@H]1COCCO1)CN1CCN(C)CC1 ZINC001118598212 792778366 /nfs/dbraw/zinc/77/83/66/792778366.db2.gz CAJPIFVURMOXGV-LSDHHAIUSA-N 0 3 356.467 -1.140 20 0 FAADHN COC1CCN(CCNC(=O)NCCOCCS(N)(=O)=O)CC1 ZINC001118605872 792779153 /nfs/dbraw/zinc/77/91/53/792779153.db2.gz UXQOQLQCWJUNOG-UHFFFAOYSA-N 0 3 352.457 -1.299 20 0 FAADHN CCN(OC)C(=O)CNC(=O)C(=O)NC1CCN([C@@H]2CCOC2)CC1 ZINC001118664645 792782211 /nfs/dbraw/zinc/78/22/11/792782211.db2.gz VWWBJHWCHFQUCB-CYBMUJFWSA-N 0 3 356.423 -1.118 20 0 FAADHN CCN(OC)C(=O)CNC(=O)C(=O)NC1CCN([C@H]2CCOC2)CC1 ZINC001118664646 792782547 /nfs/dbraw/zinc/78/25/47/792782547.db2.gz VWWBJHWCHFQUCB-ZDUSSCGKSA-N 0 3 356.423 -1.118 20 0 FAADHN CN(C)C(=O)[C@H]1CCCN1CCCNC(=O)C(=O)N[C@H]1CCNC1=O ZINC001118671848 792783241 /nfs/dbraw/zinc/78/32/41/792783241.db2.gz JJPOPVXKUJTMEN-NWDGAFQWSA-N 0 3 353.423 -1.950 20 0 FAADHN CN(C)C(=O)[C@@H]1CCCN1CCCNC(=O)C(=O)N[C@H]1CCNC1=O ZINC001118671850 792783198 /nfs/dbraw/zinc/78/31/98/792783198.db2.gz JJPOPVXKUJTMEN-RYUDHWBXSA-N 0 3 353.423 -1.950 20 0 FAADHN C[C@H](O)[C@H]1CN(C(=O)C(=O)NC2CCN([C@H]3CCOC3)CC2)CCO1 ZINC001118678552 792784082 /nfs/dbraw/zinc/78/40/82/792784082.db2.gz KDFOUUIEHONLTD-AEGPPILISA-N 0 3 355.435 -1.036 20 0 FAADHN C[C@H](O)[C@@H]1CN(C(=O)C(=O)NC2CCN([C@@H]3CCOC3)CC2)CCO1 ZINC001118678553 792784144 /nfs/dbraw/zinc/78/41/44/792784144.db2.gz KDFOUUIEHONLTD-CFVMTHIKSA-N 0 3 355.435 -1.036 20 0 FAADHN C[C@H](O)[C@H]1CN(C(=O)C(=O)NC2CCN([C@@H]3CCOC3)CC2)CCO1 ZINC001118678554 792783998 /nfs/dbraw/zinc/78/39/98/792783998.db2.gz KDFOUUIEHONLTD-NWANDNLSSA-N 0 3 355.435 -1.036 20 0 FAADHN C[C@H](O)[C@@H]1CN(C(=O)C(=O)NC2CCN([C@H]3CCOC3)CC2)CCO1 ZINC001118678555 792784134 /nfs/dbraw/zinc/78/41/34/792784134.db2.gz KDFOUUIEHONLTD-QEJZJMRPSA-N 0 3 355.435 -1.036 20 0 FAADHN C[C@H](CNC(=O)C(=O)N(C)CCCN1CCN(C)CC1)S(C)(=O)=O ZINC001118684560 792784802 /nfs/dbraw/zinc/78/48/02/792784802.db2.gz BGZZAMAQGVRHNW-CYBMUJFWSA-N 0 3 362.496 -1.368 20 0 FAADHN C[C@@H](CNC(=O)C(=O)N(C)CCCN1CCN(C)CC1)S(C)(=O)=O ZINC001118684561 792784854 /nfs/dbraw/zinc/78/48/54/792784854.db2.gz BGZZAMAQGVRHNW-ZDUSSCGKSA-N 0 3 362.496 -1.368 20 0 FAADHN O=C(CNC(=O)C(=O)NC1CCN([C@H]2CCOC2)CC1)NCC1CC1 ZINC001118739153 792787137 /nfs/dbraw/zinc/78/71/37/792787137.db2.gz KANAYWMATLBHAD-AWEZNQCLSA-N 0 3 352.435 -1.002 20 0 FAADHN O=C(CNC(=O)C(=O)NC1CCN([C@@H]2CCOC2)CC1)NCC1CC1 ZINC001118739154 792787081 /nfs/dbraw/zinc/78/70/81/792787081.db2.gz KANAYWMATLBHAD-CQSZACIVSA-N 0 3 352.435 -1.002 20 0 FAADHN CN(C)C[C@@]1(O)CCCN(C(=O)C(=O)c2cc(S(N)(=O)=O)cn2C)C1 ZINC001118758508 792787831 /nfs/dbraw/zinc/78/78/31/792787831.db2.gz KWHWLBGGFUPSHR-HNNXBMFYSA-N 0 3 372.447 -1.230 20 0 FAADHN CN(C)C[C@]1(O)CCCN(C(=O)C(=O)c2cc(S(N)(=O)=O)cn2C)C1 ZINC001118758509 792787963 /nfs/dbraw/zinc/78/79/63/792787963.db2.gz KWHWLBGGFUPSHR-OAHLLOKOSA-N 0 3 372.447 -1.230 20 0 FAADHN CC(=O)N1CC[C@@H](NC(=O)C(=O)N2CCN(CCN(C)C)C(=O)C2)C1 ZINC001118765961 792787717 /nfs/dbraw/zinc/78/77/17/792787717.db2.gz FIVYTQPPKASPRS-CYBMUJFWSA-N 0 3 353.423 -2.044 20 0 FAADHN CN(C)CCN1CCN(C(=O)C(=O)N2C[C@@H]3COC(=O)[C@@H]3C2)CC1=O ZINC001118832187 792790096 /nfs/dbraw/zinc/79/00/96/792790096.db2.gz AOOIYIBLZIVJCE-VXGBXAGGSA-N 0 3 352.391 -2.150 20 0 FAADHN CN(C)CCN1CCN(C(=O)C(=O)N2CCO[C@@H]3CCC[C@@H]32)CC1=O ZINC001118836425 792790122 /nfs/dbraw/zinc/79/01/22/792790122.db2.gz OERATPCRNGBFQF-UONOGXRCSA-N 0 3 352.435 -1.001 20 0 FAADHN CNS(=O)(=O)CCNC(=O)C(=O)Nc1ccc2c(c1)OCCNC2 ZINC001118859983 792791895 /nfs/dbraw/zinc/79/18/95/792791895.db2.gz OIXFGLMVXCRQSB-UHFFFAOYSA-N 0 3 356.404 -1.228 20 0 FAADHN COCCNC(=O)CNC(=O)C(=O)Nc1ccc2c(c1)OCCNC2 ZINC001118860465 792791777 /nfs/dbraw/zinc/79/17/77/792791777.db2.gz TWJFPLYVOMYUBE-UHFFFAOYSA-N 0 3 350.375 -1.014 20 0 FAADHN NS(=O)(=O)[C@@H]1CCN(C(=O)C(=O)Nc2ccc3c(c2)OCCNC3)C1 ZINC001118861000 792791579 /nfs/dbraw/zinc/79/15/79/792791579.db2.gz ZNLIFEFWCDYUJO-GFCCVEGCSA-N 0 3 368.415 -1.004 20 0 FAADHN NS(=O)(=O)[C@H]1CCN(C(=O)C(=O)Nc2ccc3c(c2)OCCNC3)C1 ZINC001118861001 792791591 /nfs/dbraw/zinc/79/15/91/792791591.db2.gz ZNLIFEFWCDYUJO-LBPRGKRZSA-N 0 3 368.415 -1.004 20 0 FAADHN Cn1cc(S(=O)(=O)NCC(=O)N2CC[C@@H](N3CC[C@H](O)C3)C2)cn1 ZINC001118861607 792791988 /nfs/dbraw/zinc/79/19/88/792791988.db2.gz MSXAWKRLXBNBHI-NEPJUHHUSA-N 0 3 357.436 -1.634 20 0 FAADHN Cn1cc(S(=O)(=O)NCC(=O)N2CC[C@H](N3CC[C@@H](O)C3)C2)cn1 ZINC001118861608 792792005 /nfs/dbraw/zinc/79/20/05/792792005.db2.gz MSXAWKRLXBNBHI-NWDGAFQWSA-N 0 3 357.436 -1.634 20 0 FAADHN Cn1cc(S(=O)(=O)NCC(=O)N2CC[C@H](N3CC[C@H](O)C3)C2)cn1 ZINC001118861609 792791690 /nfs/dbraw/zinc/79/16/90/792791690.db2.gz MSXAWKRLXBNBHI-RYUDHWBXSA-N 0 3 357.436 -1.634 20 0 FAADHN Cn1cc(S(=O)(=O)NCC(=O)N2CC[C@@H](N3CC[C@@H](O)C3)C2)cn1 ZINC001118861610 792791647 /nfs/dbraw/zinc/79/16/47/792791647.db2.gz MSXAWKRLXBNBHI-VXGBXAGGSA-N 0 3 357.436 -1.634 20 0 FAADHN CNS(=O)(=O)C[C@@H]1CCCN(C(=O)C(=O)N2C[C@@H]3CCN(C)[C@@H]3C2)C1 ZINC001118902038 792795749 /nfs/dbraw/zinc/79/57/49/792795749.db2.gz GLCHNKFXBOGRNN-HZSPNIEDSA-N 0 3 372.491 -1.063 20 0 FAADHN CNS(=O)(=O)C[C@H]1CCCN(C(=O)C(=O)N2C[C@@H]3CCN(C)[C@@H]3C2)C1 ZINC001118902040 792795450 /nfs/dbraw/zinc/79/54/50/792795450.db2.gz GLCHNKFXBOGRNN-MELADBBJSA-N 0 3 372.491 -1.063 20 0 FAADHN Cn1c2[nH]c(CCC(=O)NCCN3CC[C@H](O)C3)nc2c(=O)[nH]c1=O ZINC001118910602 792796453 /nfs/dbraw/zinc/79/64/53/792796453.db2.gz KOJCWSULDRAALX-VIFPVBQESA-N 0 3 350.379 -1.522 20 0 FAADHN C[C@H](NS(=O)(=O)c1cnn(C)c1)C(=O)N1CC[C@H](N2CC[C@H](O)C2)C1 ZINC001118921132 792797195 /nfs/dbraw/zinc/79/71/95/792797195.db2.gz LAJRCYXHRVXQLE-AVGNSLFASA-N 0 3 371.463 -1.246 20 0 FAADHN C[C@H](NS(=O)(=O)c1cnn(C)c1)C(=O)N1CC[C@H](N2CC[C@@H](O)C2)C1 ZINC001118921133 792797313 /nfs/dbraw/zinc/79/73/13/792797313.db2.gz LAJRCYXHRVXQLE-RWMBFGLXSA-N 0 3 371.463 -1.246 20 0 FAADHN C[C@H](NS(=O)(=O)c1cnn(C)c1)C(=O)N1CC[C@@H](N2CC[C@H](O)C2)C1 ZINC001118921134 792797242 /nfs/dbraw/zinc/79/72/42/792797242.db2.gz LAJRCYXHRVXQLE-XQQFMLRXSA-N 0 3 371.463 -1.246 20 0 FAADHN C[C@H](NS(=O)(=O)c1cnn(C)c1)C(=O)N1CC[C@@H](N2CC[C@@H](O)C2)C1 ZINC001118921135 792797129 /nfs/dbraw/zinc/79/71/29/792797129.db2.gz LAJRCYXHRVXQLE-YNEHKIRRSA-N 0 3 371.463 -1.246 20 0 FAADHN O=C(NC[C@H]1CNCCO1)C(=O)N1CCN(S(=O)(=O)C2CC2)CC1 ZINC001118928749 792797301 /nfs/dbraw/zinc/79/73/01/792797301.db2.gz QHHUTTDQUJHWMP-LLVKDONJSA-N 0 3 360.436 -2.273 20 0 FAADHN O=C(NC[C@@H]1CNCCO1)C(=O)N1CCN(S(=O)(=O)C2CC2)CC1 ZINC001118928751 792796926 /nfs/dbraw/zinc/79/69/26/792796926.db2.gz QHHUTTDQUJHWMP-NSHDSACASA-N 0 3 360.436 -2.273 20 0 FAADHN CNS(=O)(=O)C[C@@H]1CCCN(C(=O)C(=O)NC[C@@H]2CNCCO2)C1 ZINC001118929395 792797289 /nfs/dbraw/zinc/79/72/89/792797289.db2.gz ZMAKQSSABULAJG-NEPJUHHUSA-N 0 3 362.452 -2.121 20 0 FAADHN CNS(=O)(=O)C[C@H]1CCCN(C(=O)C(=O)NC[C@H]2CNCCO2)C1 ZINC001118929396 792797359 /nfs/dbraw/zinc/79/73/59/792797359.db2.gz ZMAKQSSABULAJG-NWDGAFQWSA-N 0 3 362.452 -2.121 20 0 FAADHN CNS(=O)(=O)C[C@H]1CCCN(C(=O)C(=O)NC[C@@H]2CNCCO2)C1 ZINC001118929397 792797253 /nfs/dbraw/zinc/79/72/53/792797253.db2.gz ZMAKQSSABULAJG-RYUDHWBXSA-N 0 3 362.452 -2.121 20 0 FAADHN CNS(=O)(=O)C[C@@H]1CCCN(C(=O)C(=O)NC[C@H]2CNCCO2)C1 ZINC001118929398 792797067 /nfs/dbraw/zinc/79/70/67/792797067.db2.gz ZMAKQSSABULAJG-VXGBXAGGSA-N 0 3 362.452 -2.121 20 0 FAADHN CN(C[C@@H]1CCCN1C)C(=O)C(=O)N1CCC(C(=O)NCCO)CC1 ZINC001118954179 792799976 /nfs/dbraw/zinc/79/99/76/792799976.db2.gz AYYXVFABSISSGV-AWEZNQCLSA-N 0 3 354.451 -1.114 20 0 FAADHN CN(C[C@H]1CCCN1C)C(=O)C(=O)N1CCC(C(=O)NCCO)CC1 ZINC001118954183 792800171 /nfs/dbraw/zinc/80/01/71/792800171.db2.gz AYYXVFABSISSGV-CQSZACIVSA-N 0 3 354.451 -1.114 20 0 FAADHN C[C@H]1CN(C(=O)C(=O)N2CCN(CCN(C)C)C(=O)C2)CCS1(=O)=O ZINC001118956942 792800416 /nfs/dbraw/zinc/80/04/16/792800416.db2.gz HXWPQMBUOCGJAA-LBPRGKRZSA-N 0 3 374.463 -2.136 20 0 FAADHN COCCN(CCN(C)C)C(=O)C(=O)N1CCC(C(=O)NOC)CC1 ZINC001119016193 792802459 /nfs/dbraw/zinc/80/24/59/792802459.db2.gz BPNUKZHJUMAFLK-UHFFFAOYSA-N 0 3 358.439 -1.061 20 0 FAADHN CN(C)CCN1CCN(C(=O)C(=O)N[C@@H]2CCCN(C)C2=O)CC1=O ZINC001119081143 792804322 /nfs/dbraw/zinc/80/43/22/792804322.db2.gz PECRCVWSUWTTTQ-GFCCVEGCSA-N 0 3 353.423 -2.044 20 0 FAADHN CN(C)CCN1CCN(C(=O)C(=O)N[C@H]2CCCN(C)C2=O)CC1=O ZINC001119081144 792804027 /nfs/dbraw/zinc/80/40/27/792804027.db2.gz PECRCVWSUWTTTQ-LBPRGKRZSA-N 0 3 353.423 -2.044 20 0 FAADHN CCn1nncc1CNC(=O)C(=O)NC[C@@H](C)CN1CCN(C)CC1 ZINC001119106271 792805010 /nfs/dbraw/zinc/80/50/10/792805010.db2.gz SUQHASVKXSFQQO-CYBMUJFWSA-N 0 3 351.455 -1.086 20 0 FAADHN CCn1nncc1CNC(=O)C(=O)NC[C@H](C)CN1CCN(C)CC1 ZINC001119106273 792805746 /nfs/dbraw/zinc/80/57/46/792805746.db2.gz SUQHASVKXSFQQO-ZDUSSCGKSA-N 0 3 351.455 -1.086 20 0 FAADHN CN1C[C@H](NC(=O)C(=O)N2CCC(N3CCN(C)CC3)CC2)CC1=O ZINC001119116598 792805859 /nfs/dbraw/zinc/80/58/59/792805859.db2.gz OLDMDVIHPVXBPV-CYBMUJFWSA-N 0 3 351.451 -1.428 20 0 FAADHN CN1C[C@@H](NC(=O)C(=O)N2CCC(N3CCN(C)CC3)CC2)CC1=O ZINC001119116673 792805713 /nfs/dbraw/zinc/80/57/13/792805713.db2.gz OLDMDVIHPVXBPV-ZDUSSCGKSA-N 0 3 351.451 -1.428 20 0 FAADHN C[C@H]1CCCN(CCNC(=O)C(=O)N2C[C@@H]3C(=O)N(C)C(=O)[C@@H]3C2)C1 ZINC001119161515 792806971 /nfs/dbraw/zinc/80/69/71/792806971.db2.gz BEMBHKKDEZMZAJ-RWMBFGLXSA-N 0 3 350.419 -1.092 20 0 FAADHN C[C@@H]1CCCN(CCNC(=O)C(=O)N2C[C@@H]3C(=O)N(C)C(=O)[C@@H]3C2)C1 ZINC001119161516 792806749 /nfs/dbraw/zinc/80/67/49/792806749.db2.gz BEMBHKKDEZMZAJ-UPJWGTAASA-N 0 3 350.419 -1.092 20 0 FAADHN CN1CCN(CCCCNC(=O)C(=O)NC[C@H]2COCCN2C)CC1 ZINC001119162070 792807018 /nfs/dbraw/zinc/80/70/18/792807018.db2.gz FSVVHBIVIPESEC-HNNXBMFYSA-N 0 3 355.483 -1.423 20 0 FAADHN CN1CCN(CCCCNC(=O)C(=O)NC[C@@H]2COCCN2C)CC1 ZINC001119162071 792807355 /nfs/dbraw/zinc/80/73/55/792807355.db2.gz FSVVHBIVIPESEC-OAHLLOKOSA-N 0 3 355.483 -1.423 20 0 FAADHN CC1CCN(CCNC(=O)C(=O)N2C[C@@H]3C(=O)N(C)C(=O)[C@@H]3C2)CC1 ZINC001119162133 792807331 /nfs/dbraw/zinc/80/73/31/792807331.db2.gz HBRUNUHPIABLGM-BETUJISGSA-N 0 3 350.419 -1.092 20 0 FAADHN C[C@H]1CN(C(=O)C(=O)NC[C@H]2CN3CCC[C@H]3CO2)CCS1(=O)=O ZINC001119177978 792806777 /nfs/dbraw/zinc/80/67/77/792806777.db2.gz PLYVSSIMTSDGKP-AVGNSLFASA-N 0 3 359.448 -1.389 20 0 FAADHN C[C@H]1CN(C(=O)C(=O)NC[C@@H]2CN3CCC[C@H]3CO2)CCS1(=O)=O ZINC001119177980 792807134 /nfs/dbraw/zinc/80/71/34/792807134.db2.gz PLYVSSIMTSDGKP-RWMBFGLXSA-N 0 3 359.448 -1.389 20 0 FAADHN C[C@H]1CN(C(=O)C(=O)NC[C@H]2CN3CCC[C@@H]3CO2)CCS1(=O)=O ZINC001119177982 792806688 /nfs/dbraw/zinc/80/66/88/792806688.db2.gz PLYVSSIMTSDGKP-XQQFMLRXSA-N 0 3 359.448 -1.389 20 0 FAADHN C[C@H]1CN(C(=O)C(=O)NC[C@@H]2CN3CCC[C@@H]3CO2)CCS1(=O)=O ZINC001119177984 792807240 /nfs/dbraw/zinc/80/72/40/792807240.db2.gz PLYVSSIMTSDGKP-YNEHKIRRSA-N 0 3 359.448 -1.389 20 0 FAADHN C[C@H]1CN(C(=O)C(=O)NCCN2CCN(C)C(C)(C)C2)CCS1(=O)=O ZINC001119192490 792807659 /nfs/dbraw/zinc/80/76/59/792807659.db2.gz HCFYLICIWJKINC-ZDUSSCGKSA-N 0 3 374.507 -1.226 20 0 FAADHN O=C(C(=O)N1CCNCCC12CCC2)N1CC[C@@H]2OCC(=O)N[C@H]2C1 ZINC001119347019 792809266 /nfs/dbraw/zinc/80/92/66/792809266.db2.gz HJPLLOIZBALFEX-STQMWFEESA-N 0 3 350.419 -1.153 20 0 FAADHN NC(=O)C1(N2CCCCC2)CCN(C(=O)C(=O)N2CCNCC2)CC1 ZINC001119347812 792809405 /nfs/dbraw/zinc/80/94/05/792809405.db2.gz SOBHDDBPQORMRN-UHFFFAOYSA-N 0 3 351.451 -1.249 20 0 FAADHN CN(C)C(=O)[C@H]1CCCN1CCCNC(=O)C(=O)Nc1cn(C)nn1 ZINC001119380238 792809878 /nfs/dbraw/zinc/80/98/78/792809878.db2.gz UDQTXZRQUGFJKO-LLVKDONJSA-N 0 3 351.411 -1.188 20 0 FAADHN CN(C)C(=O)[C@@H]1CCCN1CCCNC(=O)C(=O)Nc1cn(C)nn1 ZINC001119380240 792809606 /nfs/dbraw/zinc/80/96/06/792809606.db2.gz UDQTXZRQUGFJKO-NSHDSACASA-N 0 3 351.411 -1.188 20 0 FAADHN CN1CCN(CCCCNC(=O)C(=O)N[C@H]2C[C@H](S(C)(=O)=O)C2)CC1 ZINC001119462832 792811125 /nfs/dbraw/zinc/81/11/25/792811125.db2.gz DDTNXAOXTAGPPB-HDJSIYSDSA-N 0 3 374.507 -1.178 20 0 FAADHN C[C@H](CNC(=O)C(=O)NCCN1CCNC1=O)CN1CCN(C)CC1 ZINC001119464354 792810669 /nfs/dbraw/zinc/81/06/69/792810669.db2.gz KETGRGWCUCXJIA-CYBMUJFWSA-N 0 3 354.455 -1.873 20 0 FAADHN C[C@@H](CNC(=O)C(=O)NCCN1CCNC1=O)CN1CCN(C)CC1 ZINC001119464355 792810782 /nfs/dbraw/zinc/81/07/82/792810782.db2.gz KETGRGWCUCXJIA-ZDUSSCGKSA-N 0 3 354.455 -1.873 20 0 FAADHN C[C@@H]1CS(=O)(=O)C[C@@H]1NC(=O)C(=O)NCCN1CCN(C)C(C)(C)C1 ZINC001119538711 792811175 /nfs/dbraw/zinc/81/11/75/792811175.db2.gz ZSUOMNLMMDLMRI-OLZOCXBDSA-N 0 3 374.507 -1.322 20 0 FAADHN O=C(NC1CCN([C@H]2CCOC2)CC1)N1CCN2[C@@H](CNS2(=O)=O)C1 ZINC001119618309 792812082 /nfs/dbraw/zinc/81/20/82/792812082.db2.gz GMFPBNGKJSESFM-KBPBESRZSA-N 0 3 373.479 -1.217 20 0 FAADHN O=C(NC1CCN([C@@H]2CCOC2)CC1)N1CCN2[C@@H](CNS2(=O)=O)C1 ZINC001119618310 792811501 /nfs/dbraw/zinc/81/15/01/792811501.db2.gz GMFPBNGKJSESFM-KGLIPLIRSA-N 0 3 373.479 -1.217 20 0 FAADHN O=C(NC1CCN([C@H]2CCOC2)CC1)N1CCN2[C@H](CNS2(=O)=O)C1 ZINC001119618311 792812130 /nfs/dbraw/zinc/81/21/30/792812130.db2.gz GMFPBNGKJSESFM-UONOGXRCSA-N 0 3 373.479 -1.217 20 0 FAADHN O=C(NC1CCN([C@@H]2CCOC2)CC1)N1CCN2[C@H](CNS2(=O)=O)C1 ZINC001119618312 792811969 /nfs/dbraw/zinc/81/19/69/792811969.db2.gz GMFPBNGKJSESFM-ZIAGYGMSSA-N 0 3 373.479 -1.217 20 0 FAADHN CC(=O)NC1CCC(N(C)C(=O)C(=O)N2CCNCCNCC2)CC1 ZINC001119634968 792811785 /nfs/dbraw/zinc/81/17/85/792811785.db2.gz RJBTYIOFUVZMJE-UHFFFAOYSA-N 0 3 353.467 -1.087 20 0 FAADHN CC(C)NC(=O)[C@@H]1CCCN(C(=O)C(=O)N2CCNCCNCC2)C1 ZINC001119636534 792811593 /nfs/dbraw/zinc/81/15/93/792811593.db2.gz REOYMOOTAGYIHX-CQSZACIVSA-N 0 3 353.467 -1.229 20 0 FAADHN O=C(C(=O)N1CCNCCNCC1)N1CCCN(C(=O)C2CC2)CC1 ZINC001119701202 792812817 /nfs/dbraw/zinc/81/28/17/792812817.db2.gz NGWWUFLQDASHFX-UHFFFAOYSA-N 0 3 351.451 -1.521 20 0 FAADHN O=C(C(=O)N1CCNCCNCC1)N1CC[C@H](C(=O)N2CCCC2)C1 ZINC001119705655 792812936 /nfs/dbraw/zinc/81/29/36/792812936.db2.gz VWQVPLDVWSKOFP-AWEZNQCLSA-N 0 3 351.451 -1.521 20 0 FAADHN O=C(C(=O)N1CCNCCNCC1)N1CC[C@@H](C(=O)N2CCCC2)C1 ZINC001119705656 792813070 /nfs/dbraw/zinc/81/30/70/792813070.db2.gz VWQVPLDVWSKOFP-CQSZACIVSA-N 0 3 351.451 -1.521 20 0 FAADHN CN1CC[C@H]1CNC(=O)C(=O)N[C@@H]1CCN(CCN2CCOCC2)C1 ZINC001119724166 792814055 /nfs/dbraw/zinc/81/40/55/792814055.db2.gz SSNKCLFXHHZKGX-CABCVRRESA-N 0 3 353.467 -1.671 20 0 FAADHN CN1CC[C@H]1CNC(=O)C(=O)N[C@H]1CCN(CCN2CCOCC2)C1 ZINC001119724168 792813571 /nfs/dbraw/zinc/81/35/71/792813571.db2.gz SSNKCLFXHHZKGX-GJZGRUSLSA-N 0 3 353.467 -1.671 20 0 FAADHN CN1CC[C@@H]1CNC(=O)C(=O)N[C@@H]1CCN(CCN2CCOCC2)C1 ZINC001119724169 792813757 /nfs/dbraw/zinc/81/37/57/792813757.db2.gz SSNKCLFXHHZKGX-HUUCEWRRSA-N 0 3 353.467 -1.671 20 0 FAADHN CN1CC[C@@H]1CNC(=O)C(=O)N[C@H]1CCN(CCN2CCOCC2)C1 ZINC001119724171 792814275 /nfs/dbraw/zinc/81/42/75/792814275.db2.gz SSNKCLFXHHZKGX-LSDHHAIUSA-N 0 3 353.467 -1.671 20 0 FAADHN CN1CCN(C2CCN(c3nnnn3CCNS(C)(=O)=O)CC2)CC1 ZINC001119727474 792814131 /nfs/dbraw/zinc/81/41/31/792814131.db2.gz GJWGWGPTDVJCEQ-UHFFFAOYSA-N 0 3 372.499 -1.562 20 0 FAADHN COCCCN(C)CCNC(=O)C(=O)N1C[C@@H]2CS(=O)(=O)C[C@@H]2C1 ZINC001119742157 792813294 /nfs/dbraw/zinc/81/32/94/792813294.db2.gz HLPBGJMVBCKMOK-BETUJISGSA-N 0 3 361.464 -1.426 20 0 FAADHN CN1CCN(CCCCNC(=O)C(=O)N2CCOC[C@@H]2CCO)CC1 ZINC001119752223 792813399 /nfs/dbraw/zinc/81/33/99/792813399.db2.gz LUBUPYIUMKDUNC-HNNXBMFYSA-N 0 3 356.467 -1.260 20 0 FAADHN CN1CCN(CCCCNC(=O)C(=O)N2CCOC[C@H]2CCO)CC1 ZINC001119752224 792813478 /nfs/dbraw/zinc/81/34/78/792813478.db2.gz LUBUPYIUMKDUNC-OAHLLOKOSA-N 0 3 356.467 -1.260 20 0 FAADHN CCN(CCC(=O)NC)C(=O)C(=O)NC[C@H](C)CN1CCN(C)CC1 ZINC001119753403 792813624 /nfs/dbraw/zinc/81/36/24/792813624.db2.gz XOFWPIGZGNNWLF-AWEZNQCLSA-N 0 3 355.483 -1.029 20 0 FAADHN CCN(CCC(=O)NC)C(=O)C(=O)NC[C@@H](C)CN1CCN(C)CC1 ZINC001119753405 792814483 /nfs/dbraw/zinc/81/44/83/792814483.db2.gz XOFWPIGZGNNWLF-CQSZACIVSA-N 0 3 355.483 -1.029 20 0 FAADHN CN1C(=O)[C@H]2CN(C(=O)C(=O)NCCN3CCC(C)(C)C3)C[C@H]2C1=O ZINC001119876981 792814965 /nfs/dbraw/zinc/81/49/65/792814965.db2.gz HKAFBICTGPZSGF-TXEJJXNPSA-N 0 3 350.419 -1.092 20 0 FAADHN CN(C)[C@@H]1CC[C@H]2[C@@H](C1)OCCN2C(=O)[C@@H]1CS(=O)(=O)CC(=O)N1 ZINC001119889882 792815507 /nfs/dbraw/zinc/81/55/07/792815507.db2.gz CARGBQIKKXUVSY-MROQNXINSA-N 0 3 359.448 -1.390 20 0 FAADHN CN(C)[C@@H]1CC[C@H]2[C@H](C1)OCCN2C(=O)[C@@H]1CS(=O)(=O)CC(=O)N1 ZINC001119889884 792815700 /nfs/dbraw/zinc/81/57/00/792815700.db2.gz CARGBQIKKXUVSY-VOAKCMCISA-N 0 3 359.448 -1.390 20 0 FAADHN CN(C)[C@@H]1CC[C@@H]2[C@H](C1)OCCN2C(=O)[C@@H]1CS(=O)(=O)CC(=O)N1 ZINC001119889886 792815832 /nfs/dbraw/zinc/81/58/32/792815832.db2.gz CARGBQIKKXUVSY-XQHKEYJVSA-N 0 3 359.448 -1.390 20 0 FAADHN CN(C)[C@@H]1CC[C@@H]2[C@@H](C1)OCCN2C(=O)[C@@H]1CS(=O)(=O)CC(=O)N1 ZINC001119889888 792815743 /nfs/dbraw/zinc/81/57/43/792815743.db2.gz CARGBQIKKXUVSY-YVECIDJPSA-N 0 3 359.448 -1.390 20 0 FAADHN CN(CCCNC(=O)CN1CCN(C)CCN(C)CC1)S(C)(=O)=O ZINC001119956178 792815637 /nfs/dbraw/zinc/81/56/37/792815637.db2.gz FZVZLOCGJAWSHV-UHFFFAOYSA-N 0 3 363.528 -1.437 20 0 FAADHN O=C(C(=O)N1CCNCCNCC1)N1CCCS(=O)(=O)C[C@H]1C1CC1 ZINC001120270512 792816808 /nfs/dbraw/zinc/81/68/08/792816808.db2.gz NVBIMHNKHMEORH-AWEZNQCLSA-N 0 3 372.491 -1.567 20 0 FAADHN O=C(C(=O)N1CCNCCNCC1)N1CCCS(=O)(=O)C[C@@H]1C1CC1 ZINC001120270513 792817119 /nfs/dbraw/zinc/81/71/19/792817119.db2.gz NVBIMHNKHMEORH-CQSZACIVSA-N 0 3 372.491 -1.567 20 0 FAADHN CCN1CCN(C[C@@H](C)CNC(=O)C(=O)N[C@H]2CCS(=O)(=O)C2)CC1 ZINC001120280437 792817900 /nfs/dbraw/zinc/81/79/00/792817900.db2.gz HNIJBYITUFRRCK-KBPBESRZSA-N 0 3 374.507 -1.321 20 0 FAADHN CCN1CCN(C[C@H](C)CNC(=O)C(=O)N[C@H]2CCS(=O)(=O)C2)CC1 ZINC001120280440 792818010 /nfs/dbraw/zinc/81/80/10/792818010.db2.gz HNIJBYITUFRRCK-KGLIPLIRSA-N 0 3 374.507 -1.321 20 0 FAADHN CCN1CCN(C[C@@H](C)CNC(=O)C(=O)N[C@@H]2CCS(=O)(=O)C2)CC1 ZINC001120280442 792818158 /nfs/dbraw/zinc/81/81/58/792818158.db2.gz HNIJBYITUFRRCK-UONOGXRCSA-N 0 3 374.507 -1.321 20 0 FAADHN CCN1CCN(C[C@H](C)CNC(=O)C(=O)N[C@@H]2CCS(=O)(=O)C2)CC1 ZINC001120280445 792818094 /nfs/dbraw/zinc/81/80/94/792818094.db2.gz HNIJBYITUFRRCK-ZIAGYGMSSA-N 0 3 374.507 -1.321 20 0 FAADHN CN1CCN(CCNC(=O)C(=O)N[C@@H]2CCS(=O)(=O)C2)CC1(C)C ZINC001120281094 792818213 /nfs/dbraw/zinc/81/82/13/792818213.db2.gz KSXRVJGWPPKHOW-GFCCVEGCSA-N 0 3 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/nfs/dbraw/zinc/55/07/82/790550782.db2.gz BOMUCMWJKIVTCQ-XQQFMLRXSA-N 0 3 351.411 -1.143 20 0 FAADHN NC(=O)NCC(=O)N[C@@H]1CN(CC[C@@H]2CCOC2)C[C@@H]1n1ccnn1 ZINC001128681501 790550880 /nfs/dbraw/zinc/55/08/80/790550880.db2.gz CKTSYFCCEGFMOJ-UPJWGTAASA-N 0 3 351.411 -1.286 20 0 FAADHN NC(=O)NCC(=O)N[C@@H]1CN(CC[C@H]2CCOC2)C[C@@H]1n1ccnn1 ZINC001128681502 790550851 /nfs/dbraw/zinc/55/08/51/790550851.db2.gz CKTSYFCCEGFMOJ-XQQFMLRXSA-N 0 3 351.411 -1.286 20 0 FAADHN NC(=O)NCC(=O)N[C@@H]1CN(C[C@H]2CCCOC2)C[C@@H]1n1ccnn1 ZINC001128681778 790551391 /nfs/dbraw/zinc/55/13/91/790551391.db2.gz MNUXUXLRZQWJOR-UPJWGTAASA-N 0 3 351.411 -1.286 20 0 FAADHN NC(=O)NCC(=O)N[C@@H]1CN(C[C@@H]2CCCOC2)C[C@@H]1n1ccnn1 ZINC001128681780 790551026 /nfs/dbraw/zinc/55/10/26/790551026.db2.gz MNUXUXLRZQWJOR-XQQFMLRXSA-N 0 3 351.411 -1.286 20 0 FAADHN CNS(=O)(=O)CCC(=O)N[C@@H]1CN(CC2CC2)C[C@@H]1n1ccnn1 ZINC001128985810 790562263 /nfs/dbraw/zinc/56/22/63/790562263.db2.gz VASRZBJRFNZUJH-OLZOCXBDSA-N 0 3 356.452 -1.031 20 0 FAADHN CCS(=O)(=O)NCC(=O)N[C@@H]1CN(CC2CC2)C[C@@H]1n1ccnn1 ZINC001129029292 790563250 /nfs/dbraw/zinc/56/32/50/790563250.db2.gz AXLAUXJEFLFPSR-OLZOCXBDSA-N 0 3 356.452 -1.031 20 0 FAADHN CN(CC(=O)N[C@@H]1CN(CC2CC2)C[C@@H]1n1ccnn1)S(C)(=O)=O ZINC001129029485 790563427 /nfs/dbraw/zinc/56/34/27/790563427.db2.gz FKFYTJYPYCEFGB-OLZOCXBDSA-N 0 3 356.452 -1.079 20 0 FAADHN CS(=O)(=O)NCCC(=O)N[C@@H]1CN(CC2CC2)C[C@@H]1n1ccnn1 ZINC001129029866 790563116 /nfs/dbraw/zinc/56/31/16/790563116.db2.gz NFUOKIUDEBSNLG-OLZOCXBDSA-N 0 3 356.452 -1.031 20 0 FAADHN CNC(=O)NCC(=O)N[C@@H]1CN(C[C@H]2CCOC2)C[C@@H]1n1ccnn1 ZINC001129038005 790564088 /nfs/dbraw/zinc/56/40/88/790564088.db2.gz KPENMQDECLHDPR-UPJWGTAASA-N 0 3 351.411 -1.415 20 0 FAADHN CNC(=O)NCC(=O)N[C@@H]1CN(C[C@@H]2CCOC2)C[C@@H]1n1ccnn1 ZINC001129038006 790564808 /nfs/dbraw/zinc/56/48/08/790564808.db2.gz KPENMQDECLHDPR-XQQFMLRXSA-N 0 3 351.411 -1.415 20 0 FAADHN CNC(=O)NCC(=O)N[C@@H]1CN(CCCCOC)C[C@@H]1n1ccnn1 ZINC001129038087 790565023 /nfs/dbraw/zinc/56/50/23/790565023.db2.gz PGLYKAHALQJGOC-OLZOCXBDSA-N 0 3 353.427 -1.025 20 0 FAADHN CNC(=O)CN1C[C@@H](NC(=O)[C@H](C(C)C)N(C)C)[C@@H](n2ccnn2)C1 ZINC001129060407 790565619 /nfs/dbraw/zinc/56/56/19/790565619.db2.gz QNFQFGQXQZCEOA-IPYPFGDCSA-N 0 3 351.455 -1.048 20 0 FAADHN CC[C@H](C(=O)N[C@@H]1CN(CCOCCO)C[C@@H]1n1ccnn1)N(C)C ZINC001129065023 790566238 /nfs/dbraw/zinc/56/62/38/790566238.db2.gz QTIUGLRSYIHZNP-KFWWJZLASA-N 0 3 354.455 -1.031 20 0 FAADHN CC[C@H](C(=O)N[C@@H]1CN(C[C@@H](O)COC)C[C@@H]1n1ccnn1)N(C)C ZINC001129065547 790565823 /nfs/dbraw/zinc/56/58/23/790565823.db2.gz YJNZZYRXSHDTFD-TUVASFSCSA-N 0 3 354.455 -1.033 20 0 FAADHN CC[C@H](C(=O)N[C@@H]1CN(C[C@H](O)COC)C[C@@H]1n1ccnn1)N(C)C ZINC001129065548 790566344 /nfs/dbraw/zinc/56/63/44/790566344.db2.gz YJNZZYRXSHDTFD-YJNKXOJESA-N 0 3 354.455 -1.033 20 0 FAADHN CNS(=O)(=O)NCC(=O)N[C@@H]1CN(CCC2CC2)C[C@@H]1n1ccnn1 ZINC001129127412 790567499 /nfs/dbraw/zinc/56/74/99/790567499.db2.gz BNOKAHKYWOAURO-OLZOCXBDSA-N 0 3 371.467 -1.527 20 0 FAADHN CNS(=O)(=O)NCC(=O)N[C@@H]1CN(CC2CCC2)C[C@@H]1n1ccnn1 ZINC001129127441 790567278 /nfs/dbraw/zinc/56/72/78/790567278.db2.gz CHVKXFXKTVIDJA-OLZOCXBDSA-N 0 3 371.467 -1.527 20 0 FAADHN CNS(=O)(=O)NCC(=O)N[C@@H]1CN(CC2CC2)C[C@@H]1n1ccnn1 ZINC001129127500 790567365 /nfs/dbraw/zinc/56/73/65/790567365.db2.gz FXVXCTWNJNRCRI-NEPJUHHUSA-N 0 3 357.440 -1.917 20 0 FAADHN CNS(=O)(=O)NCC(=O)N[C@@H]1CN(CC(C)C)C[C@@H]1n1ccnn1 ZINC001129128527 790567253 /nfs/dbraw/zinc/56/72/53/790567253.db2.gz ZNRRITPLWXDWSJ-NEPJUHHUSA-N 0 3 359.456 -1.671 20 0 FAADHN CCCCN1C[C@@H](NC(=O)CNS(=O)(=O)NC)[C@@H](n2ccnn2)C1 ZINC001129128601 790566980 /nfs/dbraw/zinc/56/69/80/790566980.db2.gz ZULSSHOLHOIZTG-NEPJUHHUSA-N 0 3 359.456 -1.527 20 0 FAADHN COC[C@H](O)CN1C[C@@H](NC(=O)[C@H]2CCCN2C)[C@@H](n2ccnn2)C1 ZINC001129147545 790569021 /nfs/dbraw/zinc/56/90/21/790569021.db2.gz FDTFPXJEXDAYBJ-TUVASFSCSA-N 0 3 352.439 -1.279 20 0 FAADHN COC[C@@H](O)CN1C[C@@H](NC(=O)[C@H]2CCCN2C)[C@@H](n2ccnn2)C1 ZINC001129147546 790568875 /nfs/dbraw/zinc/56/88/75/790568875.db2.gz FDTFPXJEXDAYBJ-YJNKXOJESA-N 0 3 352.439 -1.279 20 0 FAADHN CNC(=O)CN1C[C@@H](NC(=O)[C@@H](C(C)C)N(C)C)[C@@H](n2ccnn2)C1 ZINC001129253185 790572230 /nfs/dbraw/zinc/57/22/30/790572230.db2.gz QNFQFGQXQZCEOA-VNHYZAJKSA-N 0 3 351.455 -1.048 20 0 FAADHN CC[C@@H](C(=O)N[C@@H]1CN(CCOCCO)C[C@@H]1n1ccnn1)N(C)C ZINC001129271827 790572118 /nfs/dbraw/zinc/57/21/18/790572118.db2.gz QTIUGLRSYIHZNP-ILXRZTDVSA-N 0 3 354.455 -1.031 20 0 FAADHN CC[C@@H](C(=O)N[C@@H]1CN(C[C@@H](O)COC)C[C@@H]1n1ccnn1)N(C)C ZINC001129272136 790572089 /nfs/dbraw/zinc/57/20/89/790572089.db2.gz YJNZZYRXSHDTFD-KBXIAJHMSA-N 0 3 354.455 -1.033 20 0 FAADHN CC[C@@H](C(=O)N[C@@H]1CN(C[C@H](O)COC)C[C@@H]1n1ccnn1)N(C)C ZINC001129272140 790572259 /nfs/dbraw/zinc/57/22/59/790572259.db2.gz YJNZZYRXSHDTFD-XGUBFFRZSA-N 0 3 354.455 -1.033 20 0 FAADHN C[C@@H](NS(C)(=O)=O)C(=O)N[C@@H]1CN(CC2CC2)C[C@@H]1n1ccnn1 ZINC001129284795 790575211 /nfs/dbraw/zinc/57/52/11/790575211.db2.gz YBRLNKFVPKDPAH-RTXFEEFZSA-N 0 3 356.452 -1.033 20 0 FAADHN C[C@H](NS(C)(=O)=O)C(=O)N[C@@H]1CN(CC2CC2)C[C@@H]1n1ccnn1 ZINC001129284796 790575292 /nfs/dbraw/zinc/57/52/92/790575292.db2.gz YBRLNKFVPKDPAH-UHTWSYAYSA-N 0 3 356.452 -1.033 20 0 FAADHN CN(C)S(=O)(=O)NCC(=O)N[C@@H]1CN(CC2CC2)C[C@@H]1n1ccnn1 ZINC001129288694 790575896 /nfs/dbraw/zinc/57/58/96/790575896.db2.gz JVTWFGIOGSNVFF-OLZOCXBDSA-N 0 3 371.467 -1.574 20 0 FAADHN O=C(CCN1CCOCC1)N[C@@H]1CN(CCCO)C[C@@H]1n1ccnn1 ZINC001129322726 790660598 /nfs/dbraw/zinc/66/05/98/790660598.db2.gz WNXYNCVKNORBJM-CABCVRRESA-N 0 3 352.439 -1.276 20 0 FAADHN CCN(CC)CC(=O)N[C@@H]1CN(C[C@@H](O)COC)C[C@@H]1n1ccnn1 ZINC001129333858 790702623 /nfs/dbraw/zinc/70/26/23/790702623.db2.gz TVCACSPGOWREAH-KFWWJZLASA-N 0 3 354.455 -1.031 20 0 FAADHN CCN(CC)CC(=O)N[C@@H]1CN(C[C@H](O)COC)C[C@@H]1n1ccnn1 ZINC001129333861 790702591 /nfs/dbraw/zinc/70/25/91/790702591.db2.gz TVCACSPGOWREAH-ZNMIVQPWSA-N 0 3 354.455 -1.031 20 0 FAADHN CCN(CC)CC(=O)N[C@@H]1CN(CCOCCO)C[C@@H]1n1ccnn1 ZINC001129337849 790703819 /nfs/dbraw/zinc/70/38/19/790703819.db2.gz ZZJWXGSCHYYITF-CABCVRRESA-N 0 3 354.455 -1.030 20 0 FAADHN O=C(Cc1nnc[nH]1)N[C@@H]1CN(CCOCCO)C[C@@H]1n1ccnn1 ZINC001129376196 790711953 /nfs/dbraw/zinc/71/19/53/790711953.db2.gz SHSFCKUSMISIHS-NEPJUHHUSA-N 0 3 350.383 -2.011 20 0 FAADHN CCCN(C)CC(=O)N[C@@H]1CN(C[C@@H](O)COC)C[C@@H]1n1ccnn1 ZINC001129407765 790757792 /nfs/dbraw/zinc/75/77/92/790757792.db2.gz WGKDHHKPUFATFL-KFWWJZLASA-N 0 3 354.455 -1.031 20 0 FAADHN CCCN(C)CC(=O)N[C@@H]1CN(C[C@H](O)COC)C[C@@H]1n1ccnn1 ZINC001129407766 790757847 /nfs/dbraw/zinc/75/78/47/790757847.db2.gz WGKDHHKPUFATFL-ZNMIVQPWSA-N 0 3 354.455 -1.031 20 0 FAADHN CCCN(C)CC(=O)N[C@@H]1CN(CCOCCO)C[C@@H]1n1ccnn1 ZINC001129407981 790757357 /nfs/dbraw/zinc/75/73/57/790757357.db2.gz ZEHLZSYEDMFSAO-CABCVRRESA-N 0 3 354.455 -1.030 20 0 FAADHN NC(=O)NCCC(=O)N[C@@H]1CN(C[C@H]2CCOC2)C[C@@H]1n1ccnn1 ZINC001129427653 790757186 /nfs/dbraw/zinc/75/71/86/790757186.db2.gz GGRDDERWOBEXKN-UPJWGTAASA-N 0 3 351.411 -1.286 20 0 FAADHN NC(=O)NCCC(=O)N[C@@H]1CN(C[C@@H]2CCOC2)C[C@@H]1n1ccnn1 ZINC001129427654 790757486 /nfs/dbraw/zinc/75/74/86/790757486.db2.gz GGRDDERWOBEXKN-XQQFMLRXSA-N 0 3 351.411 -1.286 20 0 FAADHN O=C(CN1CCCC1)N[C@@H]1CN(CCOCCO)C[C@@H]1n1ccnn1 ZINC001129433468 790759077 /nfs/dbraw/zinc/75/90/77/790759077.db2.gz AZRQUGIWURATFG-CABCVRRESA-N 0 3 352.439 -1.276 20 0 FAADHN COC[C@H](O)CN1C[C@@H](NC(=O)CN2CCCC2)[C@@H](n2ccnn2)C1 ZINC001129433716 790758868 /nfs/dbraw/zinc/75/88/68/790758868.db2.gz OBGOIWGYCIOCNC-KFWWJZLASA-N 0 3 352.439 -1.277 20 0 FAADHN COC[C@@H](O)CN1C[C@@H](NC(=O)CN2CCCC2)[C@@H](n2ccnn2)C1 ZINC001129433717 790759528 /nfs/dbraw/zinc/75/95/28/790759528.db2.gz OBGOIWGYCIOCNC-ZNMIVQPWSA-N 0 3 352.439 -1.277 20 0 FAADHN C[C@H](CN1CCOCC1)C(=O)N[C@@H]1CN(CCO)C[C@@H]1n1ccnn1 ZINC001129433801 790759580 /nfs/dbraw/zinc/75/95/80/790759580.db2.gz SOBLFDDSRFFOOF-KFWWJZLASA-N 0 3 352.439 -1.420 20 0 FAADHN C[C@@H](CN1CCOCC1)C(=O)N[C@@H]1CN(CCO)C[C@@H]1n1ccnn1 ZINC001129433802 790759322 /nfs/dbraw/zinc/75/93/22/790759322.db2.gz SOBLFDDSRFFOOF-ZNMIVQPWSA-N 0 3 352.439 -1.420 20 0 FAADHN CC(C)N(C)CC(=O)N[C@@H]1CN(CCOCCO)C[C@@H]1n1ccnn1 ZINC001129459961 790760949 /nfs/dbraw/zinc/76/09/49/790760949.db2.gz FDJPDLZAGRFOMY-CABCVRRESA-N 0 3 354.455 -1.031 20 0 FAADHN COC[C@H](O)CN1C[C@@H](NC(=O)CN(C)C(C)C)[C@@H](n2ccnn2)C1 ZINC001129461232 790760819 /nfs/dbraw/zinc/76/08/19/790760819.db2.gz SGGKTBRTFHPLDL-KFWWJZLASA-N 0 3 354.455 -1.033 20 0 FAADHN COC[C@@H](O)CN1C[C@@H](NC(=O)CN(C)C(C)C)[C@@H](n2ccnn2)C1 ZINC001129461237 790760641 /nfs/dbraw/zinc/76/06/41/790760641.db2.gz SGGKTBRTFHPLDL-ZNMIVQPWSA-N 0 3 354.455 -1.033 20 0 FAADHN COCC(=O)N1C[C@@H](NCCNC(=O)NC(C)C)[C@@H](n2ccnn2)C1 ZINC001129490341 790761989 /nfs/dbraw/zinc/76/19/89/790761989.db2.gz CNLGHUBUQCOIGU-OLZOCXBDSA-N 0 3 353.427 -1.026 20 0 FAADHN COCC(=O)N1C[C@@H](NCCOCCNC(C)=O)[C@@H](n2ccnn2)C1 ZINC001129490986 790761940 /nfs/dbraw/zinc/76/19/40/790761940.db2.gz YFIIMEGIXRNUFX-KGLIPLIRSA-N 0 3 354.411 -1.581 20 0 FAADHN COCC(=O)N1C[C@@H](NC[C@@H](C)CS(C)(=O)=O)[C@@H](n2ccnn2)C1 ZINC001129497084 790762631 /nfs/dbraw/zinc/76/26/31/790762631.db2.gz YZHOFZVBWWEOCW-UPJWGTAASA-N 0 3 359.452 -1.053 20 0 FAADHN COCC(=O)N1C[C@@H](NC[C@H](C)CS(C)(=O)=O)[C@@H](n2ccnn2)C1 ZINC001129497086 790762017 /nfs/dbraw/zinc/76/20/17/790762017.db2.gz YZHOFZVBWWEOCW-XQQFMLRXSA-N 0 3 359.452 -1.053 20 0 FAADHN CC(=O)N1C[C@@H](NC[C@@H](O)CN2C(=O)CCC2=O)[C@@H](n2ccnn2)C1 ZINC001129516611 790761888 /nfs/dbraw/zinc/76/18/88/790761888.db2.gz WILKJJATIKDDMQ-UPJWGTAASA-N 0 3 350.379 -1.851 20 0 FAADHN CC(=O)N1C[C@@H](NC[C@H](O)CN2C(=O)CCC2=O)[C@@H](n2ccnn2)C1 ZINC001129516612 790762356 /nfs/dbraw/zinc/76/23/56/790762356.db2.gz WILKJJATIKDDMQ-XQQFMLRXSA-N 0 3 350.379 -1.851 20 0 FAADHN COCCC(=O)N1C[C@@H](NCCN2CCNC2=O)[C@@H](n2ccnn2)C1 ZINC001129521515 790762168 /nfs/dbraw/zinc/76/21/68/790762168.db2.gz JVHBFANRCVMNIE-OLZOCXBDSA-N 0 3 351.411 -1.319 20 0 FAADHN COCCOCCN[C@@H]1CN(C(=O)CNC(C)=O)C[C@@H]1n1ccnn1 ZINC001129537267 790763676 /nfs/dbraw/zinc/76/36/76/790763676.db2.gz PPLAYTNRQVXBQL-KGLIPLIRSA-N 0 3 354.411 -1.581 20 0 FAADHN O=C(C1=COCCO1)N1C[C@@H](NCCOCCO)[C@@H](n2ccnn2)C1 ZINC001129547596 790763565 /nfs/dbraw/zinc/76/35/65/790763565.db2.gz GYPVVCMYGSTRKK-OLZOCXBDSA-N 0 3 353.379 -1.483 20 0 FAADHN CC(=O)N[C@H](C)C(=O)N1C[C@@H](NCCOCCO)[C@@H](n2ccnn2)C1 ZINC001129547603 790764062 /nfs/dbraw/zinc/76/40/62/790764062.db2.gz HGCAEOAJBPGCFL-BNOWGMLFSA-N 0 3 354.411 -1.847 20 0 FAADHN CC(=O)N[C@@H](C)C(=O)N1C[C@@H](NCCOCCO)[C@@H](n2ccnn2)C1 ZINC001129547604 790763359 /nfs/dbraw/zinc/76/33/59/790763359.db2.gz HGCAEOAJBPGCFL-YUTCNCBUSA-N 0 3 354.411 -1.847 20 0 FAADHN NC(=O)NCC(=O)N1C[C@@H](NCCOCC2CC2)[C@@H](n2ccnn2)C1 ZINC001129556520 790763776 /nfs/dbraw/zinc/76/37/76/790763776.db2.gz PFKBNPWWSAFKAK-OLZOCXBDSA-N 0 3 351.411 -1.286 20 0 FAADHN O=C(Cn1cnnn1)N1C[C@@H](NCCOCCO)[C@@H](n2ccnn2)C1 ZINC001129556776 790763303 /nfs/dbraw/zinc/76/33/03/790763303.db2.gz SXTLSQIZHOAUAP-NEPJUHHUSA-N 0 3 351.371 -2.685 20 0 FAADHN CCOCC(=O)N1C[C@@H](NCCN2CCNC2=O)[C@@H](n2ccnn2)C1 ZINC001129565269 790765028 /nfs/dbraw/zinc/76/50/28/790765028.db2.gz VLEZQPMELMNZLK-OLZOCXBDSA-N 0 3 351.411 -1.319 20 0 FAADHN NC(=O)NCC(=O)N1C[C@@H](NCCOC2CCC2)[C@@H](n2ccnn2)C1 ZINC001129577935 790764618 /nfs/dbraw/zinc/76/46/18/790764618.db2.gz BHWXFXJMMQESLN-OLZOCXBDSA-N 0 3 351.411 -1.143 20 0 FAADHN COCCOCCN[C@@H]1CN(C(=O)CNC(N)=O)C[C@@H]1n1ccnn1 ZINC001129578010 790765337 /nfs/dbraw/zinc/76/53/37/790765337.db2.gz CWZJUDUZHQHOEI-NEPJUHHUSA-N 0 3 355.399 -2.049 20 0 FAADHN NC(=O)NCC(=O)N1C[C@@H](NCCOCC(F)F)[C@@H](n2ccnn2)C1 ZINC001129578065 790765072 /nfs/dbraw/zinc/76/50/72/790765072.db2.gz FRQCQANXEVBZJV-ZJUUUORDSA-N 0 3 361.353 -1.430 20 0 FAADHN NC(=O)NCC(=O)N1C[C@@H](NCCc2ccns2)[C@@H](n2ccnn2)C1 ZINC001129578220 790764476 /nfs/dbraw/zinc/76/44/76/790764476.db2.gz HZGQRTQKTQRSJE-NEPJUHHUSA-N 0 3 364.435 -1.013 20 0 FAADHN CC(C)COCCN[C@@H]1CN(C(=O)CNC(N)=O)C[C@@H]1n1ccnn1 ZINC001129578578 790764844 /nfs/dbraw/zinc/76/48/44/790764844.db2.gz OCAYWRLLVADYRI-OLZOCXBDSA-N 0 3 353.427 -1.040 20 0 FAADHN O=C([C@H]1COCCO1)N1C[C@@H](NCCOCCO)[C@@H](n2ccnn2)C1 ZINC001129594835 790766356 /nfs/dbraw/zinc/76/63/56/790766356.db2.gz SEZYVGLWDJNLAL-HZSPNIEDSA-N 0 3 355.395 -1.956 20 0 FAADHN O=C([C@@H]1COCCO1)N1C[C@@H](NCCOCCO)[C@@H](n2ccnn2)C1 ZINC001129594838 790767556 /nfs/dbraw/zinc/76/75/56/790767556.db2.gz SEZYVGLWDJNLAL-RDBSUJKOSA-N 0 3 355.395 -1.956 20 0 FAADHN CS(=O)(=O)NCCN[C@@H]1CN(C(=O)c2ccn[nH]2)C[C@@H]1n1ccnn1 ZINC001129603922 790766103 /nfs/dbraw/zinc/76/61/03/790766103.db2.gz PVJJTQHHPBYWJK-NEPJUHHUSA-N 0 3 368.423 -1.794 20 0 FAADHN CC(=O)N(C)CC(=O)N1C[C@@H](NCCOCCO)[C@@H](n2ccnn2)C1 ZINC001129603957 790766275 /nfs/dbraw/zinc/76/62/75/790766275.db2.gz QXHYQYFDMPDOJX-KGLIPLIRSA-N 0 3 354.411 -1.893 20 0 FAADHN O=C(c1cnsn1)N1C[C@@H](NCCOCCO)[C@@H](n2ccnn2)C1 ZINC001129608058 790766569 /nfs/dbraw/zinc/76/65/69/790766569.db2.gz JYOKFKOQYJAYBQ-NEPJUHHUSA-N 0 3 353.408 -1.206 20 0 FAADHN O=C(c1cnns1)N1C[C@@H](NCCOCCO)[C@@H](n2ccnn2)C1 ZINC001129608343 790766620 /nfs/dbraw/zinc/76/66/20/790766620.db2.gz OFABFCUJAIVOKY-MNOVXSKESA-N 0 3 353.408 -1.206 20 0 FAADHN COC(=O)NCC(=O)N1C[C@@H](NCCOCCO)[C@@H](n2ccnn2)C1 ZINC001129633255 790767885 /nfs/dbraw/zinc/76/78/85/790767885.db2.gz IIWGGALVDKMNIK-NEPJUHHUSA-N 0 3 356.383 -2.016 20 0 FAADHN CS(=O)(=O)CC(=O)N1C[C@@H](NCCOCCO)[C@@H](n2ccnn2)C1 ZINC001129650902 790768789 /nfs/dbraw/zinc/76/87/89/790768789.db2.gz LTMYLFMBZSYOLW-NEPJUHHUSA-N 0 3 361.424 -2.327 20 0 FAADHN COC[C@@H](O)CN[C@@H]1CN(C(=O)CS(C)(=O)=O)C[C@@H]1n1ccnn1 ZINC001129651784 790769306 /nfs/dbraw/zinc/76/93/06/790769306.db2.gz VHZUMULSBOHSPF-TUAOUCFPSA-N 0 3 361.424 -2.329 20 0 FAADHN COC[C@H](O)CN[C@@H]1CN(C(=O)CS(C)(=O)=O)C[C@@H]1n1ccnn1 ZINC001129651785 790769056 /nfs/dbraw/zinc/76/90/56/790769056.db2.gz VHZUMULSBOHSPF-UTUOFQBUSA-N 0 3 361.424 -2.329 20 0 FAADHN O=C([C@H]1CCC(=O)N1)N1C[C@@H](NCCOCCO)[C@@H](n2ccnn2)C1 ZINC001129671157 790767360 /nfs/dbraw/zinc/76/73/60/790767360.db2.gz HAPOVUSRCPOMRY-UPJWGTAASA-N 0 3 352.395 -2.093 20 0 FAADHN CCC(=O)NCC(=O)N1C[C@@H](NCCOCCO)[C@@H](n2ccnn2)C1 ZINC001129683934 790769046 /nfs/dbraw/zinc/76/90/46/790769046.db2.gz CTINZSMQJPXWQS-OLZOCXBDSA-N 0 3 354.411 -1.845 20 0 FAADHN COCCOCC(=O)N1C[C@@H](NCCOCCO)[C@@H](n2ccnn2)C1 ZINC001129696038 790770809 /nfs/dbraw/zinc/77/08/09/790770809.db2.gz KMIKBDHLVNUBQY-KGLIPLIRSA-N 0 3 357.411 -1.709 20 0 FAADHN CS(=O)(=O)CCCN[C@@H]1CN(C(=O)CC(N)=O)C[C@@H]1n1ccnn1 ZINC001129699383 790770613 /nfs/dbraw/zinc/77/06/13/790770613.db2.gz UAXGHARMAOAJLF-MNOVXSKESA-N 0 3 358.424 -2.070 20 0 FAADHN O=C(Cc1ccon1)N1C[C@@H](NCCOCCO)[C@@H](n2ccnn2)C1 ZINC001129703717 790770412 /nfs/dbraw/zinc/77/04/12/790770412.db2.gz KNLRRZJTNIHWCN-KGLIPLIRSA-N 0 3 350.379 -1.141 20 0 FAADHN NC(=O)CC(=O)N1C[C@@H](NCCO[C@@H]2CC2(F)F)[C@@H](n2ccnn2)C1 ZINC001129703938 790770276 /nfs/dbraw/zinc/77/02/76/790770276.db2.gz PCQYSDIZNIDISW-OUAUKWLOSA-N 0 3 358.349 -1.081 20 0 FAADHN NC(=O)CC(=O)N1C[C@@H](NCCO[C@H]2CC2(F)F)[C@@H](n2ccnn2)C1 ZINC001129703939 790770361 /nfs/dbraw/zinc/77/03/61/790770361.db2.gz PCQYSDIZNIDISW-VWYCJHECSA-N 0 3 358.349 -1.081 20 0 FAADHN CS(=O)(=O)CCN[C@@H]1CN(C(=O)Cc2ccn[nH]2)C[C@@H]1n1ccnn1 ZINC001129707987 790771981 /nfs/dbraw/zinc/77/19/81/790771981.db2.gz FBYJRJPFAOZVPH-OLZOCXBDSA-N 0 3 367.435 -1.370 20 0 FAADHN CCOCCN[C@@H]1CN(C(=O)[C@@H]2CN(C)CCO2)C[C@@H]1n1ccnn1 ZINC001129717662 790771450 /nfs/dbraw/zinc/77/14/50/790771450.db2.gz ONRHLZSLQBWFDG-ILXRZTDVSA-N 0 3 352.439 -1.013 20 0 FAADHN CCOCCN[C@@H]1CN(C(=O)[C@H]2CN(C)CCO2)C[C@@H]1n1ccnn1 ZINC001129717663 790772134 /nfs/dbraw/zinc/77/21/34/790772134.db2.gz ONRHLZSLQBWFDG-QLFBSQMISA-N 0 3 352.439 -1.013 20 0 FAADHN CCOCCN[C@@H]1CN(C(=O)CN2CCOCC2)C[C@@H]1n1ccnn1 ZINC001129753740 790771712 /nfs/dbraw/zinc/77/17/12/790771712.db2.gz PNJRALWNXPSMII-CABCVRRESA-N 0 3 352.439 -1.012 20 0 FAADHN CCOCCN[C@@H]1CN(C(=O)[C@@H]2COCCN2C)C[C@@H]1n1ccnn1 ZINC001129753797 790771551 /nfs/dbraw/zinc/77/15/51/790771551.db2.gz QGHKFBLMPBJFRP-ILXRZTDVSA-N 0 3 352.439 -1.013 20 0 FAADHN CCOCCN[C@@H]1CN(C(=O)[C@H]2COCCN2C)C[C@@H]1n1ccnn1 ZINC001129753798 790772080 /nfs/dbraw/zinc/77/20/80/790772080.db2.gz QGHKFBLMPBJFRP-QLFBSQMISA-N 0 3 352.439 -1.013 20 0 FAADHN CCOCCN[C@@H]1CN(C(=O)CN2CN=NC2=O)C[C@@H]1n1ccnn1 ZINC001129756604 790771605 /nfs/dbraw/zinc/77/16/05/790771605.db2.gz BSYAEYYUIGPXKL-NEPJUHHUSA-N 0 3 350.383 -1.347 20 0 FAADHN O=C(C1=CCOCC1)N1C[C@@H](NCCOCCO)[C@@H](n2ccnn2)C1 ZINC001129763196 790771691 /nfs/dbraw/zinc/77/16/91/790771691.db2.gz XHOVWSQDIXTXDZ-CABCVRRESA-N 0 3 351.407 -1.025 20 0 FAADHN CNC(=O)CC(=O)N1C[C@@H](NCCOCCOC)[C@@H](n2ccnn2)C1 ZINC001129771195 790773213 /nfs/dbraw/zinc/77/32/13/790773213.db2.gz VYLQRADYTBJISV-OLZOCXBDSA-N 0 3 354.411 -1.581 20 0 FAADHN C[C@H](NC(N)=O)C(=O)N1C[C@@H](NCCOCCO)[C@@H](n2ccnn2)C1 ZINC001129782387 790773296 /nfs/dbraw/zinc/77/32/96/790773296.db2.gz JJMKMNDPXMVODD-TUAOUCFPSA-N 0 3 355.399 -2.315 20 0 FAADHN Cn1cc([C@@H]2OCCC[C@H]2C(=O)NCCNCC(=O)NC(N)=O)cn1 ZINC001129787110 790774249 /nfs/dbraw/zinc/77/42/49/790774249.db2.gz HKNOITQKKPNTAC-YPMHNXCESA-N 0 3 352.395 -1.212 20 0 FAADHN Cn1nncc1C(=O)N1C[C@@H](NCCOCCO)[C@@H](n2ccnn2)C1 ZINC001129791381 790773321 /nfs/dbraw/zinc/77/33/21/790773321.db2.gz BLCVDAJRGPYATH-YPMHNXCESA-N 0 3 350.383 -1.929 20 0 FAADHN O=C([C@H]1COC(=O)N1)N1C[C@@H](NCCOCCO)[C@@H](n2ccnn2)C1 ZINC001129795498 790773287 /nfs/dbraw/zinc/77/32/87/790773287.db2.gz KXFPPSMCDLWFOZ-UTUOFQBUSA-N 0 3 354.367 -2.263 20 0 FAADHN O=C([C@@H]1COC(=O)N1)N1C[C@@H](NCCOCCO)[C@@H](n2ccnn2)C1 ZINC001129795503 790773345 /nfs/dbraw/zinc/77/33/45/790773345.db2.gz KXFPPSMCDLWFOZ-WOPDTQHZSA-N 0 3 354.367 -2.263 20 0 FAADHN Cn1ccnc1[C@@H]1OCCC[C@H]1C(=O)NCCNCC(=O)NC(N)=O ZINC001129797534 790773277 /nfs/dbraw/zinc/77/32/77/790773277.db2.gz JAGCPBRWPKXBLA-ZYHUDNBSSA-N 0 3 352.395 -1.212 20 0 FAADHN CCNC(=O)CC(=O)N1C[C@@H](NCCOCCO)[C@@H](n2ccnn2)C1 ZINC001129798124 790773141 /nfs/dbraw/zinc/77/31/41/790773141.db2.gz NMOWPZCPMYMXQP-OLZOCXBDSA-N 0 3 354.411 -1.845 20 0 FAADHN Cn1cc(C(=O)N2C[C@@H](NCCOCCO)[C@@H](n3ccnn3)C2)nn1 ZINC001129803473 790774726 /nfs/dbraw/zinc/77/47/26/790774726.db2.gz NBXOKQAUOACUEE-YPMHNXCESA-N 0 3 350.383 -1.929 20 0 FAADHN C[C@@H]1OCCO[C@@H]1C(=O)NCCNCC(=O)N(C)Cc1cnn(C)c1 ZINC001129805896 790774786 /nfs/dbraw/zinc/77/47/86/790774786.db2.gz AECOIDSVRDPQTL-WFASDCNBSA-N 0 3 353.423 -1.112 20 0 FAADHN C[C@@H]1OCCO[C@@H]1C(=O)NCCNCC(=O)N1CCC(C(N)=O)CC1 ZINC001129806111 790774116 /nfs/dbraw/zinc/77/41/16/790774116.db2.gz CTBBPDLVLAIXDI-FZMZJTMJSA-N 0 3 356.423 -1.780 20 0 FAADHN Cn1cnc(C(=O)N2C[C@@H](NCCOCCO)[C@@H](n3ccnn3)C2)n1 ZINC001129807384 790774508 /nfs/dbraw/zinc/77/45/08/790774508.db2.gz JKVWKKJKBIWXMK-NEPJUHHUSA-N 0 3 350.383 -1.929 20 0 FAADHN CCOCCN[C@@H]1CN(C(=O)CCNC(=O)NC)C[C@@H]1n1ccnn1 ZINC001129808058 790774290 /nfs/dbraw/zinc/77/42/90/790774290.db2.gz YTFPZVGWEROVRN-OLZOCXBDSA-N 0 3 353.427 -1.025 20 0 FAADHN COCCCS(=O)(=O)NCCNCCNC(=O)[C@H]1OCCO[C@H]1C ZINC001129808972 790774603 /nfs/dbraw/zinc/77/46/03/790774603.db2.gz AMNJUWXHNBNFSP-STQMWFEESA-N 0 3 367.468 -1.548 20 0 FAADHN C[C@@H]1OCCO[C@@H]1C(=O)NCCNCC(=O)N1CCC[C@H](C(N)=O)C1 ZINC001129809138 790774554 /nfs/dbraw/zinc/77/45/54/790774554.db2.gz DBRVWGYUMODZSC-OBJOEFQTSA-N 0 3 356.423 -1.780 20 0 FAADHN C[C@@H]1OCCO[C@@H]1C(=O)NCCNCC(=O)N1CCC[C@@H](C(N)=O)C1 ZINC001129809139 790774774 /nfs/dbraw/zinc/77/47/74/790774774.db2.gz DBRVWGYUMODZSC-SCRDCRAPSA-N 0 3 356.423 -1.780 20 0 FAADHN CC(=O)N1CCN(C(=O)CNCCNC(=O)[C@H]2OCCO[C@H]2C)CC1 ZINC001129809376 790774403 /nfs/dbraw/zinc/77/44/03/790774403.db2.gz GENUSKMEXDRAJG-WFASDCNBSA-N 0 3 356.423 -1.813 20 0 FAADHN COC[C@H](C)NC(=O)NC(=O)CNCCNC(=O)[C@H]1OCCO[C@H]1C ZINC001129810002 790774475 /nfs/dbraw/zinc/77/44/75/790774475.db2.gz OBZOVNQDWPDHBB-GVXVVHGQSA-N 0 3 360.411 -1.643 20 0 FAADHN COC[C@@H](C)NC(=O)NC(=O)CNCCNC(=O)[C@H]1OCCO[C@H]1C ZINC001129810003 790774656 /nfs/dbraw/zinc/77/46/56/790774656.db2.gz OBZOVNQDWPDHBB-MDZLAQPJSA-N 0 3 360.411 -1.643 20 0 FAADHN C[C@@H]1OCCO[C@@H]1C(=O)NCCNCC(=O)NC(=O)NCC(F)(F)F ZINC001129810458 790774361 /nfs/dbraw/zinc/77/43/61/790774361.db2.gz XZTCZGLPAITCOX-WPRPVWTQSA-N 0 3 370.328 -1.116 20 0 FAADHN O=C(CC1(O)CCC1)N1C[C@@H](NCCOCCO)[C@@H](n2ccnn2)C1 ZINC001129824741 790774181 /nfs/dbraw/zinc/77/41/81/790774181.db2.gz ANGMXTUDSJYDKJ-KGLIPLIRSA-N 0 3 353.423 -1.066 20 0 FAADHN CNS(=O)(=O)CCC(=O)N1C[C@@H](NCCOC)[C@@H](n2ccnn2)C1 ZINC001129844176 790775712 /nfs/dbraw/zinc/77/57/12/790775712.db2.gz DXJYCJIVSHOLSI-NEPJUHHUSA-N 0 3 360.440 -1.795 20 0 FAADHN CS(=O)(=O)CC1(CC(=O)N2C[C@@H](NCCO)[C@@H](n3ccnn3)C2)CC1 ZINC001129845217 790775727 /nfs/dbraw/zinc/77/57/27/790775727.db2.gz PNAJJZYWSDMPNT-OLZOCXBDSA-N 0 3 371.463 -1.173 20 0 FAADHN O=C(CNC(=O)N1CCCC1)N1C[C@@H](NCCO)[C@@H](n2ccnn2)C1 ZINC001129846346 790776081 /nfs/dbraw/zinc/77/60/81/790776081.db2.gz YFGQYDQFDPVTTO-OLZOCXBDSA-N 0 3 351.411 -1.583 20 0 FAADHN O=C(Cn1ncnn1)N1C[C@@H](NCCOCCO)[C@@H](n2ccnn2)C1 ZINC001129856118 790775545 /nfs/dbraw/zinc/77/55/45/790775545.db2.gz XQZWOAUUOGHJPT-NEPJUHHUSA-N 0 3 351.371 -2.685 20 0 FAADHN CCn1nccc1[C@@H]1OCC[C@H]1C(=O)NCCNCC(=O)NC(N)=O ZINC001129859935 790775756 /nfs/dbraw/zinc/77/57/56/790775756.db2.gz OGNAMBZDWRIHPY-ZWNOBZJWSA-N 0 3 352.395 -1.119 20 0 FAADHN CCOCCN[C@@H]1CN(C(=O)C2CS(=O)(=O)C2)C[C@@H]1n1ccnn1 ZINC001129863764 790775596 /nfs/dbraw/zinc/77/55/96/790775596.db2.gz JGRBYNLGUQGGLJ-OLZOCXBDSA-N 0 3 357.436 -1.299 20 0 FAADHN CO[C@H](C)CN[C@@H]1CN(C(=O)C2CS(=O)(=O)C2)C[C@@H]1n1ccnn1 ZINC001129864151 790777088 /nfs/dbraw/zinc/77/70/88/790777088.db2.gz REESZSZGXCCSLR-RTXFEEFZSA-N 0 3 357.436 -1.301 20 0 FAADHN CO[C@@H](C)CN[C@@H]1CN(C(=O)C2CS(=O)(=O)C2)C[C@@H]1n1ccnn1 ZINC001129864152 790777408 /nfs/dbraw/zinc/77/74/08/790777408.db2.gz REESZSZGXCCSLR-UHTWSYAYSA-N 0 3 357.436 -1.301 20 0 FAADHN COC[C@@H](C)N[C@@H]1CN(C(=O)C2CS(=O)(=O)C2)C[C@@H]1n1ccnn1 ZINC001129864383 790776974 /nfs/dbraw/zinc/77/69/74/790776974.db2.gz XSXHGAHHNKJWCT-RTXFEEFZSA-N 0 3 357.436 -1.301 20 0 FAADHN COC[C@H](C)N[C@@H]1CN(C(=O)C2CS(=O)(=O)C2)C[C@@H]1n1ccnn1 ZINC001129864384 790777245 /nfs/dbraw/zinc/77/72/45/790777245.db2.gz XSXHGAHHNKJWCT-UHTWSYAYSA-N 0 3 357.436 -1.301 20 0 FAADHN O=C(N1C[C@@H](NCCOCCO)[C@@H](n2ccnn2)C1)[C@]12C[C@H]1COC2 ZINC001129864387 790776910 /nfs/dbraw/zinc/77/69/10/790776910.db2.gz YBTBYZZYUAHLTA-FQLMCAECSA-N 0 3 351.407 -1.335 20 0 FAADHN COCCN[C@@H]1CN(C(=O)[C@@H](C)NC(=O)COC)C[C@@H]1n1ccnn1 ZINC001129867829 790779155 /nfs/dbraw/zinc/77/91/55/790779155.db2.gz YCORSOXQOWKZEI-UPJWGTAASA-N 0 3 354.411 -1.583 20 0 FAADHN COCCN[C@@H]1CN(C(=O)[C@H](C)NC(=O)COC)C[C@@H]1n1ccnn1 ZINC001129867833 790779056 /nfs/dbraw/zinc/77/90/56/790779056.db2.gz YCORSOXQOWKZEI-XQQFMLRXSA-N 0 3 354.411 -1.583 20 0 FAADHN O=C(Cn1nccn1)N1C[C@@H](NCCOCCO)[C@@H](n2ccnn2)C1 ZINC001129874384 790779621 /nfs/dbraw/zinc/77/96/21/790779621.db2.gz BLHHCVWAFRDFBF-OLZOCXBDSA-N 0 3 350.383 -2.080 20 0 FAADHN O=C(CNC(=O)C1CCCC1)N1C[C@@H](NCCO)[C@@H](n2ccnn2)C1 ZINC001129876221 790779278 /nfs/dbraw/zinc/77/92/78/790779278.db2.gz FQGPOMRVLWCBCS-KGLIPLIRSA-N 0 3 350.423 -1.082 20 0 FAADHN CCN(CC)C[C@@H](F)C(=O)N1C[C@@H](NCC(N)=O)[C@@H](n2ccnn2)C1 ZINC001129878912 790777366 /nfs/dbraw/zinc/77/73/66/790777366.db2.gz KRTBLMZDQJBVDL-UPJWGTAASA-N 0 3 355.418 -1.215 20 0 FAADHN CCN(CC)C[C@H](F)C(=O)N1C[C@@H](NCC(N)=O)[C@@H](n2ccnn2)C1 ZINC001129878913 790777343 /nfs/dbraw/zinc/77/73/43/790777343.db2.gz KRTBLMZDQJBVDL-XQQFMLRXSA-N 0 3 355.418 -1.215 20 0 FAADHN COCCN[C@@H]1CN(C(=O)CN(C)C(=O)COC)C[C@@H]1n1ccnn1 ZINC001129878958 790777194 /nfs/dbraw/zinc/77/71/94/790777194.db2.gz MANQOWOBEKJMLM-OLZOCXBDSA-N 0 3 354.411 -1.629 20 0 FAADHN O=C(CCCNC(=O)C1CC1)N1C[C@@H](NCCO)[C@@H](n2ccnn2)C1 ZINC001129879213 790776954 /nfs/dbraw/zinc/77/69/54/790776954.db2.gz XGTYSYWTSFHHOV-KGLIPLIRSA-N 0 3 350.423 -1.082 20 0 FAADHN COCCN[C@@H]1CN(C(=O)CCNC(=O)COC)C[C@@H]1n1ccnn1 ZINC001129879252 790777025 /nfs/dbraw/zinc/77/70/25/790777025.db2.gz ZBNARNZQEGYWMA-OLZOCXBDSA-N 0 3 354.411 -1.581 20 0 FAADHN CNC(=O)NCC(=O)N1C[C@@H](NCCOCCO)[C@@H](n2ccnn2)C1 ZINC001129881285 790776872 /nfs/dbraw/zinc/77/68/72/790776872.db2.gz DPTPMGLOBVOABJ-NEPJUHHUSA-N 0 3 355.399 -2.443 20 0 FAADHN COCCN[C@@H]1CN(C(=O)CCNS(C)(=O)=O)C[C@@H]1n1ccnn1 ZINC001129881426 790777420 /nfs/dbraw/zinc/77/74/20/790777420.db2.gz HPYPWTADWFIVOC-NEPJUHHUSA-N 0 3 360.440 -1.795 20 0 FAADHN CNC(=O)NCC(=O)N1C[C@@H](NCCOC(C)C)[C@@H](n2ccnn2)C1 ZINC001129881841 790778136 /nfs/dbraw/zinc/77/81/36/790778136.db2.gz VIUBSDUVICHFCW-OLZOCXBDSA-N 0 3 353.427 -1.026 20 0 FAADHN CCS(=O)(=O)NCC(=O)N1C[C@@H](NCCOC)[C@@H](n2ccnn2)C1 ZINC001129881848 790778052 /nfs/dbraw/zinc/77/80/52/790778052.db2.gz VTHSUKRXILVQCX-NEPJUHHUSA-N 0 3 360.440 -1.795 20 0 FAADHN COCCN[C@@H]1CN(C(=O)CN(C)S(C)(=O)=O)C[C@@H]1n1ccnn1 ZINC001129887574 790778236 /nfs/dbraw/zinc/77/82/36/790778236.db2.gz FWJYYVRNRARGAM-NEPJUHHUSA-N 0 3 360.440 -1.843 20 0 FAADHN COCCN[C@@H]1CN(C(=O)CN2CCOCC2=O)C[C@@H]1n1ccnn1 ZINC001129896281 790780368 /nfs/dbraw/zinc/78/03/68/790780368.db2.gz XDXALOGXUVTTLN-OLZOCXBDSA-N 0 3 352.395 -1.875 20 0 FAADHN CC(C)(C(N)=O)C(=O)N1C[C@@H](NCCOCCO)[C@@H](n2ccnn2)C1 ZINC001129899759 790780293 /nfs/dbraw/zinc/78/02/93/790780293.db2.gz KMOUVOUIBYZGCW-NEPJUHHUSA-N 0 3 354.411 -1.860 20 0 FAADHN C[C@@H](NC(=O)CNCCNC(=O)[C@@H]1C[C@H]1c1cnc[nH]1)C(=O)N(C)C ZINC001129902714 790779388 /nfs/dbraw/zinc/77/93/88/790779388.db2.gz ACPNLEIMFCNBRT-IJLUTSLNSA-N 0 3 350.423 -1.188 20 0 FAADHN C[C@@H](NC(=O)CNCCNC(=O)[C@@H]1C[C@H]1c1c[nH]cn1)C(=O)N(C)C ZINC001129902714 790779382 /nfs/dbraw/zinc/77/93/82/790779382.db2.gz ACPNLEIMFCNBRT-IJLUTSLNSA-N 0 3 350.423 -1.188 20 0 FAADHN C[C@H](NC(=O)CNCCNC(=O)[C@@H]1C[C@H]1c1cnc[nH]1)C(=O)N(C)C ZINC001129902715 790779468 /nfs/dbraw/zinc/77/94/68/790779468.db2.gz ACPNLEIMFCNBRT-QJPTWQEYSA-N 0 3 350.423 -1.188 20 0 FAADHN C[C@H](NC(=O)CNCCNC(=O)[C@@H]1C[C@H]1c1c[nH]cn1)C(=O)N(C)C ZINC001129902715 790779462 /nfs/dbraw/zinc/77/94/62/790779462.db2.gz ACPNLEIMFCNBRT-QJPTWQEYSA-N 0 3 350.423 -1.188 20 0 FAADHN CC(C)CS(=O)(=O)CC(=O)N1C[C@@H](NCCO)[C@@H](n2ccnn2)C1 ZINC001129914751 790779556 /nfs/dbraw/zinc/77/95/56/790779556.db2.gz GBXGBNYJJSAPOK-OLZOCXBDSA-N 0 3 359.452 -1.317 20 0 FAADHN CC(=O)NCC(=O)NCC(=O)N1C[C@@H](NCCO)[C@@H](n2ccnn2)C1 ZINC001129914882 790779118 /nfs/dbraw/zinc/77/91/18/790779118.db2.gz LPSSTGDXPZMUMF-NEPJUHHUSA-N 0 3 353.383 -3.136 20 0 FAADHN COCCS(=O)(=O)CC(=O)N1C[C@@H](NCCO)[C@@H](n2ccnn2)C1 ZINC001129914995 790779354 /nfs/dbraw/zinc/77/93/54/790779354.db2.gz RNKCWGTVMLFZII-NEPJUHHUSA-N 0 3 361.424 -2.327 20 0 FAADHN COCCN[C@@H]1CN(C(=O)Cn2ncn(C)c2=O)C[C@@H]1n1ccnn1 ZINC001129917058 790780501 /nfs/dbraw/zinc/78/05/01/790780501.db2.gz JVBKMDIBYOFOSR-NEPJUHHUSA-N 0 3 350.383 -2.139 20 0 FAADHN CCN1CCOC[C@H]1C(=O)N1C[C@@H](NCCOC)[C@@H](n2ccnn2)C1 ZINC001129917386 790780249 /nfs/dbraw/zinc/78/02/49/790780249.db2.gz RMJJAYWLETYHHF-ILXRZTDVSA-N 0 3 352.439 -1.013 20 0 FAADHN CCN1CCOC[C@@H]1C(=O)N1C[C@@H](NCCOC)[C@@H](n2ccnn2)C1 ZINC001129917388 790780621 /nfs/dbraw/zinc/78/06/21/790780621.db2.gz RMJJAYWLETYHHF-QLFBSQMISA-N 0 3 352.439 -1.013 20 0 FAADHN COCCN[C@@H]1CN(C(=O)CC2CS(=O)(=O)C2)C[C@@H]1n1ccnn1 ZINC001129917628 790780223 /nfs/dbraw/zinc/78/02/23/790780223.db2.gz YUIVEYWHLLFVDY-OLZOCXBDSA-N 0 3 357.436 -1.299 20 0 FAADHN CS(=O)(=O)CCCN[C@@H]1CN(C(=O)c2cn[nH]n2)C[C@@H]1n1ccnn1 ZINC001129923842 790780429 /nfs/dbraw/zinc/78/04/29/790780429.db2.gz ZSURGQPMHIZELH-NEPJUHHUSA-N 0 3 368.423 -1.514 20 0 FAADHN COCCN[C@@H]1CN(C(=O)CN2CCCNC2=O)C[C@@H]1n1ccnn1 ZINC001129924586 790780871 /nfs/dbraw/zinc/78/08/71/790780871.db2.gz BQPMUIMEWVVVCW-OLZOCXBDSA-N 0 3 351.411 -1.319 20 0 FAADHN Cc1nnc(COCC(=O)N2C[C@@H](NCCO)[C@@H](n3ccnn3)C2)s1 ZINC001129925285 790780401 /nfs/dbraw/zinc/78/04/01/790780401.db2.gz YJIZWCUSQIWGQI-NEPJUHHUSA-N 0 3 367.435 -1.011 20 0 FAADHN COCCN[C@@H]1CN(C(=O)[C@@H]2CCS(=O)(=O)C2)C[C@@H]1n1ccnn1 ZINC001129927430 790781662 /nfs/dbraw/zinc/78/16/62/790781662.db2.gz XWNMYAOMJZDQDH-UPJWGTAASA-N 0 3 357.436 -1.299 20 0 FAADHN COCCN[C@@H]1CN(C(=O)[C@H]2CCS(=O)(=O)C2)C[C@@H]1n1ccnn1 ZINC001129927431 790781643 /nfs/dbraw/zinc/78/16/43/790781643.db2.gz XWNMYAOMJZDQDH-XQQFMLRXSA-N 0 3 357.436 -1.299 20 0 FAADHN O=C(COCC(F)F)N1C[C@@H](NCCOCCO)[C@@H](n2ccnn2)C1 ZINC001129947652 790782539 /nfs/dbraw/zinc/78/25/39/790782539.db2.gz LFMVLCKPYQIWOH-NEPJUHHUSA-N 0 3 363.365 -1.090 20 0 FAADHN CNS(=O)(=O)NCC(=O)N1C[C@@H](NCCOC)[C@@H](n2ccnn2)C1 ZINC001129947684 790783091 /nfs/dbraw/zinc/78/30/91/790783091.db2.gz LPJUJOUPNAYDQB-MNOVXSKESA-N 0 3 361.428 -2.680 20 0 FAADHN CNS(=O)(=O)NCC(=O)N1C[C@@H](NCC=C(C)C)[C@@H](n2ccnn2)C1 ZINC001129947729 790783140 /nfs/dbraw/zinc/78/31/40/790783140.db2.gz NLWPFSDMHPPSFU-OLZOCXBDSA-N 0 3 371.467 -1.360 20 0 FAADHN O=C(c1csnn1)N1C[C@@H](NCCOCCO)[C@@H](n2ccnn2)C1 ZINC001129949422 790782029 /nfs/dbraw/zinc/78/20/29/790782029.db2.gz ZVXZOXBBTFQBFL-PWSUYJOCSA-N 0 3 353.408 -1.206 20 0 FAADHN Cc1nn[nH]c1C(=O)N1C[C@@H](NCCS(C)(=O)=O)[C@@H](n2ccnn2)C1 ZINC001129954441 790781976 /nfs/dbraw/zinc/78/19/76/790781976.db2.gz NFORXEJJWUUVET-MNOVXSKESA-N 0 3 368.423 -1.595 20 0 FAADHN Cc1n[nH]nc1C(=O)N1C[C@@H](NCCOCCO)[C@@H](n2ccnn2)C1 ZINC001129954496 790781743 /nfs/dbraw/zinc/78/17/43/790781743.db2.gz PXLFIUZJTGJAHB-NEPJUHHUSA-N 0 3 350.383 -1.631 20 0 FAADHN O=C([C@@H]1CCNC1=O)N1C[C@@H](NCCOCCO)[C@@H](n2ccnn2)C1 ZINC001129954704 790782208 /nfs/dbraw/zinc/78/22/08/790782208.db2.gz ZXAMXWVNLOGPDC-UPJWGTAASA-N 0 3 352.395 -2.235 20 0 FAADHN O=C([C@H]1CCNC1=O)N1C[C@@H](NCCOCCO)[C@@H](n2ccnn2)C1 ZINC001129954705 790781994 /nfs/dbraw/zinc/78/19/94/790781994.db2.gz ZXAMXWVNLOGPDC-XQQFMLRXSA-N 0 3 352.395 -2.235 20 0 FAADHN C[C@H](CC(N)=O)C(=O)N1C[C@@H](NCCOCCO)[C@@H](n2ccnn2)C1 ZINC001129957213 790781518 /nfs/dbraw/zinc/78/15/18/790781518.db2.gz XESAMRAJZXYORC-UPJWGTAASA-N 0 3 354.411 -1.860 20 0 FAADHN C[C@@H](CC(N)=O)C(=O)N1C[C@@H](NCCOCCO)[C@@H](n2ccnn2)C1 ZINC001129957214 790782198 /nfs/dbraw/zinc/78/21/98/790782198.db2.gz XESAMRAJZXYORC-XQQFMLRXSA-N 0 3 354.411 -1.860 20 0 FAADHN Cn1nnc(C(=O)N2C[C@@H](NCCOCCO)[C@@H](n3ccnn3)C2)n1 ZINC001129961272 790781604 /nfs/dbraw/zinc/78/16/04/790781604.db2.gz GYSRXWWOWZAPHI-MNOVXSKESA-N 0 3 351.371 -2.534 20 0 FAADHN COCCN[C@@H]1CN(C(=O)CN2CCNC(=O)C2)C[C@@H]1n1ccnn1 ZINC001129964110 790783392 /nfs/dbraw/zinc/78/33/92/790783392.db2.gz XKHNQHWHUNGBAE-OLZOCXBDSA-N 0 3 351.411 -2.302 20 0 FAADHN CCOCCN[C@@H]1CN(C(=O)[C@@H]2CN(C)C(=O)N2)C[C@@H]1n1ccnn1 ZINC001129964143 790782813 /nfs/dbraw/zinc/78/28/13/790782813.db2.gz YLGJZRXUBHFXTM-AGIUHOORSA-N 0 3 351.411 -1.320 20 0 FAADHN CCOCCN[C@@H]1CN(C(=O)[C@H]2CN(C)C(=O)N2)C[C@@H]1n1ccnn1 ZINC001129964144 790782649 /nfs/dbraw/zinc/78/26/49/790782649.db2.gz YLGJZRXUBHFXTM-UPJWGTAASA-N 0 3 351.411 -1.320 20 0 FAADHN O=C([C@H]1[C@@H]2COC[C@@H]21)N1C[C@@H](NCCOCCO)[C@@H](n2ccnn2)C1 ZINC001129970138 790783798 /nfs/dbraw/zinc/78/37/98/790783798.db2.gz ANGPIMHZDNCAAT-SEBNEYGDSA-N 0 3 351.407 -1.479 20 0 FAADHN O=C(N1C[C@@H](NCCOCCO)[C@@H](n2ccnn2)C1)[C@]1(F)CCOC1 ZINC001129978042 790784276 /nfs/dbraw/zinc/78/42/76/790784276.db2.gz OVPOIILHVOFJSO-IPYPFGDCSA-N 0 3 357.386 -1.243 20 0 FAADHN O=C(N1C[C@@H](NCCOCCO)[C@@H](n2ccnn2)C1)[C@@]1(F)CCOC1 ZINC001129978043 790784640 /nfs/dbraw/zinc/78/46/40/790784640.db2.gz OVPOIILHVOFJSO-VNHYZAJKSA-N 0 3 357.386 -1.243 20 0 FAADHN O=C(Cc1cnoc1)N1C[C@@H](NCCOCCO)[C@@H](n2ccnn2)C1 ZINC001129980224 790784333 /nfs/dbraw/zinc/78/43/33/790784333.db2.gz FGKFUGDYCNCKBF-KGLIPLIRSA-N 0 3 350.379 -1.141 20 0 FAADHN O=C([C@@H]1CNC(=O)N1)N1C[C@@H](NCCOCCO)[C@@H](n2ccnn2)C1 ZINC001129982921 790784489 /nfs/dbraw/zinc/78/44/89/790784489.db2.gz JSCASQJHBMWQCJ-TUAOUCFPSA-N 0 3 353.383 -2.690 20 0 FAADHN O=C([C@H]1CNC(=O)N1)N1C[C@@H](NCCOCCO)[C@@H](n2ccnn2)C1 ZINC001129982925 790784590 /nfs/dbraw/zinc/78/45/90/790784590.db2.gz JSCASQJHBMWQCJ-UTUOFQBUSA-N 0 3 353.383 -2.690 20 0 FAADHN CC(C)OCCN[C@@H]1CN(C(=O)[C@H]2CNC(=O)N2)C[C@@H]1n1ccnn1 ZINC001129983116 790784536 /nfs/dbraw/zinc/78/45/36/790784536.db2.gz MZYMIXLBKFFQTN-UPJWGTAASA-N 0 3 351.411 -1.274 20 0 FAADHN CC(C)OCCN[C@@H]1CN(C(=O)[C@@H]2CNC(=O)N2)C[C@@H]1n1ccnn1 ZINC001129983117 790784672 /nfs/dbraw/zinc/78/46/72/790784672.db2.gz MZYMIXLBKFFQTN-XQQFMLRXSA-N 0 3 351.411 -1.274 20 0 FAADHN NC(=O)C1(C(=O)N2C[C@@H](NCCOCCO)[C@@H](n3ccnn3)C2)CC1 ZINC001129984816 790784255 /nfs/dbraw/zinc/78/42/55/790784255.db2.gz CDXNFMQTYLKVKN-NEPJUHHUSA-N 0 3 352.395 -2.106 20 0 FAADHN CC(=O)NCCOCCN[C@@H]1CN(C(=O)C(N)=O)C[C@@H]1n1ccnn1 ZINC001129984904 790783958 /nfs/dbraw/zinc/78/39/58/790783958.db2.gz ISTBTGVJGXSACU-NEPJUHHUSA-N 0 3 353.383 -2.742 20 0 FAADHN COCCOC[C@@H](O)CN[C@@H]1CN(C(=O)C(N)=O)C[C@@H]1n1ccnn1 ZINC001129985197 790784604 /nfs/dbraw/zinc/78/46/04/790784604.db2.gz RQMQOPVMTMXIOA-TUAOUCFPSA-N 0 3 356.383 -2.871 20 0 FAADHN COCCOC[C@H](O)CN[C@@H]1CN(C(=O)C(N)=O)C[C@@H]1n1ccnn1 ZINC001129985198 790784032 /nfs/dbraw/zinc/78/40/32/790784032.db2.gz RQMQOPVMTMXIOA-UTUOFQBUSA-N 0 3 356.383 -2.871 20 0 FAADHN NC(=O)C(=O)N1C[C@@H](NC[C@H](O)CC(F)(F)F)[C@@H](n2ccnn2)C1 ZINC001129985401 790784184 /nfs/dbraw/zinc/78/41/84/790784184.db2.gz WAUJVAWJOGFBJT-HLTSFMKQSA-N 0 3 350.301 -1.582 20 0 FAADHN NC(=O)C(=O)N1C[C@@H](NC[C@@H](O)CC(F)(F)F)[C@@H](n2ccnn2)C1 ZINC001129985402 790784691 /nfs/dbraw/zinc/78/46/91/790784691.db2.gz WAUJVAWJOGFBJT-YIZRAAEISA-N 0 3 350.301 -1.582 20 0 FAADHN NC(=O)C(=O)N1C[C@@H](NCCOCC(F)(F)F)[C@@H](n2ccnn2)C1 ZINC001129988057 790785726 /nfs/dbraw/zinc/78/57/26/790785726.db2.gz GRCNHAURJPCFKA-BDAKNGLRSA-N 0 3 350.301 -1.316 20 0 FAADHN CC(C)COC[C@H](O)CN[C@@H]1CN(C(=O)C(N)=O)C[C@@H]1n1ccnn1 ZINC001129988153 790785946 /nfs/dbraw/zinc/78/59/46/790785946.db2.gz JQMWRWFLUKHLSR-UPJWGTAASA-N 0 3 354.411 -1.862 20 0 FAADHN CC(C)COC[C@@H](O)CN[C@@H]1CN(C(=O)C(N)=O)C[C@@H]1n1ccnn1 ZINC001129988155 790785463 /nfs/dbraw/zinc/78/54/63/790785463.db2.gz JQMWRWFLUKHLSR-XQQFMLRXSA-N 0 3 354.411 -1.862 20 0 FAADHN C[C@@H](CN[C@@H]1CN(C(=O)C(N)=O)C[C@@H]1n1ccnn1)CS(C)(=O)=O ZINC001129988168 790785931 /nfs/dbraw/zinc/78/59/31/790785931.db2.gz JZEMEXGWDVFXCB-AXFHLTTASA-N 0 3 358.424 -2.214 20 0 FAADHN C[C@H](CN[C@@H]1CN(C(=O)C(N)=O)C[C@@H]1n1ccnn1)CS(C)(=O)=O ZINC001129988169 790785911 /nfs/dbraw/zinc/78/59/11/790785911.db2.gz JZEMEXGWDVFXCB-MXWKQRLJSA-N 0 3 358.424 -2.214 20 0 FAADHN COCCN[C@@H]1CN(C(=O)CCCS(N)(=O)=O)C[C@@H]1n1ccnn1 ZINC001129988274 790786002 /nfs/dbraw/zinc/78/60/02/790786002.db2.gz LQFXEGHLTCYOBH-NEPJUHHUSA-N 0 3 360.440 -1.665 20 0 FAADHN NC(=O)C(=O)N1C[C@@H](NCCOC[C@H]2CCCO2)[C@@H](n2ccnn2)C1 ZINC001129988506 790785322 /nfs/dbraw/zinc/78/53/22/790785322.db2.gz WFTUTMCSKFRZJA-UPJWGTAASA-N 0 3 352.395 -1.700 20 0 FAADHN NC(=O)C(=O)N1C[C@@H](NCCOC[C@@H]2CCCO2)[C@@H](n2ccnn2)C1 ZINC001129988507 790787260 /nfs/dbraw/zinc/78/72/60/790787260.db2.gz WFTUTMCSKFRZJA-XQQFMLRXSA-N 0 3 352.395 -1.700 20 0 FAADHN O=C(c1n[nH]cc1F)N1C[C@@H](NCCOCCO)[C@@H](n2ccnn2)C1 ZINC001129995679 790786069 /nfs/dbraw/zinc/78/60/69/790786069.db2.gz CHLADSFGXJBRHS-NEPJUHHUSA-N 0 3 353.358 -1.196 20 0 FAADHN COC[C@@H](OC)C(=O)N1C[C@@H](NCCOCCO)[C@@H](n2ccnn2)C1 ZINC001130002774 790785880 /nfs/dbraw/zinc/78/58/80/790785880.db2.gz QRJIBGNPNCLCCN-HZSPNIEDSA-N 0 3 357.411 -1.710 20 0 FAADHN COC[C@H](OC)C(=O)N1C[C@@H](NCCOCCO)[C@@H](n2ccnn2)C1 ZINC001130002775 790786123 /nfs/dbraw/zinc/78/61/23/790786123.db2.gz QRJIBGNPNCLCCN-RDBSUJKOSA-N 0 3 357.411 -1.710 20 0 FAADHN NC(=O)[C@@H]1C[C@@H]1C(=O)N1C[C@@H](NCCOCCO)[C@@H](n2ccnn2)C1 ZINC001130007672 790786972 /nfs/dbraw/zinc/78/69/72/790786972.db2.gz QEWZHIVTRWPBTO-XQHKEYJVSA-N 0 3 352.395 -2.250 20 0 FAADHN COCCN[C@@H]1CN(C(=O)[C@H]2C[C@H]2C(=O)N(C)C)C[C@@H]1n1ccnn1 ZINC001130009382 790786706 /nfs/dbraw/zinc/78/67/06/790786706.db2.gz LVRGRHSALCSBSE-RQJABVFESA-N 0 3 350.423 -1.010 20 0 FAADHN COCCN[C@@H]1CN(C(=O)[C@H]2CC[C@@H](C(N)=O)O2)C[C@@H]1n1ccnn1 ZINC001130009596 790786885 /nfs/dbraw/zinc/78/68/85/790786885.db2.gz XBTHXVFHFFLHOJ-MROQNXINSA-N 0 3 352.395 -1.701 20 0 FAADHN COCCN[C@@H]1CN(C(=O)[C@H](C)NS(C)(=O)=O)C[C@@H]1n1ccnn1 ZINC001130020321 790786776 /nfs/dbraw/zinc/78/67/76/790786776.db2.gz AJAUMJMFDSFASU-TUAOUCFPSA-N 0 3 360.440 -1.796 20 0 FAADHN COCCN[C@@H]1CN(C(=O)[C@@H](C)NS(C)(=O)=O)C[C@@H]1n1ccnn1 ZINC001130020322 790786856 /nfs/dbraw/zinc/78/68/56/790786856.db2.gz AJAUMJMFDSFASU-UTUOFQBUSA-N 0 3 360.440 -1.796 20 0 FAADHN COCCN[C@@H]1CN(C(=O)[C@@H]2CC(=O)NC(=O)N2)C[C@@H]1n1ccnn1 ZINC001130026347 790787920 /nfs/dbraw/zinc/78/79/20/790787920.db2.gz MEHXLMPGXKTISC-AXFHLTTASA-N 0 3 351.367 -2.136 20 0 FAADHN CC(=O)N[C@@H](CC(=O)N1C[C@@H](NCCO)[C@@H](n2ccnn2)C1)C(N)=O ZINC001130030588 790788519 /nfs/dbraw/zinc/78/85/19/790788519.db2.gz HFZQZVXACFOVIG-TUAOUCFPSA-N 0 3 353.383 -3.008 20 0 FAADHN CN(C)C(=O)CC(=O)N1C[C@@H](NCCOCCO)[C@@H](n2ccnn2)C1 ZINC001130030881 790788387 /nfs/dbraw/zinc/78/83/87/790788387.db2.gz WHPPHPUZCXUDTM-OLZOCXBDSA-N 0 3 354.411 -1.893 20 0 FAADHN CCNC(=O)NC(C)(C)C(=O)N1C[C@@H](NCCO)[C@@H](n2ccnn2)C1 ZINC001130032353 790788463 /nfs/dbraw/zinc/78/84/63/790788463.db2.gz CMXPCXSFLVSKLY-NEPJUHHUSA-N 0 3 353.427 -1.290 20 0 FAADHN CC(C)(NS(C)(=O)=O)C(=O)N1C[C@@H](NCCO)[C@@H](n2ccnn2)C1 ZINC001130032627 790788411 /nfs/dbraw/zinc/78/84/11/790788411.db2.gz KTCYFFCXIDNLBQ-MNOVXSKESA-N 0 3 360.440 -2.060 20 0 FAADHN COCCN[C@@H]1CN(C(=O)C2CC(=O)NC(=O)C2)C[C@@H]1n1ccnn1 ZINC001130037904 790788372 /nfs/dbraw/zinc/78/83/72/790788372.db2.gz AWYPJJBGQRPFOO-NEPJUHHUSA-N 0 3 350.379 -1.681 20 0 FAADHN Cn1ncc(C(=O)N2C[C@@H](NCCOCCO)[C@@H](n3ccnn3)C2)n1 ZINC001130038223 790789634 /nfs/dbraw/zinc/78/96/34/790789634.db2.gz SNFWEYZEWLAYBP-OLZOCXBDSA-N 0 3 350.383 -1.929 20 0 FAADHN O=C(CCNC(=O)C1CCC1)N1C[C@@H](NCCO)[C@@H](n2ccnn2)C1 ZINC001130040774 790786734 /nfs/dbraw/zinc/78/67/34/790786734.db2.gz LAKUNKDCGFQGLW-KGLIPLIRSA-N 0 3 350.423 -1.082 20 0 FAADHN C[C@@H](O)CN[C@@H]1CN(C(=O)CCCS(C)(=O)=O)C[C@@H]1n1ccnn1 ZINC001130047068 790789153 /nfs/dbraw/zinc/78/91/53/790789153.db2.gz UQHYSSDUZMNXPD-UPJWGTAASA-N 0 3 359.452 -1.175 20 0 FAADHN C[C@H](O)CN[C@@H]1CN(C(=O)CCCS(C)(=O)=O)C[C@@H]1n1ccnn1 ZINC001130047069 790789393 /nfs/dbraw/zinc/78/93/93/790789393.db2.gz UQHYSSDUZMNXPD-XQQFMLRXSA-N 0 3 359.452 -1.175 20 0 FAADHN COCCOCCN[C@@H]1CN(C(=O)c2cnon2)C[C@@H]1n1ccnn1 ZINC001130047511 790789800 /nfs/dbraw/zinc/78/98/00/790789800.db2.gz FDPPOEXCIWDSAO-OLZOCXBDSA-N 0 3 351.367 -1.021 20 0 FAADHN CS(=O)(=O)CCCN[C@@H]1CN(C(=O)c2cnon2)C[C@@H]1n1ccnn1 ZINC001130047901 790789518 /nfs/dbraw/zinc/78/95/18/790789518.db2.gz YRBVKNKNWKNTEP-NEPJUHHUSA-N 0 3 369.407 -1.249 20 0 FAADHN CS(=O)(=O)CCCN[C@@H]1CN(C(=O)c2nc[nH]n2)C[C@@H]1n1ccnn1 ZINC001130049953 790789419 /nfs/dbraw/zinc/78/94/19/790789419.db2.gz BCJSBHPXAAMCIQ-MNOVXSKESA-N 0 3 368.423 -1.514 20 0 FAADHN COCCOCCN[C@@H]1CN(C(=O)c2nc[nH]n2)C[C@@H]1n1ccnn1 ZINC001130050391 790789270 /nfs/dbraw/zinc/78/92/70/790789270.db2.gz WSMQQDWEQZGTAL-NEPJUHHUSA-N 0 3 350.383 -1.286 20 0 FAADHN O=C(CC(=O)N1C[C@@H](NCCO)[C@@H](n2ccnn2)C1)NCC(F)(F)F ZINC001130062760 790789241 /nfs/dbraw/zinc/78/92/41/790789241.db2.gz WALOMFRZSDRLPZ-ZJUUUORDSA-N 0 3 364.328 -1.320 20 0 FAADHN O=C(NCC(F)(F)F)C(=O)N1C[C@@H](NCCCO)[C@@H](n2ccnn2)C1 ZINC001130065082 790789772 /nfs/dbraw/zinc/78/97/72/790789772.db2.gz ACZZDOFWOOPEDD-ZJUUUORDSA-N 0 3 364.328 -1.320 20 0 FAADHN C[C@H](O)CN[C@@H]1CN(C(=O)C(=O)NCC(F)(F)F)C[C@@H]1n1ccnn1 ZINC001130065312 790789575 /nfs/dbraw/zinc/78/95/75/790789575.db2.gz FZBKSNZPFZEUPY-AEJSXWLSSA-N 0 3 364.328 -1.321 20 0 FAADHN C[C@@H](O)CN[C@@H]1CN(C(=O)C(=O)NCC(F)(F)F)C[C@@H]1n1ccnn1 ZINC001130065313 790791002 /nfs/dbraw/zinc/79/10/02/790791002.db2.gz FZBKSNZPFZEUPY-BBBLOLIVSA-N 0 3 364.328 -1.321 20 0 FAADHN COCCN[C@@H]1CN(C(=O)C(=O)NCC(F)(F)F)C[C@@H]1n1ccnn1 ZINC001130065662 790790399 /nfs/dbraw/zinc/79/03/99/790790399.db2.gz NMGSDGKJHZAKGU-ZJUUUORDSA-N 0 3 364.328 -1.056 20 0 FAADHN O=C(NCC(F)(F)F)C(=O)N1C[C@@H](NCCO)[C@@H](n2ccnn2)C1 ZINC001130065932 790790185 /nfs/dbraw/zinc/79/01/85/790790185.db2.gz YQMYAKJKFATISL-BDAKNGLRSA-N 0 3 350.301 -1.710 20 0 FAADHN Cn1cnnc1COCC(=O)N1C[C@@H](NCCO)[C@@H](n2ccnn2)C1 ZINC001130066512 790790460 /nfs/dbraw/zinc/79/04/60/790790460.db2.gz BYGMJMOISXSSEI-NEPJUHHUSA-N 0 3 350.383 -2.043 20 0 FAADHN CCS(=O)(=O)N(C)CC(=O)N1C[C@@H](NCCO)[C@@H](n2ccnn2)C1 ZINC001130066528 790790203 /nfs/dbraw/zinc/79/02/03/790790203.db2.gz CLCQKYFJLBPVJS-NEPJUHHUSA-N 0 3 360.440 -2.107 20 0 FAADHN Cn1ncnc1COCC(=O)N1C[C@@H](NCCO)[C@@H](n2ccnn2)C1 ZINC001130066548 790790326 /nfs/dbraw/zinc/79/03/26/790790326.db2.gz DPSPQABBFSEYNH-NEPJUHHUSA-N 0 3 350.383 -2.043 20 0 FAADHN O=C(CNC(=O)c1cscn1)N1C[C@@H](NCCO)[C@@H](n2ccnn2)C1 ZINC001130077579 790790869 /nfs/dbraw/zinc/79/08/69/790790869.db2.gz OUIVFMKPGNZBAB-PWSUYJOCSA-N 0 3 365.419 -1.502 20 0 FAADHN C[C@@H]1CCN(C(=O)C(=O)N2C[C@@H](NCCCO)[C@@H](n3ccnn3)C2)C1 ZINC001130079292 790790220 /nfs/dbraw/zinc/79/02/20/790790220.db2.gz BZTRKSSQBJKRHT-MCIONIFRSA-N 0 3 350.423 -1.130 20 0 FAADHN C[C@H]1CCN(C(=O)C(=O)N2C[C@@H](NCCCO)[C@@H](n3ccnn3)C2)C1 ZINC001130079293 790791106 /nfs/dbraw/zinc/79/11/06/790791106.db2.gz BZTRKSSQBJKRHT-MJBXVCDLSA-N 0 3 350.423 -1.130 20 0 FAADHN O=C(Cc1nnc[nH]1)N1C[C@@H](NCCOCCO)[C@@H](n2ccnn2)C1 ZINC001130084105 790790605 /nfs/dbraw/zinc/79/06/05/790790605.db2.gz ZWZMMJYTJJOPOJ-NEPJUHHUSA-N 0 3 350.383 -2.011 20 0 FAADHN CC(C)(C)[C@H](NC(N)=O)C(=O)N1C[C@@H](NCCO)[C@@H](n2ccnn2)C1 ZINC001130088764 790790534 /nfs/dbraw/zinc/79/05/34/790790534.db2.gz HYANSIQDOOLLQY-GRYCIOLGSA-N 0 3 353.427 -1.305 20 0 FAADHN CC(C)(C)[C@@H](NC(N)=O)C(=O)N1C[C@@H](NCCO)[C@@H](n2ccnn2)C1 ZINC001130088765 790790419 /nfs/dbraw/zinc/79/04/19/790790419.db2.gz HYANSIQDOOLLQY-WOPDTQHZSA-N 0 3 353.427 -1.305 20 0 FAADHN CC(C)(C)S(=O)(=O)CC(=O)N1C[C@@H](NCCO)[C@@H](n2ccnn2)C1 ZINC001130089008 790790848 /nfs/dbraw/zinc/79/08/48/790790848.db2.gz UGZCWADHUHQWBB-NEPJUHHUSA-N 0 3 359.452 -1.175 20 0 FAADHN O=C([C@@H]1CCC(=O)N1)N1C[C@@H](NCCOCCO)[C@@H](n2ccnn2)C1 ZINC001130091228 790792102 /nfs/dbraw/zinc/79/21/02/790792102.db2.gz HAPOVUSRCPOMRY-XQQFMLRXSA-N 0 3 352.395 -2.093 20 0 FAADHN CC(=O)N[C@@](C)(C(=O)N1C[C@@H](NCCO)[C@@H](n2ccnn2)C1)C1CC1 ZINC001130094669 790792151 /nfs/dbraw/zinc/79/21/51/790792151.db2.gz PCZMBWKKJUGTET-IJEWVQPXSA-N 0 3 350.423 -1.083 20 0 FAADHN CC(=O)N[C@](C)(C(=O)N1C[C@@H](NCCO)[C@@H](n2ccnn2)C1)C1CC1 ZINC001130094670 790791951 /nfs/dbraw/zinc/79/19/51/790791951.db2.gz PCZMBWKKJUGTET-YCPHGPKFSA-N 0 3 350.423 -1.083 20 0 FAADHN COCCN[C@@H]1CN(C(=O)CS(=O)(=O)N(C)C)C[C@@H]1n1ccnn1 ZINC001130107571 790792138 /nfs/dbraw/zinc/79/21/38/790792138.db2.gz RGGRTXLIFSXUKJ-NEPJUHHUSA-N 0 3 360.440 -1.843 20 0 FAADHN O=C(Cn1cncn1)N1C[C@@H](NCCOCCO)[C@@H](n2ccnn2)C1 ZINC001130112742 790792216 /nfs/dbraw/zinc/79/22/16/790792216.db2.gz OZLHHVGQAZRJRN-OLZOCXBDSA-N 0 3 350.383 -2.080 20 0 FAADHN COCCN[C@@H]1CN(C(=O)CN2C(=O)CNC2=O)C[C@@H]1n1ccnn1 ZINC001130115017 790791655 /nfs/dbraw/zinc/79/16/55/790791655.db2.gz PBCUOZFGWNNKRP-MNOVXSKESA-N 0 3 351.367 -2.182 20 0 FAADHN COCCN[C@@H]1CN(C(=O)CN2C(=O)CCC2=O)C[C@@H]1n1ccnn1 ZINC001130115157 790792173 /nfs/dbraw/zinc/79/21/73/790792173.db2.gz WYJOGKNXOFRNAV-NEPJUHHUSA-N 0 3 350.379 -1.585 20 0 FAADHN NC(=O)NCCC(=O)N1C[C@@H](NCCOCCO)[C@@H](n2ccnn2)C1 ZINC001130118772 790793366 /nfs/dbraw/zinc/79/33/66/790793366.db2.gz MMOXQLLRGNSEKP-NEPJUHHUSA-N 0 3 355.399 -2.313 20 0 FAADHN COCCN[C@@H]1CN(C(=O)[C@@H]2CCS(=O)(=O)N2)C[C@@H]1n1ccnn1 ZINC001130129663 790793168 /nfs/dbraw/zinc/79/31/68/790793168.db2.gz RDGFNJILAZTSEV-TUAOUCFPSA-N 0 3 358.424 -2.042 20 0 FAADHN COCCN[C@@H]1CN(C(=O)[C@H]2CCS(=O)(=O)N2)C[C@@H]1n1ccnn1 ZINC001130129664 790792689 /nfs/dbraw/zinc/79/26/89/790792689.db2.gz RDGFNJILAZTSEV-UTUOFQBUSA-N 0 3 358.424 -2.042 20 0 FAADHN COCCN[C@@H]1CN(C(=O)[C@@H]2CCCS2(=O)=O)C[C@@H]1n1ccnn1 ZINC001130132714 790794293 /nfs/dbraw/zinc/79/42/93/790794293.db2.gz LXOYUEDSJRMAQR-AGIUHOORSA-N 0 3 357.436 -1.157 20 0 FAADHN COCCN[C@@H]1CN(C(=O)[C@H]2CCCS2(=O)=O)C[C@@H]1n1ccnn1 ZINC001130132715 790794212 /nfs/dbraw/zinc/79/42/12/790794212.db2.gz LXOYUEDSJRMAQR-FRRDWIJNSA-N 0 3 357.436 -1.157 20 0 FAADHN CCOCCN[C@@H]1CN(C(=O)CS(=O)(=O)NC)C[C@@H]1n1ccnn1 ZINC001130132725 790793919 /nfs/dbraw/zinc/79/39/19/790793919.db2.gz MKJRSWQJZXZSFX-NEPJUHHUSA-N 0 3 360.440 -1.795 20 0 FAADHN CN(C)S(=O)(=O)CCC(=O)N1C[C@@H](NCCO)[C@@H](n2ccnn2)C1 ZINC001130137057 790793701 /nfs/dbraw/zinc/79/37/01/790793701.db2.gz GWWBVXMHEOXOOY-NEPJUHHUSA-N 0 3 360.440 -2.107 20 0 FAADHN CNC(=O)NC(C)(C)C(=O)N1C[C@@H](NCCOC)[C@@H](n2ccnn2)C1 ZINC001130139832 790795650 /nfs/dbraw/zinc/79/56/50/790795650.db2.gz JGDJXCDSMHRGST-NEPJUHHUSA-N 0 3 353.427 -1.026 20 0 FAADHN CCCCS(=O)(=O)CC(=O)N1C[C@@H](NCCO)[C@@H](n2ccnn2)C1 ZINC001130139854 790795050 /nfs/dbraw/zinc/79/50/50/790795050.db2.gz JSJDXIKWPYDOMY-OLZOCXBDSA-N 0 3 359.452 -1.173 20 0 FAADHN COCCN[C@@H]1CN(C(=O)[C@H](C)CS(C)(=O)=O)C[C@@H]1n1ccnn1 ZINC001130142583 790795300 /nfs/dbraw/zinc/79/53/00/790795300.db2.gz CDPWOOXPHXPQNN-UPJWGTAASA-N 0 3 359.452 -1.053 20 0 FAADHN COCCN[C@@H]1CN(C(=O)[C@@H](C)CS(C)(=O)=O)C[C@@H]1n1ccnn1 ZINC001130142588 790795510 /nfs/dbraw/zinc/79/55/10/790795510.db2.gz CDPWOOXPHXPQNN-XQQFMLRXSA-N 0 3 359.452 -1.053 20 0 FAADHN NC(=O)CCCC(=O)N1C[C@@H](NCCOCCO)[C@@H](n2ccnn2)C1 ZINC001130153210 790795387 /nfs/dbraw/zinc/79/53/87/790795387.db2.gz DAVFGWKPSOVJHQ-OLZOCXBDSA-N 0 3 354.411 -1.716 20 0 FAADHN Cc1nonc1C(=O)N1C[C@@H](NCCOCCO)[C@@H](n2ccnn2)C1 ZINC001130153492 790795076 /nfs/dbraw/zinc/79/50/76/790795076.db2.gz UYVFLGIOMYLCFJ-NEPJUHHUSA-N 0 3 351.367 -1.366 20 0 FAADHN CCCC[C@@H](NC(N)=O)C(=O)N1C[C@@H](NCCO)[C@@H](n2ccnn2)C1 ZINC001130153563 790795090 /nfs/dbraw/zinc/79/50/90/790795090.db2.gz ZBAKIAJRTMKKME-UPJWGTAASA-N 0 3 353.427 -1.161 20 0 FAADHN CCCC[C@H](NC(N)=O)C(=O)N1C[C@@H](NCCO)[C@@H](n2ccnn2)C1 ZINC001130153564 790795201 /nfs/dbraw/zinc/79/52/01/790795201.db2.gz ZBAKIAJRTMKKME-XQQFMLRXSA-N 0 3 353.427 -1.161 20 0 FAADHN COCCN[C@@H]1CN(C(=O)[C@@H]2CCCN2C(N)=O)C[C@@H]1n1ccnn1 ZINC001130155625 790796287 /nfs/dbraw/zinc/79/62/87/790796287.db2.gz SSLRFJBWBRRFFJ-AGIUHOORSA-N 0 3 351.411 -1.191 20 0 FAADHN C[C@@H](NC(=O)C1CCC1)C(=O)N1C[C@@H](NCCO)[C@@H](n2ccnn2)C1 ZINC001130158459 790796490 /nfs/dbraw/zinc/79/64/90/790796490.db2.gz KNVDEXXWESDDAF-BNOWGMLFSA-N 0 3 350.423 -1.083 20 0 FAADHN C[C@H](NC(=O)C1CCC1)C(=O)N1C[C@@H](NCCO)[C@@H](n2ccnn2)C1 ZINC001130158461 790796264 /nfs/dbraw/zinc/79/62/64/790796264.db2.gz KNVDEXXWESDDAF-YUTCNCBUSA-N 0 3 350.423 -1.083 20 0 FAADHN COCCN[C@@H]1CN(C(=O)C[C@@H]2CC(=O)NC2=O)C[C@@H]1n1ccnn1 ZINC001130158994 790796732 /nfs/dbraw/zinc/79/67/32/790796732.db2.gz XDIIPWWSISCHBX-TUAOUCFPSA-N 0 3 350.379 -1.681 20 0 FAADHN COCCN[C@@H]1CN(C(=O)C[C@H]2CC(=O)NC2=O)C[C@@H]1n1ccnn1 ZINC001130158995 790796221 /nfs/dbraw/zinc/79/62/21/790796221.db2.gz XDIIPWWSISCHBX-UTUOFQBUSA-N 0 3 350.379 -1.681 20 0 FAADHN CC(C)(CS(C)(=O)=O)C(=O)N1C[C@@H](NCCO)[C@@H](n2ccnn2)C1 ZINC001130159008 790796443 /nfs/dbraw/zinc/79/64/43/790796443.db2.gz XRGBFHVQGOELTO-NEPJUHHUSA-N 0 3 359.452 -1.317 20 0 FAADHN COCCN[C@@H]1CN(C(=O)[C@H](C)N2CCOCC2)C[C@@H]1n1ccnn1 ZINC001130159055 790796552 /nfs/dbraw/zinc/79/65/52/790796552.db2.gz ZODNVXWJHOLRPS-ZNMIVQPWSA-N 0 3 352.439 -1.013 20 0 FAADHN COCC(=O)NCc1nnc([C@H]2CCO[C@H]2C[NH2+]CC(=O)N(C)C)[n-]1 ZINC001130173153 790797118 /nfs/dbraw/zinc/79/71/18/790797118.db2.gz IBZGCVBUUSURGY-QWRGUYRKSA-N 0 3 354.411 -1.382 20 0 FAADHN CNC(=O)NC(=O)C[NH2+]C[C@@H]1OCC[C@@H]1c1nnc(CNC(C)=O)[n-]1 ZINC001130173167 790796102 /nfs/dbraw/zinc/79/61/02/790796102.db2.gz IZTNWXJJWKRVLO-UWVGGRQHSA-N 0 3 353.383 -1.642 20 0 FAADHN CCNC(=O)C[NH2+]C[C@@H]1OCC[C@@H]1c1nnc(CNC(=O)COC)[n-]1 ZINC001130173298 790798457 /nfs/dbraw/zinc/79/84/57/790798457.db2.gz KIFMBNVIZQLXBP-QWRGUYRKSA-N 0 3 354.411 -1.335 20 0 FAADHN CC[C@@H]([NH2+]C[C@@H]1OCC[C@@H]1c1nnc(CNC(=O)COC)[n-]1)C(N)=O ZINC001130173302 790798835 /nfs/dbraw/zinc/79/88/35/790798835.db2.gz KLUJFABCALVQAX-AXFHLTTASA-N 0 3 354.411 -1.207 20 0 FAADHN CC[C@H]([NH2+]C[C@@H]1OCC[C@@H]1c1nnc(CNC(=O)COC)[n-]1)C(N)=O ZINC001130173303 790798493 /nfs/dbraw/zinc/79/84/93/790798493.db2.gz KLUJFABCALVQAX-DCAQKATOSA-N 0 3 354.411 -1.207 20 0 FAADHN CNC(=O)[C@H](C)[NH2+]C[C@@H]1OCC[C@@H]1c1nnc(CNC(=O)COC)[n-]1 ZINC001130173411 790798154 /nfs/dbraw/zinc/79/81/54/790798154.db2.gz PTQBIIXJWPLJBP-DCAQKATOSA-N 0 3 354.411 -1.336 20 0 FAADHN CNC(=O)[C@@H](C)[NH2+]C[C@@H]1OCC[C@@H]1c1nnc(CNC(=O)COC)[n-]1 ZINC001130173412 790797631 /nfs/dbraw/zinc/79/76/31/790797631.db2.gz PTQBIIXJWPLJBP-VWYCJHECSA-N 0 3 354.411 -1.336 20 0 FAADHN CC(=O)NCc1nnc([C@H]2CCO[C@H]2C[NH2+][C@@H](C)C(=O)NC(N)=O)[n-]1 ZINC001130173459 790798088 /nfs/dbraw/zinc/79/80/88/790798088.db2.gz SBJJFVCPFVDOAU-HGNGGELXSA-N 0 3 353.383 -1.514 20 0 FAADHN CC(=O)NCc1nnc([C@H]2CCO[C@H]2C[NH2+][C@H](C)C(=O)NC(N)=O)[n-]1 ZINC001130173460 790798585 /nfs/dbraw/zinc/79/85/85/790798585.db2.gz SBJJFVCPFVDOAU-JEZHCXPESA-N 0 3 353.383 -1.514 20 0 FAADHN COCC(=O)NCc1nnc([C@H]2CCO[C@H]2C[NH2+][C@@H]2CCNC2=O)[n-]1 ZINC001130173471 790798419 /nfs/dbraw/zinc/79/84/19/790798419.db2.gz SPLXCCABDHHDIE-AXFHLTTASA-N 0 3 352.395 -1.582 20 0 FAADHN COCC(=O)NCc1nnc([C@H]2CCO[C@H]2C[NH2+][C@H]2CCNC2=O)[n-]1 ZINC001130173486 790797908 /nfs/dbraw/zinc/79/79/08/790797908.db2.gz SPLXCCABDHHDIE-DCAQKATOSA-N 0 3 352.395 -1.582 20 0 FAADHN COCCC(=O)NCc1nnc([C@H]2CCO[C@H]2C[NH2+][C@@H](C)C(N)=O)[n-]1 ZINC001130175061 790796204 /nfs/dbraw/zinc/79/62/04/790796204.db2.gz AHFQEIKAWOQLNB-DCAQKATOSA-N 0 3 354.411 -1.207 20 0 FAADHN COCCC(=O)NCc1nnc([C@H]2CCO[C@H]2C[NH2+][C@H](C)C(N)=O)[n-]1 ZINC001130175062 790796876 /nfs/dbraw/zinc/79/68/76/790796876.db2.gz AHFQEIKAWOQLNB-VWYCJHECSA-N 0 3 354.411 -1.207 20 0 FAADHN CNC(=O)C[NH2+]C[C@@H]1OCC[C@@H]1c1nnc(CNC(=O)CCOC)[n-]1 ZINC001130175325 790797041 /nfs/dbraw/zinc/79/70/41/790797041.db2.gz IWPWSDAXECEKDJ-QWRGUYRKSA-N 0 3 354.411 -1.335 20 0 FAADHN CC(=O)NCC(=O)NCc1nnc([C@H]2CCO[C@H]2C[NH2+]CC(N)=O)[n-]1 ZINC001130177611 790796598 /nfs/dbraw/zinc/79/65/98/790796598.db2.gz KNJRIGUPOKQVDH-UWVGGRQHSA-N 0 3 353.383 -2.496 20 0 FAADHN CCC(=O)NCc1nnc([C@H]2CCO[C@H]2C[NH2+]CC(=O)NC(N)=O)[n-]1 ZINC001130180032 790796848 /nfs/dbraw/zinc/79/68/48/790796848.db2.gz XTZBCFFYHSVWKE-IUCAKERBSA-N 0 3 353.383 -1.512 20 0 FAADHN NC(=O)C[NH2+]C[C@@H]1OCC[C@@H]1c1nnc(CNC(=O)[C@H]2CCCO2)[n-]1 ZINC001130181568 790796995 /nfs/dbraw/zinc/79/69/95/790796995.db2.gz LPHBKQZSHIZTQI-AXFHLTTASA-N 0 3 352.395 -1.453 20 0 FAADHN NC(=O)C[NH2+]C[C@@H]1OCC[C@@H]1c1nnc(CNC(=O)[C@@H]2CCCO2)[n-]1 ZINC001130181577 790796419 /nfs/dbraw/zinc/79/64/19/790796419.db2.gz LPHBKQZSHIZTQI-DCAQKATOSA-N 0 3 352.395 -1.453 20 0 FAADHN CNC(=O)C[NH2+]C[C@@H]1OCC[C@@H]1c1nnc(CNC(=O)CSC)[n-]1 ZINC001130181937 790796350 /nfs/dbraw/zinc/79/63/50/790796350.db2.gz YMFDIGZWSMOKLC-UWVGGRQHSA-N 0 3 356.452 -1.008 20 0 FAADHN CC(C)CNC(=O)NC(=O)CNCCNC(=O)[C@H]1CN(C)C[C@@H](C)O1 ZINC001130182666 790799556 /nfs/dbraw/zinc/79/95/56/790799556.db2.gz RTRJXSUNOMWOPO-CHWSQXEVSA-N 0 3 357.455 -1.107 20 0 FAADHN NC(=O)C[NH2+]C[C@@H]1OCC[C@@H]1c1nnc(CNC(=O)CNC(N)=O)[n-]1 ZINC001130182779 790800262 /nfs/dbraw/zinc/80/02/62/790800262.db2.gz BDEZKVOFUUOSHG-YUMQZZPRSA-N 0 3 354.371 -2.963 20 0 FAADHN C[C@H](NC(=O)CNCCNC(=O)[C@H]1CN(C)C[C@@H](C)O1)C(=O)N(C)C ZINC001130184496 790799521 /nfs/dbraw/zinc/79/95/21/790799521.db2.gz SNBFBVFNNWQBQL-FRRDWIJNSA-N 0 3 357.455 -1.996 20 0 FAADHN C[C@@H](NC(=O)CNCCNC(=O)[C@H]1CN(C)C[C@@H](C)O1)C(=O)N(C)C ZINC001130184497 790800050 /nfs/dbraw/zinc/80/00/50/790800050.db2.gz SNBFBVFNNWQBQL-JHJVBQTASA-N 0 3 357.455 -1.996 20 0 FAADHN C[C@@H]1CN(C)C[C@H](C(=O)NCCNCc2cc(=O)n(C)c(=O)n2C)O1 ZINC001130184552 790800900 /nfs/dbraw/zinc/80/09/00/790800900.db2.gz VBNUGHBIPOMAJH-DGCLKSJQSA-N 0 3 353.423 -1.991 20 0 FAADHN C[C@@H](NCCNC(=O)[C@H]1CN(C)C[C@@H](C)O1)C(=O)NC(=O)NC1CC1 ZINC001130184608 790799940 /nfs/dbraw/zinc/79/99/40/790799940.db2.gz WCMHLJFMJUOQMY-NQBHXWOUSA-N 0 3 355.439 -1.212 20 0 FAADHN C[C@H](NCCNC(=O)[C@H]1CN(C)C[C@@H](C)O1)C(=O)NC(=O)NC1CC1 ZINC001130184611 790799374 /nfs/dbraw/zinc/79/93/74/790799374.db2.gz WCMHLJFMJUOQMY-NTZNESFSSA-N 0 3 355.439 -1.212 20 0 FAADHN COCCCC(=O)NCc1nnc([C@H]2CCO[C@H]2C[NH2+]CC(N)=O)[n-]1 ZINC001130187323 790798227 /nfs/dbraw/zinc/79/82/27/790798227.db2.gz ZXFMXSAVMAMZCS-QWRGUYRKSA-N 0 3 354.411 -1.205 20 0 FAADHN CNC(=O)C[NH2+]C[C@@H]1OCC[C@@H]1c1nnc(CNC(=O)[C@H](C)OC)[n-]1 ZINC001130187676 790798335 /nfs/dbraw/zinc/79/83/35/790798335.db2.gz CWJGQQGQHDQKAD-DCAQKATOSA-N 0 3 354.411 -1.336 20 0 FAADHN CNC(=O)C[NH2+]C[C@@H]1OCC[C@@H]1c1nnc(CNC(=O)[C@@H](C)OC)[n-]1 ZINC001130187677 790798660 /nfs/dbraw/zinc/79/86/60/790798660.db2.gz CWJGQQGQHDQKAD-VWYCJHECSA-N 0 3 354.411 -1.336 20 0 FAADHN NC(=O)C[NH2+]C[C@@H]1OCC[C@@H]1c1nnc(CNC(=O)c2cnsn2)[n-]1 ZINC001130187795 790797546 /nfs/dbraw/zinc/79/75/46/790797546.db2.gz JRTYCYYTGZMZIK-CBAPKCEASA-N 0 3 366.407 -1.466 20 0 FAADHN CCOCC(=O)NCc1nnc([C@H]2CCO[C@H]2C[NH2+]CC(=O)NC)[n-]1 ZINC001130187935 790798509 /nfs/dbraw/zinc/79/85/09/790798509.db2.gz QZDZLKPFXUHPTO-QWRGUYRKSA-N 0 3 354.411 -1.335 20 0 FAADHN CCO[C@@H](C)C(=O)NCc1nnc([C@H]2CCO[C@H]2C[NH2+]CC(N)=O)[n-]1 ZINC001130187985 790798174 /nfs/dbraw/zinc/79/81/74/790798174.db2.gz SPWFFABVKWBERJ-DCAQKATOSA-N 0 3 354.411 -1.207 20 0 FAADHN CCO[C@H](C)C(=O)NCc1nnc([C@H]2CCO[C@H]2C[NH2+]CC(N)=O)[n-]1 ZINC001130187986 790798527 /nfs/dbraw/zinc/79/85/27/790798527.db2.gz SPWFFABVKWBERJ-VWYCJHECSA-N 0 3 354.411 -1.207 20 0 FAADHN NC(=O)C[NH2+]C[C@@H]1OCC[C@@H]1c1nnc(CNC(=O)c2cnns2)[n-]1 ZINC001130188033 790798707 /nfs/dbraw/zinc/79/87/07/790798707.db2.gz VYTBKFIPXCOSFZ-YUMQZZPRSA-N 0 3 366.407 -1.466 20 0 FAADHN CCOCC(=O)NCc1nnc([C@H]2CCO[C@H]2C[NH2+][C@@H](C)C(N)=O)[n-]1 ZINC001130188050 790798807 /nfs/dbraw/zinc/79/88/07/790798807.db2.gz WOBPTWVQYBULOX-DCAQKATOSA-N 0 3 354.411 -1.207 20 0 FAADHN CCOCC(=O)NCc1nnc([C@H]2CCO[C@H]2C[NH2+][C@H](C)C(N)=O)[n-]1 ZINC001130188051 790797951 /nfs/dbraw/zinc/79/79/51/790797951.db2.gz WOBPTWVQYBULOX-VWYCJHECSA-N 0 3 354.411 -1.207 20 0 FAADHN CCCOCC(=O)NCc1nnc([C@H]2CCO[C@H]2C[NH2+]CC(N)=O)[n-]1 ZINC001130190741 790798545 /nfs/dbraw/zinc/79/85/45/790798545.db2.gz MHHGDXBUWPXSJJ-QWRGUYRKSA-N 0 3 354.411 -1.205 20 0 FAADHN NC(=O)C[NH2+]C[C@@H]1OCC[C@@H]1c1nnc(CNC(=O)[C@H]2CCOC2)[n-]1 ZINC001130190768 790798255 /nfs/dbraw/zinc/79/82/55/790798255.db2.gz NGFGPTYBDVCEGS-DCAQKATOSA-N 0 3 352.395 -1.595 20 0 FAADHN NC(=O)C[NH2+]C[C@@H]1OCC[C@@H]1c1nnc(CNC(=O)[C@@H]2CCOC2)[n-]1 ZINC001130190769 790798435 /nfs/dbraw/zinc/79/84/35/790798435.db2.gz NGFGPTYBDVCEGS-VWYCJHECSA-N 0 3 352.395 -1.595 20 0 FAADHN CC(C)OCC(=O)NCc1nnc([C@H]2CCO[C@H]2C[NH2+]CC(N)=O)[n-]1 ZINC001130190810 790798641 /nfs/dbraw/zinc/79/86/41/790798641.db2.gz OPZWSHUBTOPUFR-QWRGUYRKSA-N 0 3 354.411 -1.207 20 0 FAADHN CC[C@@H](OC)C(=O)NCc1nnc([C@H]2CCO[C@H]2C[NH2+]CC(N)=O)[n-]1 ZINC001130192968 790798372 /nfs/dbraw/zinc/79/83/72/790798372.db2.gz CPFUHEHWMAPESP-AXFHLTTASA-N 0 3 354.411 -1.207 20 0 FAADHN CC[C@H](OC)C(=O)NCc1nnc([C@H]2CCO[C@H]2C[NH2+]CC(N)=O)[n-]1 ZINC001130192969 790797873 /nfs/dbraw/zinc/79/78/73/790797873.db2.gz CPFUHEHWMAPESP-DCAQKATOSA-N 0 3 354.411 -1.207 20 0 FAADHN CO[C@@H](C)CC(=O)NCc1nnc([C@H]2CCO[C@H]2C[NH2+]CC(N)=O)[n-]1 ZINC001130193081 790797679 /nfs/dbraw/zinc/79/76/79/790797679.db2.gz HRGMCSVMHNAUOV-DCAQKATOSA-N 0 3 354.411 -1.207 20 0 FAADHN CO[C@H](C)CC(=O)NCc1nnc([C@H]2CCO[C@H]2C[NH2+]CC(N)=O)[n-]1 ZINC001130193082 790798115 /nfs/dbraw/zinc/79/81/15/790798115.db2.gz HRGMCSVMHNAUOV-VWYCJHECSA-N 0 3 354.411 -1.207 20 0 FAADHN CCOCCC(=O)NCc1nnc([C@H]2CCO[C@H]2C[NH2+]CC(N)=O)[n-]1 ZINC001130193109 790798727 /nfs/dbraw/zinc/79/87/27/790798727.db2.gz IZOVYHYZSIALOA-QWRGUYRKSA-N 0 3 354.411 -1.205 20 0 FAADHN C[C@H]([NH2+]C[C@@H]1OCC[C@@H]1c1nnc(CNC(=O)CC(N)=O)[n-]1)C(N)=O ZINC001130198478 790798028 /nfs/dbraw/zinc/79/80/28/790798028.db2.gz MKIRREHNFNWPPZ-CIUDSAMLSA-N 0 3 353.383 -2.368 20 0 FAADHN C[C@@H]([NH2+]C[C@@H]1OCC[C@@H]1c1nnc(CNC(=O)CC(N)=O)[n-]1)C(N)=O ZINC001130198479 790798299 /nfs/dbraw/zinc/79/82/99/790798299.db2.gz MKIRREHNFNWPPZ-VGMNWLOBSA-N 0 3 353.383 -2.368 20 0 FAADHN CNC(=O)C[NH2+]C[C@@H]1OCC[C@@H]1c1nnc(CNC(=O)CC(N)=O)[n-]1 ZINC001130198482 790799461 /nfs/dbraw/zinc/79/94/61/790799461.db2.gz MOMBFQZNJPPMEU-IUCAKERBSA-N 0 3 353.383 -2.496 20 0 FAADHN COC[C@H](C)C(=O)NCc1nnc([C@H]2CCO[C@H]2C[NH2+]CC(N)=O)[n-]1 ZINC001130202908 790802457 /nfs/dbraw/zinc/80/24/57/790802457.db2.gz NWOHMLKKDYKPGB-DCAQKATOSA-N 0 3 354.411 -1.349 20 0 FAADHN COC[C@@H](C)C(=O)NCc1nnc([C@H]2CCO[C@H]2C[NH2+]CC(N)=O)[n-]1 ZINC001130202910 790802223 /nfs/dbraw/zinc/80/22/23/790802223.db2.gz NWOHMLKKDYKPGB-VWYCJHECSA-N 0 3 354.411 -1.349 20 0 FAADHN CNC(=O)CC(=O)NCc1nnc([C@H]2CCO[C@H]2C[NH2+]CC(N)=O)[n-]1 ZINC001130205400 790800505 /nfs/dbraw/zinc/80/05/05/790800505.db2.gz YHMTUPMNBORJRJ-IUCAKERBSA-N 0 3 353.383 -2.496 20 0 FAADHN CC(C)[C@@H](O)C(=O)NCc1nnc([C@H]2CCO[C@H]2C[NH2+]CC(N)=O)[n-]1 ZINC001130207813 790802647 /nfs/dbraw/zinc/80/26/47/790802647.db2.gz QUSRYWIUXFPYDL-OUJBWJOFSA-N 0 3 354.411 -1.615 20 0 FAADHN CC(C)(O)CC(=O)NCc1nnc([C@H]2CCO[C@H]2C[NH2+]CC(N)=O)[n-]1 ZINC001130209667 790801432 /nfs/dbraw/zinc/80/14/32/790801432.db2.gz JQEZVPZOAKPPPI-UWVGGRQHSA-N 0 3 354.411 -1.471 20 0 FAADHN NC(=O)C[NH2+]C[C@@H]1OCC[C@@H]1c1nnc(CNC(=O)c2csnn2)[n-]1 ZINC001130225015 790802004 /nfs/dbraw/zinc/80/20/04/790802004.db2.gz NRBQXWIQUDFYHB-CBAPKCEASA-N 0 3 366.407 -1.466 20 0 FAADHN CC[C@H]([NH2+]C[C@@H]1OCC[C@@H]1c1nnc(CNC(=O)C(N)=O)[n-]1)C(N)=O ZINC001130232196 790802984 /nfs/dbraw/zinc/80/29/84/790802984.db2.gz CGAQZRKWMDWOGX-CIUDSAMLSA-N 0 3 353.383 -2.368 20 0 FAADHN CC[C@@H]([NH2+]C[C@@H]1OCC[C@@H]1c1nnc(CNC(=O)C(N)=O)[n-]1)C(N)=O ZINC001130232197 790804693 /nfs/dbraw/zinc/80/46/93/790804693.db2.gz CGAQZRKWMDWOGX-YIZRAAEISA-N 0 3 353.383 -2.368 20 0 FAADHN NC(=O)C(=O)NCc1n[nH]c([C@H]2CCO[C@H]2CNCc2csnn2)n1 ZINC001130232378 790803410 /nfs/dbraw/zinc/80/34/10/790803410.db2.gz FQBITYOYERXELX-IUCAKERBSA-N 0 3 366.407 -1.580 20 0 FAADHN NC(=O)C(=O)NCc1n[nH]c([C@H]2CCO[C@H]2CNCc2cnsn2)n1 ZINC001130232416 790804436 /nfs/dbraw/zinc/80/44/36/790804436.db2.gz GSKASHXTSKTETC-IUCAKERBSA-N 0 3 366.407 -1.580 20 0 FAADHN CCNC(=O)C[NH2+]C[C@@H]1OCC[C@@H]1c1nnc(CNC(=O)C(N)=O)[n-]1 ZINC001130232496 790803364 /nfs/dbraw/zinc/80/33/64/790803364.db2.gz IUBWOZLFYROIBO-IUCAKERBSA-N 0 3 353.383 -2.496 20 0 FAADHN CNC(=O)[C@H](C)[NH2+]C[C@@H]1OCC[C@@H]1c1nnc(CNC(=O)C(N)=O)[n-]1 ZINC001130232732 790803716 /nfs/dbraw/zinc/80/37/16/790803716.db2.gz POWDOMFCEQNBQF-CIUDSAMLSA-N 0 3 353.383 -2.497 20 0 FAADHN CNC(=O)[C@@H](C)[NH2+]C[C@@H]1OCC[C@@H]1c1nnc(CNC(=O)C(N)=O)[n-]1 ZINC001130232733 790804128 /nfs/dbraw/zinc/80/41/28/790804128.db2.gz POWDOMFCEQNBQF-VGMNWLOBSA-N 0 3 353.383 -2.497 20 0 FAADHN CN(C)C(=O)C[NH2+]C[C@@H]1OCC[C@@H]1c1nnc(CNC(=O)C(N)=O)[n-]1 ZINC001130233031 790803664 /nfs/dbraw/zinc/80/36/64/790803664.db2.gz WBOLBRREUJHHBM-IUCAKERBSA-N 0 3 353.383 -2.544 20 0 FAADHN NC(=O)C(=O)NCc1nnc([C@H]2CCO[C@H]2C[NH2+][C@H]2CCNC2=O)[n-]1 ZINC001130233117 790804490 /nfs/dbraw/zinc/80/44/90/790804490.db2.gz YOGPMVQMUFSSGR-CIUDSAMLSA-N 0 3 351.367 -2.743 20 0 FAADHN NC(=O)C(=O)NCc1nnc([C@H]2CCO[C@H]2C[NH2+][C@@H]2CCNC2=O)[n-]1 ZINC001130233118 790804569 /nfs/dbraw/zinc/80/45/69/790804569.db2.gz YOGPMVQMUFSSGR-YIZRAAEISA-N 0 3 351.367 -2.743 20 0 FAADHN NC(=O)C[NH2+]C[C@@H]1OCC[C@@H]1c1nnc(CNC(=O)c2cnon2)[n-]1 ZINC001130244919 790804195 /nfs/dbraw/zinc/80/41/95/790804195.db2.gz QRYZBERJBHJKJM-CBAPKCEASA-N 0 3 350.339 -1.935 20 0 FAADHN C[C@@H](NCCNC(=O)[C@@H]1OCCO[C@@H]1C(F)(F)F)C(=O)NC(N)=O ZINC001130255541 790806437 /nfs/dbraw/zinc/80/64/37/790806437.db2.gz QUASHYALXZNYOL-PRJMDXOYSA-N 0 3 356.301 -1.378 20 0 FAADHN C[C@H](NCCNC(=O)[C@@H]1OCCO[C@@H]1C(F)(F)F)C(=O)NC(N)=O ZINC001130255542 790805323 /nfs/dbraw/zinc/80/53/23/790805323.db2.gz QUASHYALXZNYOL-RNJXMRFFSA-N 0 3 356.301 -1.378 20 0 FAADHN CCNC(=O)NC(=O)CNCCNC(=O)[C@@H]1OCCO[C@@H]1C(F)(F)F ZINC001130258260 790805084 /nfs/dbraw/zinc/80/50/84/790805084.db2.gz MVUVKQSTIWPVTK-ZJUUUORDSA-N 0 3 370.328 -1.116 20 0 FAADHN O=C(NCCN[C@@H]1CCC(=O)NC1=O)[C@@H]1OCCO[C@@H]1C(F)(F)F ZINC001130261371 790806178 /nfs/dbraw/zinc/80/61/78/790806178.db2.gz ANHKOURIZYPCJL-QNSHHTMESA-N 0 3 353.297 -1.156 20 0 FAADHN O=C(NCCN[C@H]1CCC(=O)NC1=O)[C@@H]1OCCO[C@@H]1C(F)(F)F ZINC001130261372 790805219 /nfs/dbraw/zinc/80/52/19/790805219.db2.gz ANHKOURIZYPCJL-SFGNSQDASA-N 0 3 353.297 -1.156 20 0 FAADHN O=C(CNCCNC(=O)[C@@H]1OCCO[C@@H]1C(F)(F)F)N1CCOCC1 ZINC001130261410 790805505 /nfs/dbraw/zinc/80/55/05/790805505.db2.gz BYUWKPJYBJFFLM-NEPJUHHUSA-N 0 3 369.340 -1.103 20 0 FAADHN CS(=O)(=O)NCCNCCNC(=O)[C@@H]1OCCO[C@@H]1C(F)(F)F ZINC001130261552 790805054 /nfs/dbraw/zinc/80/50/54/790805054.db2.gz GCEUAUGTYOMFCN-BDAKNGLRSA-N 0 3 363.358 -1.412 20 0 FAADHN CNC(=O)NC(=O)CNCCNC(=O)[C@@H]1OCCO[C@@H]1C(F)(F)F ZINC001130262009 790805969 /nfs/dbraw/zinc/80/59/69/790805969.db2.gz QXOZJUOXTDOAAI-BDAKNGLRSA-N 0 3 356.301 -1.506 20 0 FAADHN CNC(=O)NC(=O)[C@@H](C)NCCNC(=O)[C@@H]1OCCO[C@@H]1C(F)(F)F ZINC001130262276 790806058 /nfs/dbraw/zinc/80/60/58/790806058.db2.gz VQGHGXRGOCLCJT-HLTSFMKQSA-N 0 3 370.328 -1.117 20 0 FAADHN CNC(=O)NC(=O)[C@H](C)NCCNC(=O)[C@@H]1OCCO[C@@H]1C(F)(F)F ZINC001130262277 790805540 /nfs/dbraw/zinc/80/55/40/790805540.db2.gz VQGHGXRGOCLCJT-YIZRAAEISA-N 0 3 370.328 -1.117 20 0 FAADHN Cn1cnc([C@@H]2CN(C(=O)CC(N)=O)C[C@H]2NCCCS(C)(=O)=O)c1 ZINC001130542161 790809569 /nfs/dbraw/zinc/80/95/69/790809569.db2.gz RYHXWUKAAJEGEF-WCQYABFASA-N 0 3 371.463 -1.386 20 0 FAADHN COCCN[C@@H]1CN(C(=O)C2CS(=O)(=O)C2)C[C@H]1c1cn(C)cn1 ZINC001130599617 790811008 /nfs/dbraw/zinc/81/10/08/790811008.db2.gz XFQFWAPJKPDLAL-GXTWGEPZSA-N 0 3 356.448 -1.005 20 0 FAADHN C[C@@H](CN[C@@H]1CN(C(=O)C(N)=O)C[C@H]1c1cn(C)cn1)CS(C)(=O)=O ZINC001130659374 790811628 /nfs/dbraw/zinc/81/16/28/790811628.db2.gz KKTMGKZWULPUBN-GMXVVIOVSA-N 0 3 371.463 -1.530 20 0 FAADHN C[C@H](CN[C@@H]1CN(C(=O)C(N)=O)C[C@H]1c1cn(C)cn1)CS(C)(=O)=O ZINC001130659376 790811466 /nfs/dbraw/zinc/81/14/66/790811466.db2.gz KKTMGKZWULPUBN-NTZNESFSSA-N 0 3 371.463 -1.530 20 0 FAADHN CCS(=O)(=O)CCCN[C@@H]1CN(C(=O)C(N)=O)C[C@H]1c1cn(C)cn1 ZINC001130659816 790812264 /nfs/dbraw/zinc/81/22/64/790812264.db2.gz VKDNWQSAMFDJET-WCQYABFASA-N 0 3 371.463 -1.386 20 0 FAADHN Cn1cnc([C@@H]2CN(C(=O)C(N)=O)C[C@H]2NCCCS(C)(=O)=O)c1 ZINC001130659864 790811954 /nfs/dbraw/zinc/81/19/54/790811954.db2.gz XUWHZQHTKHGHHP-CMPLNLGQSA-N 0 3 357.436 -1.776 20 0 FAADHN Cn1cnc([C@@H]2CN(C(=O)C(=O)NCC(F)(F)F)C[C@H]2NCCO)c1 ZINC001130706695 790813128 /nfs/dbraw/zinc/81/31/28/790813128.db2.gz TVNOCDIPHYFDIE-GXSJLCMTSA-N 0 3 363.340 -1.025 20 0 FAADHN C[C@H](CS(C)(=O)=O)C(=O)N1C[C@@H](c2cn(C)cn2)[C@H](NCCO)C1 ZINC001130739648 790812978 /nfs/dbraw/zinc/81/29/78/790812978.db2.gz IUTRZGMGACEZDE-MBNYWOFBSA-N 0 3 358.464 -1.023 20 0 FAADHN C[C@@H](CS(C)(=O)=O)C(=O)N1C[C@@H](c2cn(C)cn2)[C@H](NCCO)C1 ZINC001130739649 790813237 /nfs/dbraw/zinc/81/32/37/790813237.db2.gz IUTRZGMGACEZDE-SGMGOOAPSA-N 0 3 358.464 -1.023 20 0 FAADHN CC(=O)NCc1n[n-]c([C@H]2CC[C@@H](C[NH2+][C@H](C)C(=O)NC(N)=O)O2)n1 ZINC001130747387 790814069 /nfs/dbraw/zinc/81/40/69/790814069.db2.gz UOQFGUJRGFXQJU-FKTZTGRPSA-N 0 3 353.383 -1.166 20 0 FAADHN CC(=O)NCc1n[n-]c([C@H]2CC[C@@H](C[NH2+][C@@H](C)C(=O)NC(N)=O)O2)n1 ZINC001130747388 790814894 /nfs/dbraw/zinc/81/48/94/790814894.db2.gz UOQFGUJRGFXQJU-UJNFCWOMSA-N 0 3 353.383 -1.166 20 0 FAADHN CC[C@@H]([NH2+]C[C@@H]1CC[C@H](c2nc(CNC(=O)C(N)=O)n[n-]2)O1)C(N)=O ZINC001130802500 790817553 /nfs/dbraw/zinc/81/75/53/790817553.db2.gz WWCUKARSNMIGLQ-DJLDLDEBSA-N 0 3 353.383 -2.020 20 0 FAADHN CC[C@H]([NH2+]C[C@@H]1CC[C@H](c2nc(CNC(=O)C(N)=O)n[n-]2)O1)C(N)=O ZINC001130802501 790817708 /nfs/dbraw/zinc/81/77/08/790817708.db2.gz WWCUKARSNMIGLQ-XHNCKOQMSA-N 0 3 353.383 -2.020 20 0 FAADHN NC(=O)C(=O)NCc1n[nH]c([C@H]2CC[C@@H](CNCc3cnon3)O2)n1 ZINC001130806687 790817607 /nfs/dbraw/zinc/81/76/07/790817607.db2.gz IOPAVVTUAHKDMA-DTWKUNHWSA-N 0 3 350.339 -1.701 20 0 FAADHN CNC(=O)[C@@H](C)[NH2+]C[C@@H]1CC[C@H](c2nc(CNC(=O)C(N)=O)n[n-]2)O1 ZINC001130806921 790816984 /nfs/dbraw/zinc/81/69/84/790816984.db2.gz MVVDUQYBYTWDOE-HRDYMLBCSA-N 0 3 353.383 -2.150 20 0 FAADHN CNC(=O)[C@H](C)[NH2+]C[C@@H]1CC[C@H](c2nc(CNC(=O)C(N)=O)n[n-]2)O1 ZINC001130806923 790816918 /nfs/dbraw/zinc/81/69/18/790816918.db2.gz MVVDUQYBYTWDOE-XHNCKOQMSA-N 0 3 353.383 -2.150 20 0 FAADHN Cn1cncc1[C@@H]1CN(C(=O)CC(N)=O)C[C@H]1NCCCS(C)(=O)=O ZINC001130946651 790820122 /nfs/dbraw/zinc/82/01/22/790820122.db2.gz YYDYLKFRXMPOEI-VXGBXAGGSA-N 0 3 371.463 -1.386 20 0 FAADHN COCCN[C@@H]1CN(C(=O)C2CS(=O)(=O)C2)C[C@H]1c1cncn1C ZINC001130999273 790821243 /nfs/dbraw/zinc/82/12/43/790821243.db2.gz NGYIJNQNFJFPEN-CHWSQXEVSA-N 0 3 356.448 -1.005 20 0 FAADHN Cn1cncc1[C@@H]1CN(C(=O)C(N)=O)C[C@H]1NCCCS(C)(=O)=O ZINC001131059705 790820758 /nfs/dbraw/zinc/82/07/58/790820758.db2.gz FHTARVDHINZWPL-GHMZBOCLSA-N 0 3 357.436 -1.776 20 0 FAADHN C[C@H](CN[C@@H]1CN(C(=O)C(N)=O)C[C@H]1c1cncn1C)CS(C)(=O)=O ZINC001131064384 790821202 /nfs/dbraw/zinc/82/12/02/790821202.db2.gz HUBJRZUMDOGPNB-IJLUTSLNSA-N 0 3 371.463 -1.530 20 0 FAADHN C[C@@H](CN[C@@H]1CN(C(=O)C(N)=O)C[C@H]1c1cncn1C)CS(C)(=O)=O ZINC001131064385 790822778 /nfs/dbraw/zinc/82/27/78/790822778.db2.gz HUBJRZUMDOGPNB-QJPTWQEYSA-N 0 3 371.463 -1.530 20 0 FAADHN CCS(=O)(=O)CCCN[C@@H]1CN(C(=O)C(N)=O)C[C@H]1c1cncn1C ZINC001131064800 790822184 /nfs/dbraw/zinc/82/21/84/790822184.db2.gz STOAUQGWTKCIEQ-VXGBXAGGSA-N 0 3 371.463 -1.386 20 0 FAADHN Cn1cncc1[C@@H]1CN(C(=O)C(=O)NCC(F)(F)F)C[C@H]1NCCO ZINC001131103631 790822757 /nfs/dbraw/zinc/82/27/57/790822757.db2.gz UDERDXXIDDHRHT-NXEZZACHSA-N 0 3 363.340 -1.025 20 0 FAADHN C[C@H](CS(C)(=O)=O)C(=O)N1C[C@@H](c2cncn2C)[C@H](NCCO)C1 ZINC001131130669 790823880 /nfs/dbraw/zinc/82/38/80/790823880.db2.gz XYCICKNFFLUWEO-JHJVBQTASA-N 0 3 358.464 -1.023 20 0 FAADHN C[C@@H](CS(C)(=O)=O)C(=O)N1C[C@@H](c2cncn2C)[C@H](NCCO)C1 ZINC001131130670 790824109 /nfs/dbraw/zinc/82/41/09/790824109.db2.gz XYCICKNFFLUWEO-YNEHKIRRSA-N 0 3 358.464 -1.023 20 0 FAADHN CNC(=O)CN[C@@H]1CCO[C@H]1C1CCN(C(=O)Cn2cnnn2)CC1 ZINC001131416478 790826248 /nfs/dbraw/zinc/82/62/48/790826248.db2.gz GWHHQWHWHOZBMB-DOMZBBRYSA-N 0 3 351.411 -1.595 20 0 FAADHN CCNC(=O)CN[C@@H]1CCO[C@H]1C1CCN(C(=O)CNC(N)=O)CC1 ZINC001131421843 790826285 /nfs/dbraw/zinc/82/62/85/790826285.db2.gz YSHJGCKCEVTMFD-DOMZBBRYSA-N 0 3 355.439 -1.224 20 0 FAADHN CNC(=O)CN[C@@H]1CCO[C@H]1C1CCN(C(=O)CS(C)(=O)=O)CC1 ZINC001131433738 790827747 /nfs/dbraw/zinc/82/77/47/790827747.db2.gz DORKCFBTWGRZOY-DOMZBBRYSA-N 0 3 361.464 -1.237 20 0 FAADHN NC(=O)CN[C@@H]1CCO[C@H]1C1CCN(C(=O)CNC(=O)C2CC2)CC1 ZINC001131436820 790827993 /nfs/dbraw/zinc/82/79/93/790827993.db2.gz CQGFXKOVLFXVHB-CJNGLKHVSA-N 0 3 352.435 -1.016 20 0 FAADHN CNC(=O)CN[C@@H]1CCO[C@H]1C1CCN(C(=O)[C@H]2CCC(=O)N2)CC1 ZINC001131448605 790827274 /nfs/dbraw/zinc/82/72/74/790827274.db2.gz ICSUOMNONNVXRT-IOASZLSFSA-N 0 3 352.435 -1.003 20 0 FAADHN NC(=O)CC(=O)N1CCC([C@@H]2OCC[C@H]2NCC(=O)NC(N)=O)CC1 ZINC001131456046 790827210 /nfs/dbraw/zinc/82/72/10/790827210.db2.gz IJDWRXKMQDSSMO-YGRLFVJLSA-N 0 3 355.395 -1.958 20 0 FAADHN CS(=O)(=O)CCN[C@@H]1CCO[C@H]1C1CCN(C(=O)CC(N)=O)CC1 ZINC001131456359 790827178 /nfs/dbraw/zinc/82/71/78/790827178.db2.gz NLUXKTDREDJCFF-DOMZBBRYSA-N 0 3 361.464 -1.108 20 0 FAADHN CNC(=O)CN[C@@H]1CCO[C@H]1C1CCN(C(=O)[C@H](C)NC(N)=O)CC1 ZINC001131480653 790827696 /nfs/dbraw/zinc/82/76/96/790827696.db2.gz QDFOZKRGPORRIJ-SUHUHFCYSA-N 0 3 355.439 -1.225 20 0 FAADHN CNC(=O)CN[C@@H]1CCO[C@H]1C1CCN(C(=O)[C@H]2COC(=O)N2)CC1 ZINC001131487906 790827552 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790829237 /nfs/dbraw/zinc/82/92/37/790829237.db2.gz YLZUMTDITOLHQJ-DOMZBBRYSA-N 0 3 361.464 -1.108 20 0 FAADHN O=C(CNCCNC(=O)[C@@H]1CC[C@H](CN2CCOCC2)O1)N1CCC1 ZINC001131610858 790829384 /nfs/dbraw/zinc/82/93/84/790829384.db2.gz LOLQWAHDVPZKHO-CABCVRRESA-N 0 3 354.451 -1.196 20 0 FAADHN O=C(CNCCNC(=O)[C@@H]1CC[C@H](CN2CCOCC2)O1)NC1CC1 ZINC001131613516 790829011 /nfs/dbraw/zinc/82/90/11/790829011.db2.gz DJOZARBZAMZCAL-CABCVRRESA-N 0 3 354.451 -1.149 20 0 FAADHN CN1CC[C@H](NCCNC(=O)[C@@H]2CC[C@H](CN3CCOCC3)O2)C1=O ZINC001131613540 790828663 /nfs/dbraw/zinc/82/86/63/790828663.db2.gz FGNPMFKEDZMCSV-ILXRZTDVSA-N 0 3 354.451 -1.197 20 0 FAADHN CN1CC[C@@H](NCCNC(=O)[C@@H]2CC[C@H](CN3CCOCC3)O2)C1=O ZINC001131613541 790828707 /nfs/dbraw/zinc/82/87/07/790828707.db2.gz FGNPMFKEDZMCSV-KFWWJZLASA-N 0 3 354.451 -1.197 20 0 FAADHN O=C(NCCN[C@H]1CCCNC1=O)[C@@H]1CC[C@H](CN2CCOCC2)O1 ZINC001131613659 790828322 /nfs/dbraw/zinc/82/83/22/790828322.db2.gz JHKWWGXMIKKRFG-ILXRZTDVSA-N 0 3 354.451 -1.149 20 0 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FAADHN CNS(=O)(=O)N1CCC(C(=O)N2CC[C@@H](N3CC[C@H](O)C3)C2)CC1 ZINC001140117213 792838131 /nfs/dbraw/zinc/83/81/31/792838131.db2.gz QLUSPCDVLRPYHU-KGLIPLIRSA-N 0 3 360.480 -1.170 20 0 FAADHN CNS(=O)(=O)N1CCC(C(=O)N2CC[C@H](N3CC[C@@H](O)C3)C2)CC1 ZINC001140117215 792837867 /nfs/dbraw/zinc/83/78/67/792837867.db2.gz QLUSPCDVLRPYHU-UONOGXRCSA-N 0 3 360.480 -1.170 20 0 FAADHN CNS(=O)(=O)N1CCC(C(=O)N2CC[C@@H](N3CC[C@@H](O)C3)C2)CC1 ZINC001140117223 792838213 /nfs/dbraw/zinc/83/82/13/792838213.db2.gz QLUSPCDVLRPYHU-ZIAGYGMSSA-N 0 3 360.480 -1.170 20 0 FAADHN C[C@@H](O)[C@H](NC(=O)C1CC1)C(=O)NCC(=O)NCCN1CCCCC1 ZINC001140743231 792839234 /nfs/dbraw/zinc/83/92/34/792839234.db2.gz CBLICYQHAMCGQH-DOMZBBRYSA-N 0 3 354.451 -1.020 20 0 FAADHN C[C@@H](O)[C@@H](NC(=O)C1CC1)C(=O)NCC(=O)NCCN1CCCCC1 ZINC001140743232 792839054 /nfs/dbraw/zinc/83/90/54/792839054.db2.gz CBLICYQHAMCGQH-IUODEOHRSA-N 0 3 354.451 -1.020 20 0 FAADHN C[C@H](O)[C@@H](NC(=O)C1CC1)C(=O)NCC(=O)NCCN1CCCCC1 ZINC001140743233 792839080 /nfs/dbraw/zinc/83/90/80/792839080.db2.gz CBLICYQHAMCGQH-SWLSCSKDSA-N 0 3 354.451 -1.020 20 0 FAADHN C[C@H](O)[C@H](NC(=O)C1CC1)C(=O)NCC(=O)NCCN1CCCCC1 ZINC001140743234 792839132 /nfs/dbraw/zinc/83/91/32/792839132.db2.gz CBLICYQHAMCGQH-WFASDCNBSA-N 0 3 354.451 -1.020 20 0 FAADHN Cn1cc(C(=O)NCC(=O)NCCN2CCCCC2)c(=O)n(C)c1=O ZINC001140743352 792838998 /nfs/dbraw/zinc/83/89/98/792838998.db2.gz HXEIFIFZGMZOSR-UHFFFAOYSA-N 0 3 351.407 -1.584 20 0 FAADHN CO[C@@]1(C(=O)NCC(=O)NCCN2CCCCC2)CCS(=O)(=O)C1 ZINC001140746912 792838784 /nfs/dbraw/zinc/83/87/84/792838784.db2.gz TWHKHKNHCWWMNA-HNNXBMFYSA-N 0 3 361.464 -1.092 20 0 FAADHN CO[C@]1(C(=O)NCC(=O)NCCN2CCCCC2)CCS(=O)(=O)C1 ZINC001140746914 792839348 /nfs/dbraw/zinc/83/93/48/792839348.db2.gz TWHKHKNHCWWMNA-OAHLLOKOSA-N 0 3 361.464 -1.092 20 0 FAADHN C[C@H](NC(=O)Cn1cnnn1)C(=O)NCCCCN1CCN(C)CC1 ZINC001141531695 792840939 /nfs/dbraw/zinc/84/09/39/792840939.db2.gz KJPVVUFSSVRGFI-ZDUSSCGKSA-N 0 3 352.443 -1.678 20 0 FAADHN COCCN(C)CCN1C[C@H](NC(=O)Cn2nc(C)oc2=O)CC1=O ZINC001141739541 792842575 /nfs/dbraw/zinc/84/25/75/792842575.db2.gz KFEZWHWVWGHKAK-GFCCVEGCSA-N 0 3 355.395 -1.560 20 0 FAADHN COCCN(C)CCN1C[C@@H](NC(=O)Cn2nc(C)oc2=O)CC1=O ZINC001141739542 792842818 /nfs/dbraw/zinc/84/28/18/792842818.db2.gz KFEZWHWVWGHKAK-LBPRGKRZSA-N 0 3 355.395 -1.560 20 0 FAADHN CNC(=O)CN1CCCC12CCN(C(=O)CN1CC(=O)NC1=O)CC2 ZINC001142088454 792844386 /nfs/dbraw/zinc/84/43/86/792844386.db2.gz FCZUIZZFDACBJL-UHFFFAOYSA-N 0 3 351.407 -1.259 20 0 FAADHN CC(C)N(C)CC(=O)N[C@H]1[C@H](n2ccc(N)nc2=O)O[C@H](CO)[C@H]1O ZINC001142590130 792847965 /nfs/dbraw/zinc/84/79/65/792847965.db2.gz HALKZRNDJJVYFH-ICGCDAGXSA-N 0 3 355.395 -1.856 20 0 FAADHN Nc1nc(=O)c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3N)c2n1C(=O)C1CC1 ZINC001142680646 792847730 /nfs/dbraw/zinc/84/77/30/792847730.db2.gz RYPXFFICGNCHFX-HTFXMJNNSA-N 0 3 350.335 -2.197 20 0 FAADHN COCC(=O)n1c2c(ncn2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2N)c(=O)nc1N ZINC001142822924 792849000 /nfs/dbraw/zinc/84/90/00/792849000.db2.gz WPZFMGQTIIFLGR-MUIQIWNUSA-N 0 3 354.323 -2.960 20 0 FAADHN CS(=O)(=O)N1CC(C(=O)N2CCC(N3CCC[C@@H]3C(N)=O)CC2)C1 ZINC001142969157 792848756 /nfs/dbraw/zinc/84/87/56/792848756.db2.gz HMBDTCUALSPVGR-CYBMUJFWSA-N 0 3 358.464 -1.182 20 0 FAADHN CS(=O)(=O)N1CC(C(=O)N2CCC(N3CCC[C@H]3C(N)=O)CC2)C1 ZINC001142969163 792848818 /nfs/dbraw/zinc/84/88/18/792848818.db2.gz HMBDTCUALSPVGR-ZDUSSCGKSA-N 0 3 358.464 -1.182 20 0 FAADHN NC(=O)[C@H]1CCCN1C1CCN(C(=O)CN2CCC(=O)NC2=O)CC1 ZINC001142969553 792848712 /nfs/dbraw/zinc/84/87/12/792848712.db2.gz JKNFRDSFQJOULK-GFCCVEGCSA-N 0 3 351.407 -1.131 20 0 FAADHN NC(=O)[C@@H]1CCCN1C1CCN(C(=O)CN2CCC(=O)NC2=O)CC1 ZINC001142969554 792849136 /nfs/dbraw/zinc/84/91/36/792849136.db2.gz JKNFRDSFQJOULK-LBPRGKRZSA-N 0 3 351.407 -1.131 20 0 FAADHN CC(=O)N1CC(=O)NC[C@]12CCN(C(=O)CCN1CCN(C)CC1)C2 ZINC001143230810 792851208 /nfs/dbraw/zinc/85/12/08/792851208.db2.gz OLMXWKDXLCCIKK-KRWDZBQOSA-N 0 3 351.451 -1.427 20 0 FAADHN CC(=O)N1CC(=O)NC[C@@]12CCN(C(=O)CCN1CCN(C)CC1)C2 ZINC001143230811 792851090 /nfs/dbraw/zinc/85/10/90/792851090.db2.gz OLMXWKDXLCCIKK-QGZVFWFLSA-N 0 3 351.451 -1.427 20 0 FAADHN C[C@@H]1O[C@@H](OCCNC(=O)CCN2CCN(C)CC2)[C@@H](O)[C@H](O)[C@@H]1O ZINC001143238310 792850680 /nfs/dbraw/zinc/85/06/80/792850680.db2.gz MTABAAVCCVKMTF-BPKBQXTESA-N 0 3 361.439 -2.416 20 0 FAADHN N=c1nc2c(ncn2COCCO)c(N)n1C(=O)C1CCCS1(=O)=O ZINC001143467416 789662972 /nfs/dbraw/zinc/66/29/72/789662972.db2.gz KPJOKWVIPIBWHB-MRVPVSSYSA-N 0 3 370.391 -1.522 20 0 FAADHN N=c1nc2c(ncn2COCCO)c(N)n1C(=O)C1CCCS1(=O)=O ZINC001143467417 789662955 /nfs/dbraw/zinc/66/29/55/789662955.db2.gz KPJOKWVIPIBWHB-QMMMGPOBSA-N 0 3 370.391 -1.522 20 0 FAADHN CN1CCC(N(CCO)C(=O)CCn2cc(S(N)(=O)=O)cn2)CC1 ZINC001143822502 790860821 /nfs/dbraw/zinc/86/08/21/790860821.db2.gz SLWXVNMCCFOYNK-UHFFFAOYSA-N 0 3 359.452 -1.164 20 0 FAADHN CNC(=O)CN1CCCC12CCN(C(=O)[C@@H]1CC(=O)NC(=O)N1)CC2 ZINC001144326155 790867677 /nfs/dbraw/zinc/86/76/77/790867677.db2.gz OHQRMBGEHLCDTP-NSHDSACASA-N 0 3 351.407 -1.213 20 0 FAADHN CC1=NS(=O)(=O)N(C)C=C1C(=O)N1CCN(CCN(C)C)C(=O)C1 ZINC001144757060 790885572 /nfs/dbraw/zinc/88/55/72/790885572.db2.gz SMKGAWJHPMDAQC-UHFFFAOYSA-N 0 3 357.436 -1.246 20 0 FAADHN CN(C)CCN1CC[C@@H]2[C@@H]1CCN2C(=O)C(=O)[C@H](O)[C@H](O)[C@@H](O)CO ZINC001144894358 790899767 /nfs/dbraw/zinc/89/97/67/790899767.db2.gz GFPVFEGNINRYTO-MEBFFEOJSA-N 0 3 359.423 -3.133 20 0 FAADHN CN(C)CCN1CC[C@@H]2[C@@H]1CCN2C(=O)C(=O)[C@H](O)[C@@H](O)[C@H](O)CO ZINC001144894362 790900100 /nfs/dbraw/zinc/90/01/00/790900100.db2.gz GFPVFEGNINRYTO-MQLXINIDSA-N 0 3 359.423 -3.133 20 0 FAADHN CN(C)CCN1CC[C@@H]2[C@@H]1CCN2C(=O)C(=O)[C@H](O)[C@H](O)[C@H](O)CO ZINC001144894364 790899830 /nfs/dbraw/zinc/89/98/30/790899830.db2.gz GFPVFEGNINRYTO-RYMFRWLXSA-N 0 3 359.423 -3.133 20 0 FAADHN CN(C)CCN1CC[C@@H]2[C@@H]1CCN2C(=O)C(=O)[C@H](O)[C@@H](O)[C@@H](O)CO ZINC001144894366 790900251 /nfs/dbraw/zinc/90/02/51/790900251.db2.gz GFPVFEGNINRYTO-ZUWCUPBKSA-N 0 3 359.423 -3.133 20 0 FAADHN O=C(N[C@H]1CCN(CC2CCCCC2)C1)C(=O)[C@H](O)[C@H](O)[C@@H](O)CO ZINC001144904455 790895306 /nfs/dbraw/zinc/89/53/06/790895306.db2.gz PCFVRHXVAVLNEW-BYNSBNAKSA-N 0 3 358.435 -1.599 20 0 FAADHN O=C(N[C@H]1CCN(CC2CCCCC2)C1)C(=O)[C@H](O)[C@H](O)[C@H](O)CO ZINC001144904456 790894967 /nfs/dbraw/zinc/89/49/67/790894967.db2.gz PCFVRHXVAVLNEW-GBJTYRQASA-N 0 3 358.435 -1.599 20 0 FAADHN O=C(N[C@H]1CCN(CC2CCCCC2)C1)C(=O)[C@H](O)[C@@H](O)[C@H](O)CO ZINC001144904457 790895015 /nfs/dbraw/zinc/89/50/15/790895015.db2.gz PCFVRHXVAVLNEW-LJISPDSOSA-N 0 3 358.435 -1.599 20 0 FAADHN O=C(N[C@H]1CCN(CC2CCCCC2)C1)C(=O)[C@H](O)[C@@H](O)[C@@H](O)CO ZINC001144904458 790895074 /nfs/dbraw/zinc/89/50/74/790895074.db2.gz PCFVRHXVAVLNEW-ZQDZILKHSA-N 0 3 358.435 -1.599 20 0 FAADHN CC1(C)[C@H](C(=O)N(c2ncccn2)C2CNC2)N2C(=O)C[C@H]2S1(=O)=O ZINC001146256003 790904123 /nfs/dbraw/zinc/90/41/23/790904123.db2.gz XZRQEDXYLZXLNV-NEPJUHHUSA-N 0 3 365.415 -1.085 20 0 FAADHN NC(=O)c1cc(S(=O)(=O)NCC(=O)N2CC[C@H](N3CCC3)C2)c[nH]1 ZINC001148307135 790911475 /nfs/dbraw/zinc/91/14/75/790911475.db2.gz IZQYSAFMZLQJCL-JTQLQIEISA-N 0 3 355.420 -1.302 20 0 FAADHN NC(=O)c1cc(S(=O)(=O)NCC(=O)N2CC[C@@H](N3CCC3)C2)c[nH]1 ZINC001148307136 790911441 /nfs/dbraw/zinc/91/14/41/790911441.db2.gz IZQYSAFMZLQJCL-SNVBAGLBSA-N 0 3 355.420 -1.302 20 0 FAADHN CN(CCO)CCN(C)C(=O)C1=NN([C@@H]2CCS(=O)(=O)C2)C(=O)CC1 ZINC001149203761 792851682 /nfs/dbraw/zinc/85/16/82/792851682.db2.gz BBMRPFKGEAMBSS-GFCCVEGCSA-N 0 3 374.463 -1.466 20 0 FAADHN CN(CCO)CCN(C)C(=O)C1=NN([C@H]2CCS(=O)(=O)C2)C(=O)CC1 ZINC001149203762 792851849 /nfs/dbraw/zinc/85/18/49/792851849.db2.gz BBMRPFKGEAMBSS-LBPRGKRZSA-N 0 3 374.463 -1.466 20 0 FAADHN C[C@@H]1CN(C)C[C@H](C(=O)NC[C@@H]2CN(CCOCCO)CCCO2)O1 ZINC001149881425 792854368 /nfs/dbraw/zinc/85/43/68/792854368.db2.gz NPIPUBOOBGTFQA-BZUAXINKSA-N 0 3 359.467 -1.079 20 0 FAADHN C[C@@H]1CN(C)C[C@H](C(=O)NC[C@H]2CN(CCOCCO)CCCO2)O1 ZINC001149881426 792854229 /nfs/dbraw/zinc/85/42/29/792854229.db2.gz NPIPUBOOBGTFQA-OWCLPIDISA-N 0 3 359.467 -1.079 20 0 FAADHN CC(C)(O)CN1CC[C@H](NC(=O)c2cn(C[C@@H]3CNC(=O)O3)nn2)C1 ZINC001151104293 792857115 /nfs/dbraw/zinc/85/71/15/792857115.db2.gz RKMLXOAGVQQXOM-QWRGUYRKSA-N 0 3 352.395 -1.039 20 0 FAADHN CC(C)(O)CN1CC[C@H](NC(=O)c2cn(C[C@H]3CNC(=O)O3)nn2)C1 ZINC001151104294 792856756 /nfs/dbraw/zinc/85/67/56/792856756.db2.gz RKMLXOAGVQQXOM-WDEREUQCSA-N 0 3 352.395 -1.039 20 0 FAADHN CCN(CC(=O)NC(=O)NC)[C@H](C)CNC(=O)[C@H]1CN(C)C[C@@H](C)O1 ZINC001153998594 792863662 /nfs/dbraw/zinc/86/36/62/792863662.db2.gz ZDGZQDKPJGFJBE-JHJVBQTASA-N 0 3 357.455 -1.012 20 0 FAADHN CCN(CCN1CCNC1=O)[C@H](C)CNC(=O)[C@H]1CC[C@@H](C(N)=O)O1 ZINC001155222272 792867696 /nfs/dbraw/zinc/86/76/96/792867696.db2.gz YAEIFUKHZQBVLW-FRRDWIJNSA-N 0 3 355.439 -1.129 20 0 FAADHN CN(CCO)CCNC(=O)[C@@H](CC(N)=O)NC(=O)c1ccccc1F ZINC001155251155 792867641 /nfs/dbraw/zinc/86/76/41/792867641.db2.gz IKQBTMPCORREEO-CYBMUJFWSA-N 0 3 354.382 -1.160 20 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COC(=O)[C@H]1CS[C@@H](C(=O)OC)N1C(=O)[C@@H](N)Cc1cncn1C ZINC001160494629 792902584 /nfs/dbraw/zinc/90/25/84/792902584.db2.gz UNUVGYXZDIEHKW-UMNHJUIQSA-N 0 3 356.404 -1.094 20 0 FAADHN COC(=O)[C@@H]1CS[C@H](C(=O)OC)N1C(=O)[C@@H]1COC2(CNC2)CN1 ZINC001160495086 792902298 /nfs/dbraw/zinc/90/22/98/792902298.db2.gz XDEFKOKWGJEHCV-ATZCPNFKSA-N 0 3 359.404 -2.067 20 0 FAADHN COC(=O)[C@@H]1CS[C@@H](C(=O)OC)N1C(=O)[C@@H]1COC2(CNC2)CN1 ZINC001160495093 792901922 /nfs/dbraw/zinc/90/19/22/792901922.db2.gz XDEFKOKWGJEHCV-QXEWZRGKSA-N 0 3 359.404 -2.067 20 0 FAADHN COC(=O)[C@@H]1CS[C@H](C(=O)OC)N1C(=O)[C@H]1COC2(CNC2)CN1 ZINC001160495097 792902553 /nfs/dbraw/zinc/90/25/53/792902553.db2.gz XDEFKOKWGJEHCV-WCABBAIRSA-N 0 3 359.404 -2.067 20 0 FAADHN COC(=O)[C@@H]1CS[C@@H](C(=O)OC)N1C(=O)[C@H]1COC2(CNC2)CN1 ZINC001160495101 792902201 /nfs/dbraw/zinc/90/22/01/792902201.db2.gz XDEFKOKWGJEHCV-YWVKMMECSA-N 0 3 359.404 -2.067 20 0 FAADHN O=C([C@@H]1CCCCN1C(=O)[C@@H]1COC2(CNC2)CN1)N1CCOCC1 ZINC001160506423 792902242 /nfs/dbraw/zinc/90/22/42/792902242.db2.gz NFHFIYAQJVRQQB-KBPBESRZSA-N 0 3 352.435 -1.443 20 0 FAADHN O=C([C@H]1COC2(CNC2)CN1)N1CCCC[C@H]1C(=O)N1CCOCC1 ZINC001160506424 792902528 /nfs/dbraw/zinc/90/25/28/792902528.db2.gz NFHFIYAQJVRQQB-KGLIPLIRSA-N 0 3 352.435 -1.443 20 0 FAADHN O=C([C@H]1CCCCN1C(=O)[C@@H]1COC2(CNC2)CN1)N1CCOCC1 ZINC001160506425 792902477 /nfs/dbraw/zinc/90/24/77/792902477.db2.gz NFHFIYAQJVRQQB-UONOGXRCSA-N 0 3 352.435 -1.443 20 0 FAADHN O=C([C@H]1CCCCN1C(=O)[C@H]1COC2(CNC2)CN1)N1CCOCC1 ZINC001160506426 792902258 /nfs/dbraw/zinc/90/22/58/792902258.db2.gz NFHFIYAQJVRQQB-ZIAGYGMSSA-N 0 3 352.435 -1.443 20 0 FAADHN COC(=O)CN1CCN(C(=O)[C@@H]2COC(C)(C)N2C(=O)[C@H](C)N)CC1 ZINC001160535913 792902504 /nfs/dbraw/zinc/90/25/04/792902504.db2.gz WJZDWLJTRBYPAJ-RYUDHWBXSA-N 0 3 356.423 -1.386 20 0 FAADHN C[C@H](N)C(=O)N[C@@H](CC(N)=O)C(=O)N1CCc2nc(Cl)ncc2C1 ZINC001160576379 792902401 /nfs/dbraw/zinc/90/24/01/792902401.db2.gz UDHMTYPPQFPWLA-XVKPBYJWSA-N 0 3 354.798 -1.278 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/nfs/dbraw/zinc/90/32/47/792903247.db2.gz VHLFZHKKTWLFGX-ZDUSSCGKSA-N 0 3 360.480 -2.104 20 0 FAADHN CS(=O)(=O)CCCN1CCN(C(=O)CN2CCCC[C@H](N)C2=O)CC1 ZINC001160586107 792903218 /nfs/dbraw/zinc/90/32/18/792903218.db2.gz WSIUVODDWFGYQG-AWEZNQCLSA-N 0 3 374.507 -1.095 20 0 FAADHN COCCN(C)CCN1C[C@@H](NC(=O)Cc2nnc(N)s2)CC1=O ZINC001160604791 792903141 /nfs/dbraw/zinc/90/31/41/792903141.db2.gz OCTCSKFOCYBYND-JTQLQIEISA-N 0 3 356.452 -1.042 20 0 FAADHN COCCN(C)CCN1C[C@H](NC(=O)Cc2nnc(N)s2)CC1=O ZINC001160604792 792903308 /nfs/dbraw/zinc/90/33/08/792903308.db2.gz OCTCSKFOCYBYND-SNVBAGLBSA-N 0 3 356.452 -1.042 20 0 FAADHN CC(C)C[C@H](N)C(=O)N[C@@H](C)C(=O)N1CC(N2CCN(C)C(=O)C2)C1 ZINC001160634495 792903268 /nfs/dbraw/zinc/90/32/68/792903268.db2.gz BGIAREXTQRQHBK-JSGCOSHPSA-N 0 3 353.467 -1.151 20 0 FAADHN C[C@H](N)C(=O)N1[C@H](C(=O)N2CC(N3CCNC(=O)C3)C2)COC1(C)C ZINC001160635713 792903202 /nfs/dbraw/zinc/90/32/02/792903202.db2.gz BVOVSCVPDGOVNA-JQWIXIFHSA-N 0 3 353.423 -2.060 20 0 FAADHN 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792905848 /nfs/dbraw/zinc/90/58/48/792905848.db2.gz KFCFYSBZUAKCEL-RZKMHQGSSA-N 0 3 352.313 -1.376 20 0 FAADHN COC(=O)[C@H]1CCS(=O)(=O)C12CN(C(=O)[C@H](N)Cc1cnc[nH]1)C2 ZINC001160772059 792904993 /nfs/dbraw/zinc/90/49/93/792904993.db2.gz MRWZLKSVCAHUKD-GHMZBOCLSA-N 0 3 356.404 -1.532 20 0 FAADHN COC(=O)[C@H]1CCS(=O)(=O)C12CN(C(=O)[C@@H](N)Cc1cnc[nH]1)C2 ZINC001160772060 792905689 /nfs/dbraw/zinc/90/56/89/792905689.db2.gz MRWZLKSVCAHUKD-MNOVXSKESA-N 0 3 356.404 -1.532 20 0 FAADHN COC(=O)[C@@H]1CCS(=O)(=O)C12CN(C(=O)[C@@H](N)Cc1cnc[nH]1)C2 ZINC001160772061 792905222 /nfs/dbraw/zinc/90/52/22/792905222.db2.gz MRWZLKSVCAHUKD-QWRGUYRKSA-N 0 3 356.404 -1.532 20 0 FAADHN COC(=O)[C@@H]1CCS(=O)(=O)C12CN(C(=O)[C@H](N)Cc1cnc[nH]1)C2 ZINC001160772062 792905433 /nfs/dbraw/zinc/90/54/33/792905433.db2.gz MRWZLKSVCAHUKD-WDEREUQCSA-N 0 3 356.404 -1.532 20 0 FAADHN COC(=O)[C@H]1CCS(=O)(=O)C12CN(C(=O)[C@H]1COC3(CNC3)CN1)C2 ZINC001160772185 792905945 /nfs/dbraw/zinc/90/59/45/792905945.db2.gz 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CC(=O)NCC(=O)NCC(=O)N1CC[C@H]2CN([C@@H]3CCNC3=O)C[C@H]21 ZINC001188384008 791961039 /nfs/dbraw/zinc/96/10/39/791961039.db2.gz WTHRHGUAPLQPDG-YNEHKIRRSA-N 0 3 351.407 -2.340 20 0 FAADHN COCCOCCN1C[C@@H]2CCN(C(=O)Cn3ncn(C)c3=O)[C@@H]2C1 ZINC001188387190 791960681 /nfs/dbraw/zinc/96/06/81/791960681.db2.gz BVIMGGFVEHANDP-UONOGXRCSA-N 0 3 353.423 -1.223 20 0 FAADHN CN1CCN(CC(=O)N2CC[C@H]3CN(CCOCCO)C[C@H]32)CC1=O ZINC001188388616 791960658 /nfs/dbraw/zinc/96/06/58/791960658.db2.gz UCSJYYICIITIGT-LSDHHAIUSA-N 0 3 354.451 -1.698 20 0 FAADHN O=C(Cn1ccc(=O)[nH]c1=O)N1CC[C@H]2CN(CCOCCO)C[C@H]21 ZINC001188470275 791962640 /nfs/dbraw/zinc/96/26/40/791962640.db2.gz LINWDFLKNCXOKC-QWHCGFSZSA-N 0 3 352.391 -1.510 20 0 FAADHN Cn1cnn(CCC(=O)N2CC[C@H]3CN(CCOCCO)C[C@H]32)c1=O ZINC001188636164 791963743 /nfs/dbraw/zinc/96/37/43/791963743.db2.gz HZTIHTPBIBJYOB-UONOGXRCSA-N 0 3 353.423 -1.487 20 0 FAADHN CNS(=O)(=O)NCC(=O)N1CC[C@H]2CN(CCc3cnn(C)c3)C[C@H]21 ZINC001188723683 791965140 /nfs/dbraw/zinc/96/51/40/791965140.db2.gz BEUCQBJROBVJKS-UONOGXRCSA-N 0 3 370.479 -1.451 20 0 FAADHN CNS(=O)(=O)NCC(=O)N1CC[C@H]2CN(CCOCCO)C[C@H]21 ZINC001188723983 791965850 /nfs/dbraw/zinc/96/58/50/791965850.db2.gz LFQKAAUBMZHFTC-NWDGAFQWSA-N 0 3 350.441 -2.418 20 0 FAADHN CNS(=O)(=O)NCC(=O)N1CC[C@H]2CN(CCc3ccnn3C)C[C@H]21 ZINC001188724238 791965944 /nfs/dbraw/zinc/96/59/44/791965944.db2.gz PJZADIROCQUSKS-GXTWGEPZSA-N 0 3 370.479 -1.451 20 0 FAADHN CNS(=O)(=O)NCC(=O)N1CC[C@H]2CN(CCOCCOC)C[C@H]21 ZINC001188724620 791966516 /nfs/dbraw/zinc/96/65/16/791966516.db2.gz YCSWEJMDDRFGCD-QWHCGFSZSA-N 0 3 364.468 -1.764 20 0 FAADHN CNS(=O)(=O)NCC(=O)N1CC[C@H]2CN([C@@H]3CCN(C)C3=O)C[C@H]21 ZINC001188730716 791966021 /nfs/dbraw/zinc/96/60/21/791966021.db2.gz CEYWNJQDHNMXTM-QJPTWQEYSA-N 0 3 359.452 -2.196 20 0 FAADHN CNS(=O)(=O)NCC(=O)N1CC[C@H]2CN([C@H]3CCN(C)C3=O)C[C@H]21 ZINC001188730726 791966209 /nfs/dbraw/zinc/96/62/09/791966209.db2.gz CEYWNJQDHNMXTM-SDDRHHMPSA-N 0 3 359.452 -2.196 20 0 FAADHN CNS(=O)(=O)NCC(=O)N1CC[C@H]2CN(CCOCC3CC3)C[C@H]21 ZINC001188730799 791966154 /nfs/dbraw/zinc/96/61/54/791966154.db2.gz DVBSXUFLGLRLQO-UONOGXRCSA-N 0 3 360.480 -1.001 20 0 FAADHN CNS(=O)(=O)NCC(=O)N1CC[C@H]2CN(CCn3cncn3)C[C@H]21 ZINC001188731322 791965746 /nfs/dbraw/zinc/96/57/46/791965746.db2.gz JZUMKNQLKSHIQH-NWDGAFQWSA-N 0 3 357.440 -2.135 20 0 FAADHN CNS(=O)(=O)NCC(=O)N1CC[C@H]2CN(CCn3cccn3)C[C@H]21 ZINC001188732112 791966237 /nfs/dbraw/zinc/96/62/37/791966237.db2.gz UZUCWTQTQVRGBV-QWHCGFSZSA-N 0 3 356.452 -1.530 20 0 FAADHN Cn1c(=O)[nH]cc(C(=O)N2CC[C@H]3CN(CCOCCO)C[C@H]32)c1=O ZINC001188744045 791967253 /nfs/dbraw/zinc/96/72/53/791967253.db2.gz KCMSGOUPBAEGMN-WCQYABFASA-N 0 3 352.391 -1.359 20 0 FAADHN CC(=O)NCCOCCN1C[C@@H]2CCN(C(=O)[C@@H]3CCNC3=O)[C@@H]2C1 ZINC001188760189 791967041 /nfs/dbraw/zinc/96/70/41/791967041.db2.gz UNBKUUPREKWVPP-RRFJBIMHSA-N 0 3 352.435 -1.192 20 0 FAADHN CC(=O)NCCOCCN1C[C@@H]2CCN(C(=O)[C@H]3CCNC3=O)[C@@H]2C1 ZINC001188760190 791967188 /nfs/dbraw/zinc/96/71/88/791967188.db2.gz UNBKUUPREKWVPP-SOUVJXGZSA-N 0 3 352.435 -1.192 20 0 FAADHN COCCOCCN1C[C@@H]2CCN(C(=O)CN3CCNC(=O)C3)[C@@H]2C1 ZINC001188760331 791967443 /nfs/dbraw/zinc/96/74/43/791967443.db2.gz XTCHTSFNCCQUSN-LSDHHAIUSA-N 0 3 354.451 -1.386 20 0 FAADHN COCCOC[C@@H](O)CN1C[C@@H]2CCN(C(=O)c3nnn(C)n3)[C@@H]2C1 ZINC001188812728 791968683 /nfs/dbraw/zinc/96/86/83/791968683.db2.gz HNIZYXNLMZKVNU-RWMBFGLXSA-N 0 3 354.411 -1.620 20 0 FAADHN COCCOC[C@H](O)CN1C[C@@H]2CCN(C(=O)c3nnn(C)n3)[C@@H]2C1 ZINC001188812729 791968828 /nfs/dbraw/zinc/96/88/28/791968828.db2.gz HNIZYXNLMZKVNU-YNEHKIRRSA-N 0 3 354.411 -1.620 20 0 FAADHN CC(=O)NCCOCCN1C[C@@H]2CCN(C(=O)[C@H]3CNC(=O)N3)[C@@H]2C1 ZINC001188979244 791971073 /nfs/dbraw/zinc/97/10/73/791971073.db2.gz MVMMDOZOWRGACD-BFHYXJOUSA-N 0 3 353.423 -1.647 20 0 FAADHN CC(=O)NCCOCCN1C[C@@H]2CCN(C(=O)[C@@H]3CNC(=O)N3)[C@@H]2C1 ZINC001188979245 791971481 /nfs/dbraw/zinc/97/14/81/791971481.db2.gz MVMMDOZOWRGACD-MELADBBJSA-N 0 3 353.423 -1.647 20 0 FAADHN NS(=O)(=O)CCCC(=O)N1CC[C@H]2CN(CCn3cncn3)C[C@H]21 ZINC001188991874 791969890 /nfs/dbraw/zinc/96/98/90/791969890.db2.gz KFWYKZZURZISIQ-QWHCGFSZSA-N 0 3 356.452 -1.121 20 0 FAADHN CN1CC[C@H](N2C[C@@H]3CCN(C(=O)CCCS(N)(=O)=O)[C@@H]3C2)C1=O ZINC001188992806 791969599 /nfs/dbraw/zinc/96/95/99/791969599.db2.gz ZUJCWUBYPJMUQH-RWMBFGLXSA-N 0 3 358.464 -1.182 20 0 FAADHN CN1CC[C@@H](N2C[C@@H]3CCN(C(=O)CCCS(N)(=O)=O)[C@@H]3C2)C1=O ZINC001188992809 791969872 /nfs/dbraw/zinc/96/98/72/791969872.db2.gz ZUJCWUBYPJMUQH-YNEHKIRRSA-N 0 3 358.464 -1.182 20 0 FAADHN CNC(=O)NC(=O)CN1C[C@@H]2CCN(C(=O)C3=NC(=O)N(C)C3)[C@@H]2C1 ZINC001189012595 791970627 /nfs/dbraw/zinc/97/06/27/791970627.db2.gz QJYASLVMFXLZOW-GXSJLCMTSA-N 0 3 350.379 -1.272 20 0 FAADHN CN(C)S(=O)(=O)CCCN1C[C@@H]2CCN(C(=O)[C@H]3C[C@H]3C(N)=O)[C@@H]2C1 ZINC001189134731 791972994 /nfs/dbraw/zinc/97/29/94/791972994.db2.gz DQLCYFSTSISWFM-RFQIPJPRSA-N 0 3 372.491 -1.078 20 0 FAADHN CC(=O)NCCOCCN1C[C@@H]2CCN(C(=O)[C@H]3C[C@H]3C(N)=O)[C@@H]2C1 ZINC001189135913 791973014 /nfs/dbraw/zinc/97/30/14/791973014.db2.gz RYYULAZFYDSGEO-LJISPDSOSA-N 0 3 352.435 -1.207 20 0 FAADHN N[C@@H]1NCN(C(=O)c2n[nH]cc2I)[C@H]2NCN[C@@H]21 ZINC001189145371 791973217 /nfs/dbraw/zinc/97/32/17/791973217.db2.gz SEUUMPIBOIIQBD-BWZBUEFSSA-N 0 3 363.163 -1.853 20 0 FAADHN N[C@@H]1NCN(C(=O)c2n[nH]cc2I)[C@@H]2NCN[C@@H]21 ZINC001189145372 791972957 /nfs/dbraw/zinc/97/29/57/791972957.db2.gz SEUUMPIBOIIQBD-PRJMDXOYSA-N 0 3 363.163 -1.853 20 0 FAADHN N[C@@H]1NCN(C(=O)c2n[nH]cc2I)[C@@H]2NCN[C@H]21 ZINC001189145373 791973295 /nfs/dbraw/zinc/97/32/95/791973295.db2.gz SEUUMPIBOIIQBD-RNJXMRFFSA-N 0 3 363.163 -1.853 20 0 FAADHN N[C@@H]1NCN(C(=O)c2n[nH]cc2I)[C@H]2NCN[C@H]21 ZINC001189145374 791973244 /nfs/dbraw/zinc/97/32/44/791973244.db2.gz SEUUMPIBOIIQBD-XLPZGREQSA-N 0 3 363.163 -1.853 20 0 FAADHN C[C@@H](NS(C)(=O)=O)C(=O)N1CC[C@H]2CN(CCn3cncn3)C[C@H]21 ZINC001189246795 791975313 /nfs/dbraw/zinc/97/53/13/791975313.db2.gz TXTROIWYMKKTGO-FRRDWIJNSA-N 0 3 356.452 -1.252 20 0 FAADHN C[C@H](NS(C)(=O)=O)C(=O)N1CC[C@H]2CN(CCn3cncn3)C[C@H]21 ZINC001189246800 791974835 /nfs/dbraw/zinc/97/48/35/791974835.db2.gz TXTROIWYMKKTGO-RWMBFGLXSA-N 0 3 356.452 -1.252 20 0 FAADHN COCCOCCN1C[C@@H]2CCN(C(=O)[C@@H]3CC(=O)NC(=O)N3)[C@@H]2C1 ZINC001189253355 791975162 /nfs/dbraw/zinc/97/51/62/791975162.db2.gz NUNXEGHMNVGHCF-RWMBFGLXSA-N 0 3 354.407 -1.220 20 0 FAADHN CN(C)S(=O)(=O)NCC(=O)N1CC[C@H]2CN(CCn3cccn3)C[C@H]21 ZINC001189275344 791974908 /nfs/dbraw/zinc/97/49/08/791974908.db2.gz AFYLESWVVJPAPH-UONOGXRCSA-N 0 3 370.479 -1.188 20 0 FAADHN CN(C)S(=O)(=O)NCC(=O)N1CC[C@H]2CN(CCOCCO)C[C@H]21 ZINC001189276022 791975620 /nfs/dbraw/zinc/97/56/20/791975620.db2.gz DXJICGRDIPCLFH-QWHCGFSZSA-N 0 3 364.468 -2.076 20 0 FAADHN CN(C)S(=O)(=O)NCC(=O)N1CC[C@H]2CN([C@@H]3CCNC3=O)C[C@H]21 ZINC001189276821 791975523 /nfs/dbraw/zinc/97/55/23/791975523.db2.gz KIEXCMAHEWAJMN-QJPTWQEYSA-N 0 3 359.452 -2.196 20 0 FAADHN CN(C)S(=O)(=O)NCC(=O)N1CC[C@H]2CN([C@H]3CCNC3=O)C[C@H]21 ZINC001189276822 791975048 /nfs/dbraw/zinc/97/50/48/791975048.db2.gz KIEXCMAHEWAJMN-SDDRHHMPSA-N 0 3 359.452 -2.196 20 0 FAADHN CN(C)S(=O)(=O)NCC(=O)N1CC[C@H]2CN(CCn3cncn3)C[C@H]21 ZINC001189276980 791975703 /nfs/dbraw/zinc/97/57/03/791975703.db2.gz MVSREVUFOFBTEP-QWHCGFSZSA-N 0 3 371.467 -1.793 20 0 FAADHN CCOCCN1C[C@@H]2CCN(C(=O)CN3C(=O)C(=O)N(C)C3=O)[C@@H]2C1 ZINC001189304560 791976618 /nfs/dbraw/zinc/97/66/18/791976618.db2.gz ZQBQMRCZHQFCMP-NWDGAFQWSA-N 0 3 352.391 -1.024 20 0 FAADHN CC(=O)N[C@@H](CC(=O)N1CC[C@H]2CN(CCOCCO)C[C@H]21)C(N)=O ZINC001189324652 791976502 /nfs/dbraw/zinc/97/65/02/791976502.db2.gz MQTNCMCQNCMPBN-MELADBBJSA-N 0 3 356.423 -2.092 20 0 FAADHN COCCOC[C@H](O)CN1C[C@@H]2CCN(C(=O)c3cnn(C)n3)[C@@H]2C1 ZINC001189414106 791977904 /nfs/dbraw/zinc/97/79/04/791977904.db2.gz KPJXUKLCMSNQNP-GZBFAFLISA-N 0 3 353.423 -1.015 20 0 FAADHN COCCOC[C@@H](O)CN1C[C@@H]2CCN(C(=O)c3cnn(C)n3)[C@@H]2C1 ZINC001189414107 791977813 /nfs/dbraw/zinc/97/78/13/791977813.db2.gz KPJXUKLCMSNQNP-KCQAQPDRSA-N 0 3 353.423 -1.015 20 0 FAADHN COCCOCCN1C[C@@H]2CCN(C(=O)CN3CC(=O)NC3=O)[C@@H]2C1 ZINC001189444720 791979533 /nfs/dbraw/zinc/97/95/33/791979533.db2.gz LEMXJAGQBRCPPQ-QWHCGFSZSA-N 0 3 354.407 -1.266 20 0 FAADHN CCS(=O)(=O)N(C)CC(=O)N1CC[C@H]2CN(CCOCCO)C[C@H]21 ZINC001189604913 791979769 /nfs/dbraw/zinc/97/97/69/791979769.db2.gz HMDYGHGTOSVHPP-UONOGXRCSA-N 0 3 363.480 -1.191 20 0 FAADHN Cn1ncnc1COCC(=O)N1CC[C@H]2CN(CCOCCO)C[C@H]21 ZINC001189612094 791980961 /nfs/dbraw/zinc/98/09/61/791980961.db2.gz DBCDLTXSSNXKEC-UONOGXRCSA-N 0 3 353.423 -1.127 20 0 FAADHN COC[C@H](O)CN1C[C@@H]2CCN(C(=O)COCc3nncn3C)[C@@H]2C1 ZINC001189612111 791981348 /nfs/dbraw/zinc/98/13/48/791981348.db2.gz DXJWNBCCOSDMOZ-BFHYXJOUSA-N 0 3 353.423 -1.128 20 0 FAADHN COC[C@@H](O)CN1C[C@@H]2CCN(C(=O)COCc3nncn3C)[C@@H]2C1 ZINC001189612112 791981173 /nfs/dbraw/zinc/98/11/73/791981173.db2.gz DXJWNBCCOSDMOZ-MELADBBJSA-N 0 3 353.423 -1.128 20 0 FAADHN COC[C@H](O)CN1C[C@@H]2CCN(C(=O)COCc3ncnn3C)[C@@H]2C1 ZINC001189612214 791980873 /nfs/dbraw/zinc/98/08/73/791980873.db2.gz KLTBRSHVSARWNN-BFHYXJOUSA-N 0 3 353.423 -1.128 20 0 FAADHN COC[C@@H](O)CN1C[C@@H]2CCN(C(=O)COCc3ncnn3C)[C@@H]2C1 ZINC001189612215 791980739 /nfs/dbraw/zinc/98/07/39/791980739.db2.gz KLTBRSHVSARWNN-MELADBBJSA-N 0 3 353.423 -1.128 20 0 FAADHN Cn1cnnc1COCC(=O)N1CC[C@H]2CN(CCOCCO)C[C@H]21 ZINC001189612360 791981038 /nfs/dbraw/zinc/98/10/38/791981038.db2.gz RYRSZVSEPVVNGW-UONOGXRCSA-N 0 3 353.423 -1.127 20 0 FAADHN CCS(=O)(=O)N(C)CC(=O)N1CC[C@H]2CN([C@H]3CCNC3=O)C[C@H]21 ZINC001189628589 791980914 /nfs/dbraw/zinc/98/09/14/791980914.db2.gz LXNFKNALHRDFMF-RWMBFGLXSA-N 0 3 358.464 -1.311 20 0 FAADHN CCS(=O)(=O)N(C)CC(=O)N1CC[C@H]2CN([C@@H]3CCNC3=O)C[C@H]21 ZINC001189628592 791980660 /nfs/dbraw/zinc/98/06/60/791980660.db2.gz LXNFKNALHRDFMF-YNEHKIRRSA-N 0 3 358.464 -1.311 20 0 FAADHN O=C(CN1CCC(=O)NC1=O)N1CC[C@H]2CN(CCOCCO)C[C@H]21 ZINC001189660083 791982101 /nfs/dbraw/zinc/98/21/01/791982101.db2.gz NYTHDRYQSWLTCG-QWHCGFSZSA-N 0 3 354.407 -1.530 20 0 FAADHN COCCN1C[C@@H]2CCN(C(=O)[C@H](C)NC(=O)Cn3cnnn3)[C@@H]2C1 ZINC001189714860 791982293 /nfs/dbraw/zinc/98/22/93/791982293.db2.gz YLHYHCJYHBFLHN-RWMBFGLXSA-N 0 3 351.411 -1.643 20 0 FAADHN CCS(=O)(=O)NCCN1C[C@@H]2CCN(C(=O)Cc3ncn[nH]3)[C@@H]2C1 ZINC001189741647 791982543 /nfs/dbraw/zinc/98/25/43/791982543.db2.gz JMVCKTKUOKBUDG-NWDGAFQWSA-N 0 3 356.452 -1.181 20 0 FAADHN COCCN1C[C@@H]2CCN(C(=O)[C@@H](C)NC(=O)Cn3cnnn3)[C@@H]2C1 ZINC001189749882 791982160 /nfs/dbraw/zinc/98/21/60/791982160.db2.gz YLHYHCJYHBFLHN-FRRDWIJNSA-N 0 3 351.411 -1.643 20 0 FAADHN CN1C(=O)CN(CC(=O)N2CC[C@H]3CN(CCOCCO)C[C@H]32)C1=O ZINC001189771642 791983759 /nfs/dbraw/zinc/98/37/59/791983759.db2.gz PRADUVGBNCNVBG-QWHCGFSZSA-N 0 3 354.407 -1.578 20 0 FAADHN CC(=O)NCCOCCN1C[C@@H]2CCN(C(=O)[C@@H]3CCC(=O)N3)[C@@H]2C1 ZINC001189856552 791983244 /nfs/dbraw/zinc/98/32/44/791983244.db2.gz BAMSWXONWNVUEE-SOUVJXGZSA-N 0 3 352.435 -1.050 20 0 FAADHN CC(=O)N1CCO[C@@H](C(=O)N2CC[C@H]3CN(CCOCCO)C[C@H]32)C1 ZINC001189985416 791985167 /nfs/dbraw/zinc/98/51/67/791985167.db2.gz CIXBJAYVPOEOQD-ARFHVFGLSA-N 0 3 355.435 -1.225 20 0 FAADHN CC(=O)N1CCO[C@H](C(=O)N2CC[C@H]3CN(CCOCCO)C[C@H]32)C1 ZINC001189985417 791985212 /nfs/dbraw/zinc/98/52/12/791985212.db2.gz CIXBJAYVPOEOQD-XHSDSOJGSA-N 0 3 355.435 -1.225 20 0 FAADHN CN(C)S(=O)(=O)CC(=O)N1CC[C@H]2CN([C@H]3CCCNC3=O)C[C@H]21 ZINC001189991948 791984846 /nfs/dbraw/zinc/98/48/46/791984846.db2.gz AKFPTULRMUVOSC-RWMBFGLXSA-N 0 3 358.464 -1.311 20 0 FAADHN CN(C)S(=O)(=O)CC(=O)N1CC[C@H]2CN([C@@H]3CCCNC3=O)C[C@H]21 ZINC001189991949 791984780 /nfs/dbraw/zinc/98/47/80/791984780.db2.gz AKFPTULRMUVOSC-YNEHKIRRSA-N 0 3 358.464 -1.311 20 0 FAADHN Cc1nn(CC(=O)N2CC[C@H]3CN(CCOCCO)C[C@H]32)c(=O)n1C ZINC001189999379 791986110 /nfs/dbraw/zinc/98/61/10/791986110.db2.gz RJMLKKOMYGFUBI-UONOGXRCSA-N 0 3 353.423 -1.568 20 0 FAADHN COCCOC[C@H](O)CN1C[C@@H]2CCN(C(=O)Cn3cncn3)[C@@H]2C1 ZINC001190066464 791985829 /nfs/dbraw/zinc/98/58/29/791985829.db2.gz SHWBWWXTVRJASY-RRFJBIMHSA-N 0 3 353.423 -1.165 20 0 FAADHN COCCOC[C@@H](O)CN1C[C@@H]2CCN(C(=O)Cn3cncn3)[C@@H]2C1 ZINC001190066473 791986342 /nfs/dbraw/zinc/98/63/42/791986342.db2.gz SHWBWWXTVRJASY-SOUVJXGZSA-N 0 3 353.423 -1.165 20 0 FAADHN COCCOCCN1C[C@@H]2CCN(C(=O)CN3C(=O)CNC3=O)[C@@H]2C1 ZINC001190066568 791986262 /nfs/dbraw/zinc/98/62/62/791986262.db2.gz UVBLWMBRJXCVDZ-QWHCGFSZSA-N 0 3 354.407 -1.266 20 0 FAADHN CN1CC(=O)N(CC(=O)N2CC[C@H]3CN(CCOCCO)C[C@H]32)C1=O ZINC001190071985 791987453 /nfs/dbraw/zinc/98/74/53/791987453.db2.gz DCWAXBXFNPCYTC-QWHCGFSZSA-N 0 3 354.407 -1.578 20 0 FAADHN O=C(CC[C@@H]1NC(=O)NC1=O)N1CC[C@H]2CN(CCOCCO)C[C@H]21 ZINC001190082969 791987101 /nfs/dbraw/zinc/98/71/01/791987101.db2.gz YYQASLDEWSEZEX-RWMBFGLXSA-N 0 3 354.407 -1.484 20 0 FAADHN O=C(CC[C@H]1NC(=O)NC1=O)N1CC[C@H]2CN(CCOCCO)C[C@H]21 ZINC001190082970 791986734 /nfs/dbraw/zinc/98/67/34/791986734.db2.gz YYQASLDEWSEZEX-YNEHKIRRSA-N 0 3 354.407 -1.484 20 0 FAADHN CC(=O)NCCOCCN1C[C@@H]2CCN(C(=O)CCNC(N)=O)[C@@H]2C1 ZINC001190101336 791986831 /nfs/dbraw/zinc/98/68/31/791986831.db2.gz XUUSTCNWQDYZNP-UONOGXRCSA-N 0 3 355.439 -1.270 20 0 FAADHN Cn1cc(C(=O)N2CC[C@H]3CN(CCOCCO)C[C@H]32)c(=O)[nH]c1=O ZINC001190140781 791987021 /nfs/dbraw/zinc/98/70/21/791987021.db2.gz YPDNHHMSNNMKFJ-WCQYABFASA-N 0 3 352.391 -1.359 20 0 FAADHN COCCOCCN1C[C@@H]2CCN(C(=O)[C@H]3CCS(=O)(=O)N3)[C@@H]2C1 ZINC001190193996 791988293 /nfs/dbraw/zinc/98/82/93/791988293.db2.gz KUWNOCVQVLKCAH-BFHYXJOUSA-N 0 3 361.464 -1.126 20 0 FAADHN COCCOCCN1C[C@@H]2CCN(C(=O)[C@@H]3CCS(=O)(=O)N3)[C@@H]2C1 ZINC001190193997 791988632 /nfs/dbraw/zinc/98/86/32/791988632.db2.gz KUWNOCVQVLKCAH-MELADBBJSA-N 0 3 361.464 -1.126 20 0 FAADHN CNS(=O)(=O)CC(=O)N1CC[C@H]2CN(C[C@@H]3CCc4ncnn43)C[C@H]21 ZINC001190227078 791990056 /nfs/dbraw/zinc/99/00/56/791990056.db2.gz GIZRIETUSOMOHH-RWMBFGLXSA-N 0 3 368.463 -1.153 20 0 FAADHN CNS(=O)(=O)CC(=O)N1CC[C@H]2CN(C[C@H]3CCc4ncnn43)C[C@H]21 ZINC001190227079 791989970 /nfs/dbraw/zinc/98/99/70/791989970.db2.gz GIZRIETUSOMOHH-YNEHKIRRSA-N 0 3 368.463 -1.153 20 0 FAADHN CNS(=O)(=O)CC(=O)N1CC[C@H]2CN([C@H]3CCCN(C)C3=O)C[C@H]21 ZINC001190227933 791990011 /nfs/dbraw/zinc/99/00/11/791990011.db2.gz VJIVKTLEBCIPOH-RWMBFGLXSA-N 0 3 358.464 -1.311 20 0 FAADHN CNS(=O)(=O)CC(=O)N1CC[C@H]2CN([C@@H]3CCCN(C)C3=O)C[C@H]21 ZINC001190227934 791989850 /nfs/dbraw/zinc/98/98/50/791989850.db2.gz VJIVKTLEBCIPOH-YNEHKIRRSA-N 0 3 358.464 -1.311 20 0 FAADHN CNS(=O)(=O)CC(=O)N1CC[C@H]2CN(C[C@@H](O)Cn3cccn3)C[C@H]21 ZINC001190247370 791990804 /nfs/dbraw/zinc/99/08/04/791990804.db2.gz HDHXKDMPIWBLQZ-BFHYXJOUSA-N 0 3 371.463 -1.674 20 0 FAADHN CNS(=O)(=O)CC(=O)N1CC[C@H]2CN(C[C@H](O)Cn3cccn3)C[C@H]21 ZINC001190247371 791990740 /nfs/dbraw/zinc/99/07/40/791990740.db2.gz HDHXKDMPIWBLQZ-MELADBBJSA-N 0 3 371.463 -1.674 20 0 FAADHN CN(C)S(=O)(=O)CCC(=O)N1CC[C@H]2CN(CCOCCO)C[C@H]21 ZINC001190312031 791992337 /nfs/dbraw/zinc/99/23/37/791992337.db2.gz MGVSBODHCPPJQU-UONOGXRCSA-N 0 3 363.480 -1.191 20 0 FAADHN CN(C)S(=O)(=O)CCC(=O)N1CC[C@H]2CN([C@H]3CCNC3=O)C[C@H]21 ZINC001190312380 791992205 /nfs/dbraw/zinc/99/22/05/791992205.db2.gz WJMRBELLSJTAEJ-RWMBFGLXSA-N 0 3 358.464 -1.311 20 0 FAADHN CN(C)S(=O)(=O)CCC(=O)N1CC[C@H]2CN([C@@H]3CCNC3=O)C[C@H]21 ZINC001190312503 791992375 /nfs/dbraw/zinc/99/23/75/791992375.db2.gz WJMRBELLSJTAEJ-YNEHKIRRSA-N 0 3 358.464 -1.311 20 0 FAADHN CCOCCN1C[C@@H]2CCN(C(=O)CNC(=O)Cn3cncn3)[C@@H]2C1 ZINC001190341315 791992276 /nfs/dbraw/zinc/99/22/76/791992276.db2.gz KLBPXPSUJRZWRN-UONOGXRCSA-N 0 3 350.423 -1.037 20 0 FAADHN COC[C@H](O)CN1C[C@@H]2CCN(C(=O)c3cn(CC(N)=O)nn3)[C@@H]2C1 ZINC001190341459 791992092 /nfs/dbraw/zinc/99/20/92/791992092.db2.gz MPEWKUDERLXYOG-DMDPSCGWSA-N 0 3 352.395 -2.083 20 0 FAADHN COC[C@@H](O)CN1C[C@@H]2CCN(C(=O)c3cn(CC(N)=O)nn3)[C@@H]2C1 ZINC001190341463 791991806 /nfs/dbraw/zinc/99/18/06/791991806.db2.gz MPEWKUDERLXYOG-GMXVVIOVSA-N 0 3 352.395 -2.083 20 0 FAADHN O=C(CCn1cncn1)N[C@@H]1CN(C[C@@H]2CCNC(=O)CC2)C[C@H]1O ZINC001191120068 792013080 /nfs/dbraw/zinc/01/30/80/792013080.db2.gz CIXFWMMVXXQWDZ-BFHYXJOUSA-N 0 3 350.423 -1.254 20 0 FAADHN O=C(CCn1cncn1)N[C@@H]1CN(C[C@H]2CCNC(=O)CC2)C[C@H]1O ZINC001191120069 792013944 /nfs/dbraw/zinc/01/39/44/792013944.db2.gz CIXFWMMVXXQWDZ-MGPQQGTHSA-N 0 3 350.423 -1.254 20 0 FAADHN O=C(CNC(=O)C1CC1)N[C@@H]1CN(C[C@@H]2CCNC(=O)CC2)C[C@H]1O ZINC001191315236 792023369 /nfs/dbraw/zinc/02/33/69/792023369.db2.gz ZJDOHQWERAWQBA-IACUBPJLSA-N 0 3 352.435 -1.410 20 0 FAADHN O=C(CNC(=O)C1CC1)N[C@@H]1CN(C[C@H]2CCNC(=O)CC2)C[C@H]1O ZINC001191315237 792023335 /nfs/dbraw/zinc/02/33/35/792023335.db2.gz ZJDOHQWERAWQBA-MRVWCRGKSA-N 0 3 352.435 -1.410 20 0 FAADHN COC(=O)NCC(=O)N[C@@H]1CN(CCCCCn2cncn2)C[C@H]1O ZINC001191392837 792026216 /nfs/dbraw/zinc/02/62/16/792026216.db2.gz MTBGJAVXLJJXIY-CHWSQXEVSA-N 0 3 354.411 -1.034 20 0 FAADHN CCCC(=O)NCC(=O)N[C@@H]1CN(C[C@@H]2CCNC(=O)CC2)C[C@H]1O ZINC001191456037 792031164 /nfs/dbraw/zinc/03/11/64/792031164.db2.gz DWINLBBBOCKBAQ-BFHYXJOUSA-N 0 3 354.451 -1.020 20 0 FAADHN CCCC(=O)NCC(=O)N[C@@H]1CN(C[C@H]2CCNC(=O)CC2)C[C@H]1O ZINC001191456039 792030624 /nfs/dbraw/zinc/03/06/24/792030624.db2.gz DWINLBBBOCKBAQ-MGPQQGTHSA-N 0 3 354.451 -1.020 20 0 FAADHN O=C(N[C@@H]1CN(CCCCCn2cncn2)C[C@H]1O)[C@H]1CCC(=O)N1 ZINC001191745269 792039483 /nfs/dbraw/zinc/03/94/83/792039483.db2.gz RVTAPOFSEDRUMR-MGPQQGTHSA-N 0 3 350.423 -1.112 20 0 FAADHN CCNC(=O)CCC(=O)N[C@@H]1CN(C[C@@H]2CCNC(=O)CC2)C[C@H]1O ZINC001191784644 792040717 /nfs/dbraw/zinc/04/07/17/792040717.db2.gz HMYJFOQQYAWJBS-BFHYXJOUSA-N 0 3 354.451 -1.020 20 0 FAADHN CCNC(=O)CCC(=O)N[C@@H]1CN(C[C@H]2CCNC(=O)CC2)C[C@H]1O ZINC001191784645 792040037 /nfs/dbraw/zinc/04/00/37/792040037.db2.gz HMYJFOQQYAWJBS-MGPQQGTHSA-N 0 3 354.451 -1.020 20 0 FAADHN Cc1n[nH]c(C(=O)N[C@@H]2CN(CCN(C)S(C)(=O)=O)C[C@H]2O)c1C ZINC001191935546 792047213 /nfs/dbraw/zinc/04/72/13/792047213.db2.gz DJZDUFWKCPOQHI-VXGBXAGGSA-N 0 3 359.452 -1.307 20 0 FAADHN COCCOC[C@H](O)CN1C[C@@H](O)[C@H](NC(=O)CCc2nnc[nH]2)C1 ZINC001192103371 792056662 /nfs/dbraw/zinc/05/66/62/792056662.db2.gz OCCCWTKJGSRJQN-JHJVBQTASA-N 0 3 357.411 -2.078 20 0 FAADHN COCCOC[C@@H](O)CN1C[C@@H](O)[C@H](NC(=O)CCc2nnc[nH]2)C1 ZINC001192103372 792056992 /nfs/dbraw/zinc/05/69/92/792056992.db2.gz OCCCWTKJGSRJQN-YNEHKIRRSA-N 0 3 357.411 -2.078 20 0 FAADHN CC(=O)NCCOCCN1C[C@@H](O)[C@H](NC(=O)CCc2nc[nH]n2)C1 ZINC001192103868 792058063 /nfs/dbraw/zinc/05/80/63/792058063.db2.gz UQXYYOULIDCVED-CHWSQXEVSA-N 0 3 354.411 -1.949 20 0 FAADHN CC(=O)NCCOCCN1C[C@@H](O)[C@H](NC(=O)CCc2nnc[nH]2)C1 ZINC001192103868 792058054 /nfs/dbraw/zinc/05/80/54/792058054.db2.gz UQXYYOULIDCVED-CHWSQXEVSA-N 0 3 354.411 -1.949 20 0 FAADHN O=C(CCc1nnc[nH]1)N[C@@H]1CN(CCCN2CCCC2=O)C[C@H]1O ZINC001192109509 792056942 /nfs/dbraw/zinc/05/69/42/792056942.db2.gz HPLGRDHPQDJEFM-CHWSQXEVSA-N 0 3 350.423 -1.089 20 0 FAADHN CC(C)COC[C@@H](O)CN1C[C@@H](O)[C@H](NC(=O)CCc2nnc[nH]2)C1 ZINC001192109588 792057470 /nfs/dbraw/zinc/05/74/70/792057470.db2.gz KFDKRAGYZNXFMI-BFHYXJOUSA-N 0 3 355.439 -1.068 20 0 FAADHN CC(C)COC[C@H](O)CN1C[C@@H](O)[C@H](NC(=O)CCc2nnc[nH]2)C1 ZINC001192109589 792057575 /nfs/dbraw/zinc/05/75/75/792057575.db2.gz KFDKRAGYZNXFMI-MGPQQGTHSA-N 0 3 355.439 -1.068 20 0 FAADHN CN(C)S(=O)(=O)CCCN(C)[C@@H]1CCN(C(=O)[C@H]2C[C@H]2C(N)=O)C1 ZINC001192377120 792070547 /nfs/dbraw/zinc/07/05/47/792070547.db2.gz IGDGNLPQADZWNX-UPJWGTAASA-N 0 3 360.480 -1.078 20 0 FAADHN CN(C)S(=O)(=O)CCCN(C)[C@H]1CCN(C(=O)[C@H]2C[C@H]2C(N)=O)C1 ZINC001192377121 792070570 /nfs/dbraw/zinc/07/05/70/792070570.db2.gz IGDGNLPQADZWNX-XQQFMLRXSA-N 0 3 360.480 -1.078 20 0 FAADHN CNC(=O)CCCC(=O)N[C@@H]1CN(C[C@@H]2CCNC(=O)CC2)C[C@H]1O ZINC001192414322 792072671 /nfs/dbraw/zinc/07/26/71/792072671.db2.gz ZZDLOKXZLNVCJO-BFHYXJOUSA-N 0 3 354.451 -1.020 20 0 FAADHN CNC(=O)CCCC(=O)N[C@@H]1CN(C[C@H]2CCNC(=O)CC2)C[C@H]1O ZINC001192414323 792072706 /nfs/dbraw/zinc/07/27/06/792072706.db2.gz ZZDLOKXZLNVCJO-MGPQQGTHSA-N 0 3 354.451 -1.020 20 0 FAADHN C[C@H](NC(N)=O)C(=O)N[C@@H]1CN(CCCCCn2cncn2)C[C@H]1O ZINC001192445072 792081357 /nfs/dbraw/zinc/08/13/57/792081357.db2.gz RJMPIEKJGQPJJJ-YNEHKIRRSA-N 0 3 353.427 -1.334 20 0 FAADHN O=C(CCn1ccnn1)N[C@@H]1CN(C[C@@H]2CCNC(=O)CC2)C[C@H]1O ZINC001192546939 792084887 /nfs/dbraw/zinc/08/48/87/792084887.db2.gz KFVWYOKTFNXJQU-BFHYXJOUSA-N 0 3 350.423 -1.254 20 0 FAADHN O=C(CCn1ccnn1)N[C@@H]1CN(C[C@H]2CCNC(=O)CC2)C[C@H]1O ZINC001192546942 792084688 /nfs/dbraw/zinc/08/46/88/792084688.db2.gz KFVWYOKTFNXJQU-MGPQQGTHSA-N 0 3 350.423 -1.254 20 0 FAADHN O=C(N[C@@H]1CN(CCCCCn2cncn2)C[C@H]1O)[C@@H]1COC(=O)N1 ZINC001192591755 792089263 /nfs/dbraw/zinc/08/92/63/792089263.db2.gz WCWGULHJGZEUMQ-FRRDWIJNSA-N 0 3 352.395 -1.282 20 0 FAADHN O=C(N[C@@H]1CN(CCCCCn2cncn2)C[C@H]1O)[C@H]1COC(=O)N1 ZINC001192591757 792088376 /nfs/dbraw/zinc/08/83/76/792088376.db2.gz WCWGULHJGZEUMQ-JHJVBQTASA-N 0 3 352.395 -1.282 20 0 FAADHN CNC(=O)NCCC(=O)N[C@@H]1CN(C[C@H]2CCNC(=O)CC2)C[C@H]1O ZINC001192702374 792094249 /nfs/dbraw/zinc/09/42/49/792094249.db2.gz NJENGOYCWBUIOW-JHJVBQTASA-N 0 3 355.439 -1.617 20 0 FAADHN CNC(=O)NCCC(=O)N[C@@H]1CN(C[C@@H]2CCNC(=O)CC2)C[C@H]1O ZINC001192702378 792094724 /nfs/dbraw/zinc/09/47/24/792094724.db2.gz NJENGOYCWBUIOW-YNEHKIRRSA-N 0 3 355.439 -1.617 20 0 FAADHN COCCOC[C@H](O)CN1C[C@@H](O)[C@H](NC(=O)Cc2n[nH]c(C)n2)C1 ZINC001192751678 792095972 /nfs/dbraw/zinc/09/59/72/792095972.db2.gz GCABGYYYFJNLNG-JHJVBQTASA-N 0 3 357.411 -2.159 20 0 FAADHN COCCOC[C@@H](O)CN1C[C@@H](O)[C@H](NC(=O)Cc2n[nH]c(C)n2)C1 ZINC001192751679 792096888 /nfs/dbraw/zinc/09/68/88/792096888.db2.gz GCABGYYYFJNLNG-YNEHKIRRSA-N 0 3 357.411 -2.159 20 0 FAADHN Cc1nc(CC(=O)N[C@@H]2CN(C[C@H](O)COCC(C)C)C[C@H]2O)n[nH]1 ZINC001192751726 792097803 /nfs/dbraw/zinc/09/78/03/792097803.db2.gz IDQKGVSZBBBDAK-BFHYXJOUSA-N 0 3 355.439 -1.150 20 0 FAADHN 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792098462 /nfs/dbraw/zinc/09/84/62/792098462.db2.gz ZCBBCDVISSKRQD-MGPQQGTHSA-N 0 3 362.496 -1.430 20 0 FAADHN COCCCCN1C[C@@H](O)[C@H](NC(=O)CN(C)S(=O)(=O)N(C)C)C1 ZINC001192915832 792101798 /nfs/dbraw/zinc/10/17/98/792101798.db2.gz FTZVPFYIENETPE-CHWSQXEVSA-N 0 3 366.484 -1.688 20 0 FAADHN CC[C@H](CN1C[C@@H](O)[C@H](NC(=O)CN(C)S(=O)(=O)N(C)C)C1)OC ZINC001192915863 792102299 /nfs/dbraw/zinc/10/22/99/792102299.db2.gz FWAFRMBJGUTQDT-JHJVBQTASA-N 0 3 366.484 -1.689 20 0 FAADHN CC[C@@H](CN1C[C@@H](O)[C@H](NC(=O)CN(C)S(=O)(=O)N(C)C)C1)OC ZINC001192915866 792101885 /nfs/dbraw/zinc/10/18/85/792101885.db2.gz FWAFRMBJGUTQDT-YNEHKIRRSA-N 0 3 366.484 -1.689 20 0 FAADHN C[C@@H](F)CCN1C[C@@H](O)[C@H](NC(=O)CN(C)S(=O)(=O)N(C)C)C1 ZINC001192915909 792102020 /nfs/dbraw/zinc/10/20/20/792102020.db2.gz HHBWMECXBUDLAG-IJLUTSLNSA-N 0 3 354.448 -1.366 20 0 FAADHN C[C@H](F)CCN1C[C@@H](O)[C@H](NC(=O)CN(C)S(=O)(=O)N(C)C)C1 ZINC001192915910 792101939 /nfs/dbraw/zinc/10/19/39/792101939.db2.gz 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ZINC001193446860 792130637 /nfs/dbraw/zinc/13/06/37/792130637.db2.gz AOCUGORKCKDNIE-MGPQQGTHSA-N 0 3 359.446 -1.147 20 0 FAADHN CCO[C@@H](CN1C[C@@H](O)[C@H](NC(=O)CNS(=O)(=O)CC)C1)C1CC1 ZINC001193447004 792131348 /nfs/dbraw/zinc/13/13/48/792131348.db2.gz GXORBQNXIDYRPR-MCIONIFRSA-N 0 3 363.480 -1.098 20 0 FAADHN CCO[C@H](CN1C[C@@H](O)[C@H](NC(=O)CNS(=O)(=O)CC)C1)C1CC1 ZINC001193447005 792131165 /nfs/dbraw/zinc/13/11/65/792131165.db2.gz GXORBQNXIDYRPR-MGPQQGTHSA-N 0 3 363.480 -1.098 20 0 FAADHN CCS(=O)(=O)NCC(=O)N[C@@H]1CN(CCC[C@H]2CCOC2)C[C@H]1O ZINC001193447097 792131597 /nfs/dbraw/zinc/13/15/97/792131597.db2.gz JFRSDDKGADZERV-BFHYXJOUSA-N 0 3 363.480 -1.096 20 0 FAADHN CCS(=O)(=O)NCC(=O)N[C@@H]1CN(CCC[C@@H]2CCOC2)C[C@H]1O ZINC001193447098 792131623 /nfs/dbraw/zinc/13/16/23/792131623.db2.gz JFRSDDKGADZERV-MGPQQGTHSA-N 0 3 363.480 -1.096 20 0 FAADHN CCS(=O)(=O)NCC(=O)N[C@@H]1CN(C[C@H](OC)C2CCC2)C[C@H]1O ZINC001193447120 792131665 /nfs/dbraw/zinc/13/16/65/792131665.db2.gz 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792192584 /nfs/dbraw/zinc/19/25/84/792192584.db2.gz UPPABJIOKYJXKB-QJPTWQEYSA-N 0 3 357.455 -1.278 20 0 FAADHN CCO[C@@H](CN1C[C@@H](O)[C@H](NC(=O)Cn2ncn(C)c2=O)C1)C1CC1 ZINC001194274442 792190003 /nfs/dbraw/zinc/19/00/03/792190003.db2.gz MNHOSULNIXHKJE-MCIONIFRSA-N 0 3 353.423 -1.442 20 0 FAADHN CCO[C@H](CN1C[C@@H](O)[C@H](NC(=O)Cn2ncn(C)c2=O)C1)C1CC1 ZINC001194274446 792190205 /nfs/dbraw/zinc/19/02/05/792190205.db2.gz MNHOSULNIXHKJE-MGPQQGTHSA-N 0 3 353.423 -1.442 20 0 FAADHN CC(C)CN1CCC[C@H]1C(=O)N[C@@H]1CN(CC(=O)NC(N)=O)C[C@H]1O ZINC001194321357 792194032 /nfs/dbraw/zinc/19/40/32/792194032.db2.gz TYVMDCSTWUIOLD-FRRDWIJNSA-N 0 3 355.439 -1.537 20 0 FAADHN CC(C)CN1CCC[C@@H]1C(=O)N[C@@H]1CN(CC(=O)NC(N)=O)C[C@H]1O ZINC001194321358 792194359 /nfs/dbraw/zinc/19/43/59/792194359.db2.gz TYVMDCSTWUIOLD-JHJVBQTASA-N 0 3 355.439 -1.537 20 0 FAADHN COCCCCCN1C[C@@H](O)[C@H](NC(=O)Cn2ccc(=O)[nH]c2=O)C1 ZINC001194450665 792203823 /nfs/dbraw/zinc/20/38/23/792203823.db2.gz CIWOUCJDYUJGAL-CHWSQXEVSA-N 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/nfs/dbraw/zinc/21/62/22/792216222.db2.gz OFJSOEHSQUFYAV-ZIAGYGMSSA-N 0 3 363.480 -1.000 20 0 FAADHN CCNC(=O)CN1C[C@@H](O)[C@H](NC(=O)[C@H]2CN3CC4CC3(C4)CO2)C1 ZINC001194831432 792217227 /nfs/dbraw/zinc/21/72/27/792217227.db2.gz DGAFSIHUNJTVRL-DEWJTKQSSA-N 0 3 352.435 -1.853 20 0 FAADHN CCNC(=O)CN1C[C@@H](O)[C@H](NC(=O)[C@@H]2CN3CC4CC3(C4)CO2)C1 ZINC001194831433 792217171 /nfs/dbraw/zinc/21/71/71/792217171.db2.gz DGAFSIHUNJTVRL-JEFPAAPESA-N 0 3 352.435 -1.853 20 0 FAADHN O=C(N[C@@H]1CN(CCOCCO)C[C@H]1O)[C@@H]1CN2CC3CC2(C3)CO1 ZINC001194832828 792216949 /nfs/dbraw/zinc/21/69/49/792216949.db2.gz UFELZOZOGXIYON-QJNCVLDKSA-N 0 3 355.435 -1.980 20 0 FAADHN O=C(N[C@@H]1CN(CCOCCO)C[C@H]1O)[C@H]1CN2CC3CC2(C3)CO1 ZINC001194832833 792217053 /nfs/dbraw/zinc/21/70/53/792217053.db2.gz UFELZOZOGXIYON-VXSWHIBVSA-N 0 3 355.435 -1.980 20 0 FAADHN COCCCCN1C[C@@H](O)[C@H](NC(=O)[C@@H]2Cc3cncn3C(=O)N2)C1 ZINC001194892992 792221329 /nfs/dbraw/zinc/22/13/29/792221329.db2.gz MOZACWJOHGIOOM-BFHYXJOUSA-N 0 3 351.407 -1.047 20 0 FAADHN NC(=O)NC(=O)CN1C[C@@H](O)[C@H](NC(=O)[C@H](C2CC2)N2CCCC2)C1 ZINC001194924495 792220395 /nfs/dbraw/zinc/22/03/95/792220395.db2.gz UCZORIHQJTZKER-BZPMIXESSA-N 0 3 353.423 -1.783 20 0 FAADHN NC(=O)NC(=O)CN1C[C@@H](O)[C@H](NC(=O)[C@@H](C2CC2)N2CCCC2)C1 ZINC001194924496 792220246 /nfs/dbraw/zinc/22/02/46/792220246.db2.gz UCZORIHQJTZKER-YRGRVCCFSA-N 0 3 353.423 -1.783 20 0 FAADHN Cn1cnn(CCC(=O)N[C@@H]2CN(CC[C@@H]3CCCO3)C[C@H]2O)c1=O ZINC001194951529 792222012 /nfs/dbraw/zinc/22/20/12/792222012.db2.gz DPCDGLAGFXBCDD-BFHYXJOUSA-N 0 3 353.423 -1.298 20 0 FAADHN Cn1cnn(CCC(=O)N[C@@H]2CN(CC[C@H]3CCCO3)C[C@H]2O)c1=O ZINC001194951530 792221806 /nfs/dbraw/zinc/22/18/06/792221806.db2.gz DPCDGLAGFXBCDD-MGPQQGTHSA-N 0 3 353.423 -1.298 20 0 FAADHN Cn1cnn(CCC(=O)N[C@@H]2CN(CC[C@H]3CCOC3)C[C@H]2O)c1=O ZINC001194951860 792221914 /nfs/dbraw/zinc/22/19/14/792221914.db2.gz JWVBQDHDLBCVDH-BFHYXJOUSA-N 0 3 353.423 -1.440 20 0 FAADHN Cn1cnn(CCC(=O)N[C@@H]2CN(CC[C@@H]3CCOC3)C[C@H]2O)c1=O ZINC001194951862 792222284 /nfs/dbraw/zinc/22/22/84/792222284.db2.gz JWVBQDHDLBCVDH-MGPQQGTHSA-N 0 3 353.423 -1.440 20 0 FAADHN COCCCCCN1C[C@@H](O)[C@H](NC(=O)CCn2ncn(C)c2=O)C1 ZINC001194953039 792223385 /nfs/dbraw/zinc/22/33/85/792223385.db2.gz YVENYMZZPBEXMT-ZIAGYGMSSA-N 0 3 355.439 -1.050 20 0 FAADHN CNS(=O)(=O)NCC(=O)N[C@@H]1CN(CCCc2ccccc2)C[C@H]1O ZINC001194996844 792229014 /nfs/dbraw/zinc/22/90/14/792229014.db2.gz JUDJWTMFUKZULC-HUUCEWRRSA-N 0 3 370.475 -1.166 20 0 FAADHN CNS(=O)(=O)NCC(=O)N[C@@H]1CN(CCCCCOC)C[C@H]1O ZINC001194997211 792228411 /nfs/dbraw/zinc/22/84/11/792228411.db2.gz OPLDINQBXBVYEM-VXGBXAGGSA-N 0 3 352.457 -1.982 20 0 FAADHN CNS(=O)(=O)NCC(=O)N[C@@H]1CN(C[C@@H]2CCC(F)(F)C2)C[C@H]1O ZINC001195010591 792229793 /nfs/dbraw/zinc/22/97/93/792229793.db2.gz AAGQQNJTGTZIOV-GMTAPVOTSA-N 0 3 370.422 -1.363 20 0 FAADHN CNS(=O)(=O)NCC(=O)N[C@@H]1CN(C[C@H]2CCC(F)(F)C2)C[C@H]1O ZINC001195010610 792229520 /nfs/dbraw/zinc/22/95/20/792229520.db2.gz AAGQQNJTGTZIOV-HBNTYKKESA-N 0 3 370.422 -1.363 20 0 FAADHN CNS(=O)(=O)NCC(=O)N[C@@H]1CN(C[C@@H](OC)C2CCC2)C[C@H]1O ZINC001195010982 792231055 /nfs/dbraw/zinc/23/10/55/792231055.db2.gz CSLOXTJZKMLHDQ-JHJVBQTASA-N 0 3 364.468 -1.983 20 0 FAADHN CNS(=O)(=O)NCC(=O)N[C@@H]1CN(C[C@H](OC)C2CCC2)C[C@H]1O ZINC001195010987 792230881 /nfs/dbraw/zinc/23/08/81/792230881.db2.gz CSLOXTJZKMLHDQ-UPJWGTAASA-N 0 3 364.468 -1.983 20 0 FAADHN CCOC1CC(CN2C[C@@H](O)[C@H](NC(=O)CNS(=O)(=O)NC)C2)C1 ZINC001195011176 792231032 /nfs/dbraw/zinc/23/10/32/792231032.db2.gz FKIIHGOISGEABB-FIYWTHMPSA-N 0 3 364.468 -1.983 20 0 FAADHN CNS(=O)(=O)NCC(=O)N[C@@H]1CN([C@H]2CCc3ccccc32)C[C@H]1O ZINC001195011222 792231072 /nfs/dbraw/zinc/23/10/72/792231072.db2.gz GFYUSFOHTUSZFY-QLFBSQMISA-N 0 3 368.459 -1.111 20 0 FAADHN CNS(=O)(=O)NCC(=O)N[C@@H]1CN([C@@H]2CCc3ccccc32)C[C@H]1O ZINC001195011223 792230973 /nfs/dbraw/zinc/23/09/73/792230973.db2.gz GFYUSFOHTUSZFY-RBSFLKMASA-N 0 3 368.459 -1.111 20 0 FAADHN CNS(=O)(=O)NCC(=O)N[C@@H]1CN(CC[C@@H]2CCOC2)C[C@H]1O ZINC001195011502 792231039 /nfs/dbraw/zinc/23/10/39/792231039.db2.gz IRAQNQYCDUUBOO-IJLUTSLNSA-N 0 3 350.441 -2.372 20 0 FAADHN CNS(=O)(=O)NCC(=O)N[C@@H]1CN(CC[C@H]2CCOC2)C[C@H]1O ZINC001195011504 792230902 /nfs/dbraw/zinc/23/09/02/792230902.db2.gz IRAQNQYCDUUBOO-QJPTWQEYSA-N 0 3 350.441 -2.372 20 0 FAADHN CNS(=O)(=O)NCC(=O)N[C@@H]1CN(CCC[C@@H]2CCOC2)C[C@H]1O ZINC001195011879 792231860 /nfs/dbraw/zinc/23/18/60/792231860.db2.gz LJFFQMOYYUBJKO-JHJVBQTASA-N 0 3 364.468 -1.982 20 0 FAADHN CNS(=O)(=O)NCC(=O)N[C@@H]1CN(CCC[C@H]2CCOC2)C[C@H]1O ZINC001195011880 792232280 /nfs/dbraw/zinc/23/22/80/792232280.db2.gz LJFFQMOYYUBJKO-YNEHKIRRSA-N 0 3 364.468 -1.982 20 0 FAADHN CNS(=O)(=O)NCC(=O)N[C@@H]1CN(CCC2CCOCC2)C[C@H]1O ZINC001195012403 792223746 /nfs/dbraw/zinc/22/37/46/792223746.db2.gz NUXDWUYIAQMNCH-CHWSQXEVSA-N 0 3 364.468 -1.982 20 0 FAADHN CNS(=O)(=O)NCC(=O)N[C@@H]1CN(CCc2ccc(C)cc2)C[C@H]1O ZINC001195012581 792223359 /nfs/dbraw/zinc/22/33/59/792223359.db2.gz QGXFIJGRCUJBIA-HUUCEWRRSA-N 0 3 370.475 -1.247 20 0 FAADHN CCO[C@H](CN1C[C@@H](O)[C@H](NC(=O)CNS(=O)(=O)NC)C1)C1CC1 ZINC001195012983 792224505 /nfs/dbraw/zinc/22/45/05/792224505.db2.gz VAKFVPUNJRNYOA-JHJVBQTASA-N 0 3 364.468 -1.983 20 0 FAADHN CCO[C@@H](CN1C[C@@H](O)[C@H](NC(=O)CNS(=O)(=O)NC)C1)C1CC1 ZINC001195012984 792224564 /nfs/dbraw/zinc/22/45/64/792224564.db2.gz VAKFVPUNJRNYOA-UPJWGTAASA-N 0 3 364.468 -1.983 20 0 FAADHN CNS(=O)(=O)NCC(=O)N[C@@H]1CN(CC[C@H]2CCCO2)C[C@H]1O ZINC001195013052 792224609 /nfs/dbraw/zinc/22/46/09/792224609.db2.gz WVNOKCMJZHTCAP-IJLUTSLNSA-N 0 3 350.441 -2.229 20 0 FAADHN CNS(=O)(=O)NCC(=O)N[C@@H]1CN(CC[C@@H]2CCCO2)C[C@H]1O ZINC001195013054 792224762 /nfs/dbraw/zinc/22/47/62/792224762.db2.gz WVNOKCMJZHTCAP-QJPTWQEYSA-N 0 3 350.441 -2.229 20 0 FAADHN CNS(=O)(=O)NCC(=O)N[C@@H]1CN(CC[C@H]2CCCCO2)C[C@H]1O ZINC001195013363 792224811 /nfs/dbraw/zinc/22/48/11/792224811.db2.gz YTEDRBYXTOMEPT-JHJVBQTASA-N 0 3 364.468 -1.839 20 0 FAADHN CNS(=O)(=O)NCC(=O)N[C@@H]1CN(CC[C@@H]2CCCCO2)C[C@H]1O ZINC001195013365 792224749 /nfs/dbraw/zinc/22/47/49/792224749.db2.gz YTEDRBYXTOMEPT-YNEHKIRRSA-N 0 3 364.468 -1.839 20 0 FAADHN CNC(=O)NC(=O)CN1C[C@@H](O)[C@H](NC(=O)C(C)(C)N2CCCC2)C1 ZINC001195215650 792239063 /nfs/dbraw/zinc/23/90/63/792239063.db2.gz WNEGZZZSOSWOBS-VXGBXAGGSA-N 0 3 355.439 -1.522 20 0 FAADHN CC(C)(C(=O)N[C@@H]1CN(CCNS(C)(=O)=O)C[C@H]1O)N1CCCC1 ZINC001195221855 792240169 /nfs/dbraw/zinc/24/01/69/792240169.db2.gz JOAXILHHZORLDM-CHWSQXEVSA-N 0 3 362.496 -1.429 20 0 FAADHN C[C@H](C(=O)NC(N)=O)N1C[C@@H](O)[C@H](NC(=O)C(C)(C)N2CCCC2)C1 ZINC001195222286 792240182 /nfs/dbraw/zinc/24/01/82/792240182.db2.gz RKJNVFZJSTXESQ-IJLUTSLNSA-N 0 3 355.439 -1.395 20 0 FAADHN C[C@@H](C(=O)NC(N)=O)N1C[C@@H](O)[C@H](NC(=O)C(C)(C)N2CCCC2)C1 ZINC001195222287 792239804 /nfs/dbraw/zinc/23/98/04/792239804.db2.gz RKJNVFZJSTXESQ-QJPTWQEYSA-N 0 3 355.439 -1.395 20 0 FAADHN CCO[C@@H](CN1C[C@@H](O)[C@H](NC(=O)CN2CCNC(=O)C2)C1)C1CC1 ZINC001195236750 792237493 /nfs/dbraw/zinc/23/74/93/792237493.db2.gz AIASNZMOSFMZFM-KFWWJZLASA-N 0 3 354.451 -1.605 20 0 FAADHN CCO[C@H](CN1C[C@@H](O)[C@H](NC(=O)CN2CCNC(=O)C2)C1)C1CC1 ZINC001195236766 792238158 /nfs/dbraw/zinc/23/81/58/792238158.db2.gz AIASNZMOSFMZFM-RBSFLKMASA-N 0 3 354.451 -1.605 20 0 FAADHN O=C(N[C@@H]1CN(CCCCCn2cncn2)C[C@H]1O)[C@H]1CCNC1=O ZINC001195272269 792241804 /nfs/dbraw/zinc/24/18/04/792241804.db2.gz ROLKLSWRBWEEGZ-BFHYXJOUSA-N 0 3 350.423 -1.254 20 0 FAADHN O=C(N[C@@H]1CN(CCCCCn2cncn2)C[C@H]1O)[C@@H]1CCNC1=O ZINC001195272285 792241708 /nfs/dbraw/zinc/24/17/08/792241708.db2.gz ROLKLSWRBWEEGZ-MGPQQGTHSA-N 0 3 350.423 -1.254 20 0 FAADHN COCCOCCN1C[C@@H](O)[C@H](NC(=O)[C@H]2CN(C(C)C)CCO2)C1 ZINC001195594752 792253009 /nfs/dbraw/zinc/25/30/09/792253009.db2.gz VCLKSPNLKNOQLF-BZUAXINKSA-N 0 3 359.467 -1.080 20 0 FAADHN COCCOCCN1C[C@@H](O)[C@H](NC(=O)[C@@H]2CN(C(C)C)CCO2)C1 ZINC001195594756 792252441 /nfs/dbraw/zinc/25/24/41/792252441.db2.gz VCLKSPNLKNOQLF-OAGGEKHMSA-N 0 3 359.467 -1.080 20 0 FAADHN O=C(N[C@@H]1CN(CCCCCn2cncn2)C[C@H]1O)[C@H]1CNC(=O)N1 ZINC001195718127 792259982 /nfs/dbraw/zinc/25/99/82/792259982.db2.gz NTRWZHFYXWTFQV-JHJVBQTASA-N 0 3 351.411 -1.709 20 0 FAADHN O=C(N[C@@H]1CN(CCCCCn2cncn2)C[C@H]1O)[C@@H]1CNC(=O)N1 ZINC001195718128 792260213 /nfs/dbraw/zinc/26/02/13/792260213.db2.gz NTRWZHFYXWTFQV-YNEHKIRRSA-N 0 3 351.411 -1.709 20 0 FAADHN NC(=O)C1(C(=O)N[C@@H]2CN(CCCCCn3cncn3)C[C@H]2O)CC1 ZINC001195789116 792263829 /nfs/dbraw/zinc/26/38/29/792263829.db2.gz CEEZUHMIFCFBLP-CHWSQXEVSA-N 0 3 350.423 -1.125 20 0 FAADHN COCCCN1C[C@@H](O)[C@H](NC(=O)[C@H](Cc2c[nH]cn2)NC(C)=O)C1 ZINC001195821823 792265436 /nfs/dbraw/zinc/26/54/36/792265436.db2.gz OTZGCBDAMULUSX-RRFJBIMHSA-N 0 3 353.423 -1.345 20 0 FAADHN CCOCCN1C[C@@H](O)[C@H](NC(=O)[C@H](Cc2cnc[nH]2)NC(C)=O)C1 ZINC001195842668 792266662 /nfs/dbraw/zinc/26/66/62/792266662.db2.gz QSKAQEGXZNYICO-RRFJBIMHSA-N 0 3 353.423 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CC(=O)NCCOCCN1C[C@@H](O)[C@H](NC(=O)[C@@H](C(C)C)N(C)C)C1 ZINC001195980878 792269577 /nfs/dbraw/zinc/26/95/77/792269577.db2.gz JCJMBXDOCVPMNT-BZUAXINKSA-N 0 3 358.483 -1.113 20 0 FAADHN CC(C)[C@H](C(=O)N[C@@H]1CN(CCN2C(=O)CNC2=O)C[C@H]1O)N(C)C ZINC001195980915 792269850 /nfs/dbraw/zinc/26/98/50/792269850.db2.gz JXEZCRVLRCSJEL-YRGRVCCFSA-N 0 3 355.439 -1.714 20 0 FAADHN CCS(=O)(=O)NCCN1C[C@@H](O)[C@H](NC(=O)[C@@H](C(C)C)N(C)C)C1 ZINC001195981030 792269339 /nfs/dbraw/zinc/26/93/39/792269339.db2.gz LOGHEDRHYWXKQO-MGPQQGTHSA-N 0 3 364.512 -1.327 20 0 FAADHN CC(C)[C@H](C(=O)N[C@@H]1CN(CCN(C)S(C)(=O)=O)C[C@H]1O)N(C)C ZINC001195981624 792269323 /nfs/dbraw/zinc/26/93/23/792269323.db2.gz XISJSCRUFPBEFC-MGPQQGTHSA-N 0 3 364.512 -1.375 20 0 FAADHN CC(C)[C@H](C(=O)N[C@@H]1CN(CCNS(C)(=O)=O)C[C@H]1O)N(C)C ZINC001195981663 792269530 /nfs/dbraw/zinc/26/95/30/792269530.db2.gz YOCMLQDACRFUEG-JHJVBQTASA-N 0 3 350.485 -1.717 20 0 FAADHN CS(=O)(=O)NCCN1C[C@@H](O)[C@H](NC(=O)[C@H]2CCCc3[nH]cnc32)C1 ZINC001196089693 792273894 /nfs/dbraw/zinc/27/38/94/792273894.db2.gz BFMXMEHOJZBERQ-CYZMBNFOSA-N 0 3 371.463 -1.460 20 0 FAADHN CS(=O)(=O)NCCN1C[C@@H](O)[C@H](NC(=O)[C@@H]2CCCc3[nH]cnc32)C1 ZINC001196089696 792273513 /nfs/dbraw/zinc/27/35/13/792273513.db2.gz BFMXMEHOJZBERQ-RAIGVLPGSA-N 0 3 371.463 -1.460 20 0 FAADHN NC(=O)[C@H]1CN(CC(=O)N2CCN(C(=O)C3CC3)CC2)C[C@@H]1C(N)=O ZINC001196092633 792273727 /nfs/dbraw/zinc/27/37/27/792273727.db2.gz JAFULAYNPAMYSX-RYUDHWBXSA-N 0 3 351.407 -2.414 20 0 FAADHN NC(=O)[C@H]1CN(CC(=O)N2CCN(C(=O)C3CC3)CC2)C[C@H]1C(N)=O ZINC001196092646 792273812 /nfs/dbraw/zinc/27/38/12/792273812.db2.gz JAFULAYNPAMYSX-TXEJJXNPSA-N 0 3 351.407 -2.414 20 0 FAADHN NC(=O)[C@@H]1CN(CC(=O)N2CCN(C(=O)C3CC3)CC2)C[C@H]1C(N)=O ZINC001196092650 792273326 /nfs/dbraw/zinc/27/33/26/792273326.db2.gz JAFULAYNPAMYSX-VXGBXAGGSA-N 0 3 351.407 -2.414 20 0 FAADHN COC(=O)C1CCN(C(=O)[C@H](C)N2C[C@H](C(N)=O)[C@@H](C(N)=O)C2)CC1 ZINC001196094952 792273338 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DRAFZDAEUSYBAL-NUEKZKHPSA-N 0 3 356.467 -1.215 20 0 FAADHN CC(=O)NCCOCCN1C[C@@H](O)[C@H](NC(=O)CN2CC[C@@H](C)C2)C1 ZINC001196167669 792276601 /nfs/dbraw/zinc/27/66/01/792276601.db2.gz FEXLHLKDGPCJRE-FVQBIDKESA-N 0 3 356.467 -1.358 20 0 FAADHN CC(=O)NCCOCCN1C[C@@H](O)[C@H](NC(=O)CN2CC[C@H](C)C2)C1 ZINC001196167671 792277394 /nfs/dbraw/zinc/27/73/94/792277394.db2.gz FEXLHLKDGPCJRE-NUEKZKHPSA-N 0 3 356.467 -1.358 20 0 FAADHN NC(=O)[C@@H]1C[C@@H]1C(=O)N[C@@H]1CN(CCCCCn2cncn2)C[C@H]1O ZINC001196185006 792276191 /nfs/dbraw/zinc/27/61/91/792276191.db2.gz MFUNUGCOMYQQEP-XJFOESAGSA-N 0 3 350.423 -1.269 20 0 FAADHN CNC(=O)NC(=O)CN1C[C@@H](O)[C@H](NC(=O)CN(C)CC(C)(C)C)C1 ZINC001196200529 792278909 /nfs/dbraw/zinc/27/89/09/792278909.db2.gz WWOFGCNDZKYOQQ-VXGBXAGGSA-N 0 3 357.455 -1.419 20 0 FAADHN CC[C@@H](C(=O)N[C@@H]1CN(CC(=O)NC2CCOCC2)C[C@H]1O)N(C)C ZINC001196206486 792279765 /nfs/dbraw/zinc/27/97/65/792279765.db2.gz DFHMQHSBZHOQCF-QLFBSQMISA-N 0 3 356.467 -1.217 20 0 FAADHN CN(CC(=O)N[C@@H]1CN([C@H]2CCC(=O)NC2=O)C[C@H]1O)CC(C)(C)C ZINC001196206753 792279621 /nfs/dbraw/zinc/27/96/21/792279621.db2.gz GWLFLCYPNHRFNN-FRRDWIJNSA-N 0 3 354.451 -1.069 20 0 FAADHN CN(CC(=O)N[C@@H]1CN([C@@H]2CCC(=O)NC2=O)C[C@H]1O)CC(C)(C)C ZINC001196206756 792278847 /nfs/dbraw/zinc/27/88/47/792278847.db2.gz GWLFLCYPNHRFNN-JHJVBQTASA-N 0 3 354.451 -1.069 20 0 FAADHN CN(CC(=O)N[C@@H]1CN(CCNS(C)(=O)=O)C[C@H]1O)CC(C)(C)C ZINC001196221875 792280216 /nfs/dbraw/zinc/28/02/16/792280216.db2.gz BGWDTTIEHHBHGT-CHWSQXEVSA-N 0 3 364.512 -1.325 20 0 FAADHN C[C@H](C(=O)NC(N)=O)N1C[C@@H](O)[C@H](NC(=O)CN(C)CC(C)(C)C)C1 ZINC001196222179 792280095 /nfs/dbraw/zinc/28/00/95/792280095.db2.gz IKYNSRUIKRIYJB-IJLUTSLNSA-N 0 3 357.455 -1.291 20 0 FAADHN C[C@@H](C(=O)NC(N)=O)N1C[C@@H](O)[C@H](NC(=O)CN(C)CC(C)(C)C)C1 ZINC001196222180 792280480 /nfs/dbraw/zinc/28/04/80/792280480.db2.gz IKYNSRUIKRIYJB-QJPTWQEYSA-N 0 3 357.455 -1.291 20 0 FAADHN CC[C@@H](C(=O)N[C@@H]1CN(CC(=O)Nc2nncs2)C[C@H]1O)N(C)C ZINC001196267622 792280780 /nfs/dbraw/zinc/28/07/80/792280780.db2.gz FHEQGHSLSXTTSX-OUAUKWLOSA-N 0 3 356.452 -1.022 20 0 FAADHN CC[C@@H](C(=O)N[C@@H]1CN(CCCNS(=O)(=O)CC)C[C@H]1O)N(C)C ZINC001196267832 792281067 /nfs/dbraw/zinc/28/10/67/792281067.db2.gz HAUWCOTUCRMLNA-HZSPNIEDSA-N 0 3 364.512 -1.183 20 0 FAADHN CC[C@@H](C(=O)N[C@@H]1CN(Cc2nnc3n2CCOC3)C[C@H]1O)N(C)C ZINC001196267840 792280244 /nfs/dbraw/zinc/28/02/44/792280244.db2.gz HGPHBXVUVNVGPX-FRRDWIJNSA-N 0 3 352.439 -1.190 20 0 FAADHN CCCNC(=O)NC(=O)CN1C[C@@H](O)[C@H](NC(=O)[C@H](CC)N(C)C)C1 ZINC001196267919 792280496 /nfs/dbraw/zinc/28/04/96/792280496.db2.gz KOUGGUHAOCVWNL-FRRDWIJNSA-N 0 3 357.455 -1.276 20 0 FAADHN CC[C@@H](C(=O)N[C@@H]1CN(C[C@H](O)CN2CCCC2=O)C[C@H]1O)N(C)C ZINC001196267921 792280700 /nfs/dbraw/zinc/28/07/00/792280700.db2.gz KPEVSZPLFUIVRV-LJISPDSOSA-N 0 3 356.467 -1.529 20 0 FAADHN CC[C@@H](C(=O)N[C@@H]1CN(CCN(C)S(C)(=O)=O)C[C@H]1O)N(C)C ZINC001196268083 792280573 /nfs/dbraw/zinc/28/05/73/792280573.db2.gz OVIZNIOXNCADBG-FRRDWIJNSA-N 0 3 350.485 -1.621 20 0 FAADHN CC[C@@H](C(=O)N[C@@H]1CN(CCN2CCCS2(=O)=O)C[C@H]1O)N(C)C ZINC001196268141 792281891 /nfs/dbraw/zinc/28/18/91/792281891.db2.gz PHWGNSWBFVPEJK-HZSPNIEDSA-N 0 3 362.496 -1.477 20 0 FAADHN CC[C@@H](C(=O)N[C@@H]1CN(CC(=O)N2CCNC(=O)C2)C[C@H]1O)N(C)C ZINC001196268495 792281986 /nfs/dbraw/zinc/28/19/86/792281986.db2.gz VKUAHOSQSSRMRS-FRRDWIJNSA-N 0 3 355.439 -2.554 20 0 FAADHN CC[C@@H](C(=O)N[C@@H]1CN(CC(=O)Nc2cnccn2)C[C@H]1O)N(C)C ZINC001196268499 792281450 /nfs/dbraw/zinc/28/14/50/792281450.db2.gz VNDCZSMRROZXKG-FRRDWIJNSA-N 0 3 350.423 -1.083 20 0 FAADHN CC[C@@H](C(=O)N[C@@H]1CN(CC(=O)NC(=O)NC2CC2)C[C@H]1O)N(C)C ZINC001196268510 792282170 /nfs/dbraw/zinc/28/21/70/792282170.db2.gz VTTHUNVQWYOWKG-FRRDWIJNSA-N 0 3 355.439 -1.524 20 0 FAADHN CC[C@@H](C(=O)N[C@@H]1CN(CCNS(=O)(=O)CC)C[C@H]1O)N(C)C ZINC001196276059 792283036 /nfs/dbraw/zinc/28/30/36/792283036.db2.gz IJRXBDJFNPWHKP-FRRDWIJNSA-N 0 3 350.485 -1.573 20 0 FAADHN CC[C@@H](C(=O)N[C@@H]1CN(CCCS(=O)(=O)N(C)C)C[C@H]1O)N(C)C ZINC001196276383 792283748 /nfs/dbraw/zinc/28/37/48/792283748.db2.gz OYAOSELQKPUVLN-HZSPNIEDSA-N 0 3 364.512 -1.231 20 0 FAADHN CC[C@@H](C(=O)N[C@@H]1CN(CCCN2C(=O)CNC2=O)C[C@H]1O)N(C)C ZINC001196276702 792283699 /nfs/dbraw/zinc/28/36/99/792283699.db2.gz UKPRMJMGUJUZOE-FRRDWIJNSA-N 0 3 355.439 -1.570 20 0 FAADHN CC(=O)NCCOCCN1C[C@@H](O)[C@H](NC(=O)CCc2c[nH]nn2)C1 ZINC001196314030 792283198 /nfs/dbraw/zinc/28/31/98/792283198.db2.gz QPYVORBUOQKVPJ-ZIAGYGMSSA-N 0 3 354.411 -1.949 20 0 FAADHN CC(=O)NCCOCCN1C[C@@H](O)[C@H](NC(=O)CCc2cn[nH]n2)C1 ZINC001196314030 792283192 /nfs/dbraw/zinc/28/31/92/792283192.db2.gz QPYVORBUOQKVPJ-ZIAGYGMSSA-N 0 3 354.411 -1.949 20 0 FAADHN COCCOC[C@@H](O)CN1C[C@@H](O)[C@H](NC(=O)CCc2c[nH]nn2)C1 ZINC001196314857 792283356 /nfs/dbraw/zinc/28/33/56/792283356.db2.gz ZJAAQEACFUKXHD-BFHYXJOUSA-N 0 3 357.411 -2.078 20 0 FAADHN COCCOC[C@@H](O)CN1C[C@@H](O)[C@H](NC(=O)CCc2cn[nH]n2)C1 ZINC001196314857 792283347 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O=C(CCn1cnnn1)N[C@@H]1CN(C[C@@H]2CCNC(=O)CC2)C[C@H]1O ZINC001197171818 792339758 /nfs/dbraw/zinc/33/97/58/792339758.db2.gz KWCZRGMNWAWIAF-YNEHKIRRSA-N 0 3 351.411 -1.859 20 0 FAADHN Cn1cnnc1COCC(=O)N[C@@H]1CN(C[C@@H]2CCCOC2)C[C@H]1O ZINC001197357975 792346540 /nfs/dbraw/zinc/34/65/40/792346540.db2.gz KSMONQQXFQYXSD-BFHYXJOUSA-N 0 3 353.423 -1.080 20 0 FAADHN Cn1cnnc1COCC(=O)N[C@@H]1CN(C[C@H]2CCCOC2)C[C@H]1O ZINC001197357995 792346577 /nfs/dbraw/zinc/34/65/77/792346577.db2.gz KSMONQQXFQYXSD-MGPQQGTHSA-N 0 3 353.423 -1.080 20 0 FAADHN Cn1ncnc1COCC(=O)N[C@@H]1CN(CC[C@H]2CCOC2)C[C@H]1O ZINC001197368048 792353406 /nfs/dbraw/zinc/35/34/06/792353406.db2.gz UTUWUSMHEPBBBI-BFHYXJOUSA-N 0 3 353.423 -1.080 20 0 FAADHN Cn1ncnc1COCC(=O)N[C@@H]1CN(CC[C@@H]2CCOC2)C[C@H]1O ZINC001197368049 792353776 /nfs/dbraw/zinc/35/37/76/792353776.db2.gz UTUWUSMHEPBBBI-MGPQQGTHSA-N 0 3 353.423 -1.080 20 0 FAADHN Cn1ncnc1COCC(=O)N[C@@H]1CN(C[C@@H]2CCCOC2)C[C@H]1O ZINC001197381498 792353540 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FAADHN CCS(=O)(=O)N(C)CC(=O)N[C@@H]1CN(CC[C@H]2CCOC2)C[C@H]1O ZINC001197381910 792350379 /nfs/dbraw/zinc/35/03/79/792350379.db2.gz NCGXPAMFTWGPSK-BFHYXJOUSA-N 0 3 363.480 -1.144 20 0 FAADHN CCS(=O)(=O)N(C)CC(=O)N[C@@H]1CN(CC[C@@H]2CCOC2)C[C@H]1O ZINC001197381911 792350302 /nfs/dbraw/zinc/35/03/02/792350302.db2.gz NCGXPAMFTWGPSK-MGPQQGTHSA-N 0 3 363.480 -1.144 20 0 FAADHN CCOCCCN1C[C@@H](O)[C@H](NC(=O)CN(C)S(=O)(=O)CC)C1 ZINC001197381921 792349417 /nfs/dbraw/zinc/34/94/17/792349417.db2.gz NQKWUBJHQGEYKI-CHWSQXEVSA-N 0 3 351.469 -1.144 20 0 FAADHN CCS(=O)(=O)N(C)CC(=O)N[C@@H]1CN(CCCCOC)C[C@H]1O ZINC001197382042 792351088 /nfs/dbraw/zinc/35/10/88/792351088.db2.gz QZCBZNZTJREGCE-CHWSQXEVSA-N 0 3 351.469 -1.144 20 0 FAADHN CCS(=O)(=O)N(C)CC(=O)N[C@@H]1CN(CC[C@@H]2CCCO2)C[C@H]1O ZINC001197388005 792351499 /nfs/dbraw/zinc/35/14/99/792351499.db2.gz HYVWVGDOIQRXQV-BFHYXJOUSA-N 0 3 363.480 -1.002 20 0 FAADHN CCS(=O)(=O)N(C)CC(=O)N[C@@H]1CN(CC[C@H]2CCCO2)C[C@H]1O ZINC001197388006 792351231 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OYUDYBJABPOGPK-KFWWJZLASA-N 0 3 356.467 -1.094 20 0 FAADHN CCOCCNC(=O)CN[C@@H]1CN(C(=O)[C@H]2COCCN2C)C[C@H]1C ZINC001214454474 793085757 /nfs/dbraw/zinc/08/57/57/793085757.db2.gz OYUDYBJABPOGPK-RBSFLKMASA-N 0 3 356.467 -1.094 20 0 FAADHN COCCCNC(=O)CN[C@@H]1CN(C(=O)CN2CCOCC2)C[C@H]1C ZINC001214454577 793086084 /nfs/dbraw/zinc/08/60/84/793086084.db2.gz UMNUJZKXJLFFGT-HUUCEWRRSA-N 0 3 356.467 -1.092 20 0 FAADHN CCNC(=O)NC(=O)CN[C@@H]1CN(C(=O)[C@H]2COCCN2C)C[C@H]1C ZINC001214458887 793086221 /nfs/dbraw/zinc/08/62/21/793086221.db2.gz JOUCODSPCHFGSP-JHJVBQTASA-N 0 3 355.439 -1.401 20 0 FAADHN CCNC(=O)NC(=O)CN[C@@H]1CN(C(=O)[C@@H]2COCCN2C)C[C@H]1C ZINC001214458888 793085398 /nfs/dbraw/zinc/08/53/98/793085398.db2.gz JOUCODSPCHFGSP-UPJWGTAASA-N 0 3 355.439 -1.401 20 0 FAADHN COCCCNC(=O)CN[C@@H]1CN(C(=O)[C@@H]2COCCN2C)C[C@H]1C ZINC001214459169 793085457 /nfs/dbraw/zinc/08/54/57/793085457.db2.gz QSRNCBYUQMWOLN-KFWWJZLASA-N 0 3 356.467 -1.094 20 0 FAADHN COCCCNC(=O)CN[C@@H]1CN(C(=O)[C@H]2COCCN2C)C[C@H]1C ZINC001214459170 793086199 /nfs/dbraw/zinc/08/61/99/793086199.db2.gz QSRNCBYUQMWOLN-RBSFLKMASA-N 0 3 356.467 -1.094 20 0 FAADHN CCOCCNC(=O)CN[C@@H]1CN(C(=O)CN2CCOCC2)C[C@H]1C ZINC001214464095 793085812 /nfs/dbraw/zinc/08/58/12/793085812.db2.gz MZRPEZYHQVVFMS-HUUCEWRRSA-N 0 3 356.467 -1.092 20 0 FAADHN CCNC(=O)NC(=O)CN[C@@H]1CN(C(=O)CN2CCOCC2)C[C@H]1C ZINC001214464281 793085591 /nfs/dbraw/zinc/08/55/91/793085591.db2.gz UKKFKOTYONDLOV-CHWSQXEVSA-N 0 3 355.439 -1.399 20 0 FAADHN CNC(=O)NC(=O)[C@H](C)N[C@@H]1CN(C(=O)CN2CN=NC2=O)C[C@H]1C ZINC001214471680 793086006 /nfs/dbraw/zinc/08/60/06/793086006.db2.gz ANKDGTVPZQSYLS-KXUCPTDWSA-N 0 3 353.383 -1.736 20 0 FAADHN CNC(=O)NC(=O)[C@@H](C)N[C@@H]1CN(C(=O)CN2CN=NC2=O)C[C@H]1C ZINC001214471681 793085938 /nfs/dbraw/zinc/08/59/38/793085938.db2.gz ANKDGTVPZQSYLS-OPRDCNLKSA-N 0 3 353.383 -1.736 20 0 FAADHN CCOCCNC(=O)CN[C@@H]1CN(C(=O)CN2CN=NC2=O)C[C@H]1C ZINC001214475432 793085962 /nfs/dbraw/zinc/08/59/62/793085962.db2.gz FINMPCWCTBHOEP-VXGBXAGGSA-N 0 3 354.411 -1.427 20 0 FAADHN CCNC(=O)NC(=O)CN[C@@H]1CN(C(=O)CN2CN=NC2=O)C[C@H]1C ZINC001214475433 793086127 /nfs/dbraw/zinc/08/61/27/793086127.db2.gz FIOZBGHKTVKQON-NXEZZACHSA-N 0 3 353.383 -1.734 20 0 FAADHN COCCCNC(=O)CN[C@@H]1CN(C(=O)CN2CN=NC2=O)C[C@H]1C ZINC001214475536 793085674 /nfs/dbraw/zinc/08/56/74/793085674.db2.gz GCAYQFYJLBQVBT-VXGBXAGGSA-N 0 3 354.411 -1.427 20 0 FAADHN CCNC(=O)NC(=O)CN[C@@H]1CN(C(=O)c2cnn(C)c2N)C[C@H]1C ZINC001214477935 793085652 /nfs/dbraw/zinc/08/56/52/793085652.db2.gz KWUAPENSZAUJEZ-MWLCHTKSSA-N 0 3 351.411 -1.102 20 0 FAADHN CCNC(=O)CC(=O)N1C[C@@H](C)[C@H](NCC(=O)N2CCNC(=O)C2)C1 ZINC001214482111 793085626 /nfs/dbraw/zinc/08/56/26/793085626.db2.gz HCSNOSYZHJOXCO-VXGBXAGGSA-N 0 3 353.423 -2.093 20 0 FAADHN CCNC(=O)CC(=O)N1C[C@@H](C)[C@H](NCC(=O)NC(=O)NC2CC2)C1 ZINC001214482310 793086148 /nfs/dbraw/zinc/08/61/48/793086148.db2.gz PRXUSHSGERTTHQ-ZYHUDNBSSA-N 0 3 353.423 -1.063 20 0 FAADHN CNC(=O)NC(=O)[C@@H](C)N[C@@H]1CN(C(=O)c2cnn(C)c2N)C[C@H]1C ZINC001214491053 793086770 /nfs/dbraw/zinc/08/67/70/793086770.db2.gz FZBRPSQVJFORGH-FXPVBKGRSA-N 0 3 351.411 -1.104 20 0 FAADHN CNC(=O)NC(=O)[C@H](C)N[C@@H]1CN(C(=O)c2cnn(C)c2N)C[C@H]1C ZINC001214491054 793086936 /nfs/dbraw/zinc/08/69/36/793086936.db2.gz FZBRPSQVJFORGH-WCABBAIRSA-N 0 3 351.411 -1.104 20 0 FAADHN CNC(=O)CC(=O)N1C[C@@H](C)[C@H](N[C@H](C)C(=O)NC(=O)NC2CC2)C1 ZINC001214497192 793086487 /nfs/dbraw/zinc/08/64/87/793086487.db2.gz IRACLBNXOMGOKO-CKYFFXLPSA-N 0 3 353.423 -1.064 20 0 FAADHN CNC(=O)CC(=O)N1C[C@@H](C)[C@H](N[C@@H](C)C(=O)NC(=O)NC2CC2)C1 ZINC001214497193 793086894 /nfs/dbraw/zinc/08/68/94/793086894.db2.gz IRACLBNXOMGOKO-JFGNBEQYSA-N 0 3 353.423 -1.064 20 0 FAADHN CNC(=O)CC(=O)N1C[C@@H](C)[C@H](NCC(=O)N[C@@H](C)C(=O)N(C)C)C1 ZINC001214497448 793086915 /nfs/dbraw/zinc/08/69/15/793086915.db2.gz NGTTXGSXFVSKRX-GRYCIOLGSA-N 0 3 355.439 -1.848 20 0 FAADHN CNC(=O)CC(=O)N1C[C@@H](C)[C@H](NCC(=O)N[C@H](C)C(=O)N(C)C)C1 ZINC001214497450 793086710 /nfs/dbraw/zinc/08/67/10/793086710.db2.gz NGTTXGSXFVSKRX-IJLUTSLNSA-N 0 3 355.439 -1.848 20 0 FAADHN CNC(=O)CC(=O)N1C[C@@H](C)[C@H](NCc2cc(=O)n(C)c(=O)n2C)C1 ZINC001214497892 793086842 /nfs/dbraw/zinc/08/68/42/793086842.db2.gz UZXSDUSBWATANQ-ZYHUDNBSSA-N 0 3 351.407 -1.843 20 0 FAADHN C[C@H](NC(N)=O)C(=O)N1C[C@@H](C)[C@H](NCC(=O)N2CCNC(=O)C2)C1 ZINC001214508295 793086529 /nfs/dbraw/zinc/08/65/29/793086529.db2.gz JHMMWTQPMZNBEM-OUAUKWLOSA-N 0 3 354.411 -2.562 20 0 FAADHN C[C@H](NC(N)=O)C(=O)N1C[C@@H](C)[C@H](NCC(=O)NC2CCOCC2)C1 ZINC001214508351 793087224 /nfs/dbraw/zinc/08/72/24/793087224.db2.gz MFAVJHKRJHMCMB-NTZNESFSSA-N 0 3 355.439 -1.225 20 0 FAADHN CCCNC(=O)NC(=O)CN[C@@H]1CN(C(=O)[C@H](C)NC(N)=O)C[C@H]1C ZINC001214508519 793087130 /nfs/dbraw/zinc/08/71/30/793087130.db2.gz PDBZRCYIGHIPMU-OUAUKWLOSA-N 0 3 356.427 -1.285 20 0 FAADHN C[C@H](NC(N)=O)C(=O)N1C[C@@H](C)[C@H](NCC(=O)NC(=O)NC2CC2)C1 ZINC001214508530 793086398 /nfs/dbraw/zinc/08/63/98/793086398.db2.gz PPRSOQFNZFSMEH-WCABBAIRSA-N 0 3 354.411 -1.532 20 0 FAADHN CCNC(=O)NC(=O)CN[C@@H]1CN(C(=O)CCn2ccnn2)C[C@H]1C ZINC001214512442 793086508 /nfs/dbraw/zinc/08/65/08/793086508.db2.gz TXFMSORIFQRZSP-VXGBXAGGSA-N 0 3 351.411 -1.050 20 0 FAADHN CCNC(=O)NC(=O)CN[C@@H]1CN(C(=O)c2cc(=O)n(C)o2)C[C@H]1C ZINC001214512567 793087243 /nfs/dbraw/zinc/08/72/43/793087243.db2.gz YAVVFEKPYNCTIY-NXEZZACHSA-N 0 3 353.379 -1.126 20 0 FAADHN CNC(=O)NC(=O)[C@H](C)N[C@@H]1CN(C(=O)C2CN(C(C)=O)C2)C[C@H]1C ZINC001214514031 793086818 /nfs/dbraw/zinc/08/68/18/793086818.db2.gz JYSTUUZGKRSGFQ-GBIKHYSHSA-N 0 3 353.423 -1.255 20 0 FAADHN CNC(=O)NC(=O)[C@@H](C)N[C@@H]1CN(C(=O)C2CN(C(C)=O)C2)C[C@H]1C ZINC001214514032 793086873 /nfs/dbraw/zinc/08/68/73/793086873.db2.gz JYSTUUZGKRSGFQ-GIPNMCIBSA-N 0 3 353.423 -1.255 20 0 FAADHN CNC(=O)NC(=O)[C@H](C)N[C@@H]1CN(C(=O)CCn2ccnn2)C[C@H]1C ZINC001214514421 793086991 /nfs/dbraw/zinc/08/69/91/793086991.db2.gz XTFVSLYQDMGRQQ-GRYCIOLGSA-N 0 3 351.411 -1.051 20 0 FAADHN CNC(=O)NC(=O)[C@@H](C)N[C@@H]1CN(C(=O)CCn2ccnn2)C[C@H]1C ZINC001214514422 793086558 /nfs/dbraw/zinc/08/65/58/793086558.db2.gz XTFVSLYQDMGRQQ-IJLUTSLNSA-N 0 3 351.411 -1.051 20 0 FAADHN CCNC(=O)NC(=O)CN[C@@H]1CN(C(=O)C2CN(C(C)=O)C2)C[C@H]1C ZINC001214514428 793087171 /nfs/dbraw/zinc/08/71/71/793087171.db2.gz YAVVLJWJRJIYOC-ZWNOBZJWSA-N 0 3 353.423 -1.253 20 0 FAADHN CNC(=O)NC(=O)[C@H](C)N[C@@H]1CN(C(=O)c2cc(=O)n(C)o2)C[C@H]1C ZINC001214516618 793086678 /nfs/dbraw/zinc/08/66/78/793086678.db2.gz UDXKHCGTKAMBML-KXUCPTDWSA-N 0 3 353.379 -1.128 20 0 FAADHN CNC(=O)NC(=O)[C@@H](C)N[C@@H]1CN(C(=O)c2cc(=O)n(C)o2)C[C@H]1C ZINC001214516619 793086427 /nfs/dbraw/zinc/08/64/27/793086427.db2.gz UDXKHCGTKAMBML-OPRDCNLKSA-N 0 3 353.379 -1.128 20 0 FAADHN CCCNC(=O)NC(=O)CN[C@@H]1CN(C(=O)[C@H]2COC(=O)N2)C[C@H]1C ZINC001214542437 793087857 /nfs/dbraw/zinc/08/78/57/793087857.db2.gz XEWCEQLMGWBAOG-GMTAPVOTSA-N 0 3 355.395 -1.233 20 0 FAADHN CCCNC(=O)NC(=O)CN[C@@H]1CN(C(=O)[C@@H]2COC(=O)N2)C[C@H]1C ZINC001214542438 793088130 /nfs/dbraw/zinc/08/81/30/793088130.db2.gz XEWCEQLMGWBAOG-MXWKQRLJSA-N 0 3 355.395 -1.233 20 0 FAADHN C[C@@H]1CN(C(=O)[C@H]2COC(=O)N2)C[C@H]1NCC(=O)NC(=O)NC1CC1 ZINC001214542490 793087465 /nfs/dbraw/zinc/08/74/65/793087465.db2.gz YQTWJYOXXWPQJA-FBIMIBRVSA-N 0 3 353.379 -1.481 20 0 FAADHN C[C@@H]1CN(C(=O)[C@@H]2COC(=O)N2)C[C@H]1NCC(=O)NC(=O)NC1CC1 ZINC001214542491 793087765 /nfs/dbraw/zinc/08/77/65/793087765.db2.gz YQTWJYOXXWPQJA-IEBDPFPHSA-N 0 3 353.379 -1.481 20 0 FAADHN C[C@@H]1CN(C(=O)[C@H]2COC(=O)N2)C[C@H]1NCC(=O)NC1CCOCC1 ZINC001214542520 793087931 /nfs/dbraw/zinc/08/79/31/793087931.db2.gz ZSIIVMXITOHVLR-RAIGVLPGSA-N 0 3 354.407 -1.174 20 0 FAADHN C[C@@H]1CN(C(=O)[C@@H]2COC(=O)N2)C[C@H]1NCC(=O)NC1CCOCC1 ZINC001214542521 793088223 /nfs/dbraw/zinc/08/82/23/793088223.db2.gz ZSIIVMXITOHVLR-RTXFEEFZSA-N 0 3 354.407 -1.174 20 0 FAADHN CNC(=O)NCCC(=O)N1C[C@@H](C)[C@H](N[C@H](C)C(=O)NC(=O)NC)C1 ZINC001214562131 793088272 /nfs/dbraw/zinc/08/82/72/793088272.db2.gz LDIZBDDXWCRZCB-GMTAPVOTSA-N 0 3 356.427 -1.414 20 0 FAADHN CNC(=O)NCCC(=O)N1C[C@@H](C)[C@H](N[C@@H](C)C(=O)NC(=O)NC)C1 ZINC001214562132 793087560 /nfs/dbraw/zinc/08/75/60/793087560.db2.gz LDIZBDDXWCRZCB-OUAUKWLOSA-N 0 3 356.427 -1.414 20 0 FAADHN CCOCCNC(=O)CN[C@@H]1CN(C(=O)CCNC(=O)NC)C[C@H]1C ZINC001214563964 793088023 /nfs/dbraw/zinc/08/80/23/793088023.db2.gz BPCREOUEAYTVBI-CHWSQXEVSA-N 0 3 357.455 -1.105 20 0 FAADHN CNC(=O)NCCC(=O)N1C[C@@H](C)[C@H](NCC(=O)NCCCOC)C1 ZINC001214564201 793087894 /nfs/dbraw/zinc/08/78/94/793087894.db2.gz NVJPEEIIVIDKTE-CHWSQXEVSA-N 0 3 357.455 -1.105 20 0 FAADHN CNC(=O)NCCC(=O)N1C[C@@H](C)[C@H](NCC(=O)N2CCOCC2)C1 ZINC001214564269 793088200 /nfs/dbraw/zinc/08/82/00/793088200.db2.gz QTVUZZNCLBZTPX-CHWSQXEVSA-N 0 3 355.439 -1.399 20 0 FAADHN CCNC(=O)NC(=O)CN[C@@H]1CN(C(=O)CCNC(=O)NC)C[C@H]1C ZINC001214564360 793088243 /nfs/dbraw/zinc/08/82/43/793088243.db2.gz WPBRLFXFNNUVRG-GHMZBOCLSA-N 0 3 356.427 -1.412 20 0 FAADHN CCNC(=O)NC(=O)CN[C@@H]1CN(C(=O)Cc2nnc(C)[nH]2)C[C@H]1C ZINC001214585276 793087546 /nfs/dbraw/zinc/08/75/46/793087546.db2.gz GQFLZYAXTHCIPQ-MWLCHTKSSA-N 0 3 351.411 -1.062 20 0 FAADHN C[C@@H]1CN(C(=O)CNC(=O)N2CCCC2)C[C@H]1NCC(=O)NC(N)=O ZINC001214595699 793087612 /nfs/dbraw/zinc/08/76/12/793087612.db2.gz SMPXVRRPELBMKF-GHMZBOCLSA-N 0 3 354.411 -1.577 20 0 FAADHN COCCn1cc(C(=O)N2C[C@@H](C)[C@H](NCC(=O)NC(N)=O)C2)nn1 ZINC001214595787 793087982 /nfs/dbraw/zinc/08/79/82/793087982.db2.gz XAKTUYGRPLQGCV-NXEZZACHSA-N 0 3 353.383 -1.831 20 0 FAADHN CNS(=O)(=O)CCC(=O)N1C[C@@H](C)[C@H](NCC(=O)NCC2CC2)C1 ZINC001214610663 793087685 /nfs/dbraw/zinc/08/76/85/793087685.db2.gz BWLMNTJJHSLNMB-DGCLKSJQSA-N 0 3 360.480 -1.112 20 0 FAADHN CNS(=O)(=O)CCC(=O)N1C[C@@H](C)[C@H](NCC(=O)N(C)C2CC2)C1 ZINC001214610710 793088299 /nfs/dbraw/zinc/08/82/99/793088299.db2.gz CMQRPIGFYNZLKQ-DGCLKSJQSA-N 0 3 360.480 -1.017 20 0 FAADHN CNS(=O)(=O)CCC(=O)N1C[C@@H](C)[C@H](NCCS(C)(=O)=O)C1 ZINC001214610997 793088180 /nfs/dbraw/zinc/08/81/80/793088180.db2.gz JZHDUZAKWHVKTK-GHMZBOCLSA-N 0 3 355.482 -1.593 20 0 FAADHN CNC(=O)NC(=O)CN[C@@H]1CN(C(=O)CCS(=O)(=O)NC)C[C@H]1C ZINC001214611096 793088045 /nfs/dbraw/zinc/08/80/45/793088045.db2.gz OSAHACMOGAJALQ-NXEZZACHSA-N 0 3 363.440 -2.182 20 0 FAADHN CNS(=O)(=O)CCC(=O)N1C[C@@H](C)[C@H](NCC(=O)N2CCCC2)C1 ZINC001214611258 793089223 /nfs/dbraw/zinc/08/92/23/793089223.db2.gz WYMZVVGJFKTTIK-CHWSQXEVSA-N 0 3 360.480 -1.015 20 0 FAADHN C[C@@H]1CN(C(=O)CN(C)S(=O)(=O)N(C)C)C[C@H]1N[C@H]1CCNC1=O ZINC001214611291 793089150 /nfs/dbraw/zinc/08/91/50/793089150.db2.gz YFZHOPILTGVBIS-GRYCIOLGSA-N 0 3 361.468 -1.950 20 0 FAADHN C[C@@H]1CN(C(=O)CN(C)S(=O)(=O)N(C)C)C[C@H]1N[C@@H]1CCNC1=O ZINC001214611292 793088873 /nfs/dbraw/zinc/08/88/73/793088873.db2.gz YFZHOPILTGVBIS-IJLUTSLNSA-N 0 3 361.468 -1.950 20 0 FAADHN C[C@@H]1CN(C(=O)CN(C)S(=O)(=O)N(C)C)C[C@H]1NCC(=O)N(C)C ZINC001214612753 793089293 /nfs/dbraw/zinc/08/92/93/793089293.db2.gz ORRGIQCONMANGC-VXGBXAGGSA-N 0 3 363.484 -1.751 20 0 FAADHN CNC(=O)[C@H](C)N[C@@H]1CN(C(=O)CN(C)S(=O)(=O)N(C)C)C[C@H]1C ZINC001214612767 793089089 /nfs/dbraw/zinc/08/90/89/793089089.db2.gz PABPGRKTQGBCIR-GRYCIOLGSA-N 0 3 363.484 -1.704 20 0 FAADHN CNC(=O)[C@@H](C)N[C@@H]1CN(C(=O)CN(C)S(=O)(=O)N(C)C)C[C@H]1C ZINC001214612768 793088732 /nfs/dbraw/zinc/08/87/32/793088732.db2.gz PABPGRKTQGBCIR-IJLUTSLNSA-N 0 3 363.484 -1.704 20 0 FAADHN CCNC(=O)CN[C@@H]1CN(C(=O)CN(C)S(=O)(=O)N(C)C)C[C@H]1C ZINC001214619383 793089273 /nfs/dbraw/zinc/08/92/73/793089273.db2.gz DNFJXFUBTPVIIK-VXGBXAGGSA-N 0 3 363.484 -1.703 20 0 FAADHN CNS(=O)(=O)CCC(=O)N1C[C@@H](C)[C@H](N[C@@H](C)C(=O)NC(N)=O)C1 ZINC001214619657 793088789 /nfs/dbraw/zinc/08/87/89/793088789.db2.gz RQXLQZZMDBKWRO-KXUCPTDWSA-N 0 3 363.440 -2.054 20 0 FAADHN CNS(=O)(=O)CCC(=O)N1C[C@@H](C)[C@H](N[C@H](C)C(=O)NC(N)=O)C1 ZINC001214619658 793088859 /nfs/dbraw/zinc/08/88/59/793088859.db2.gz RQXLQZZMDBKWRO-OPRDCNLKSA-N 0 3 363.440 -2.054 20 0 FAADHN CCN1CC[C@H](N[C@@H]2CN(C(=O)CCS(=O)(=O)NC)C[C@H]2C)C1=O ZINC001214619717 793088602 /nfs/dbraw/zinc/08/86/02/793088602.db2.gz VAHWDMMRJLJEPA-FRRDWIJNSA-N 0 3 360.480 -1.017 20 0 FAADHN CCN1CC[C@@H](N[C@@H]2CN(C(=O)CCS(=O)(=O)NC)C[C@H]2C)C1=O ZINC001214619718 793089321 /nfs/dbraw/zinc/08/93/21/793089321.db2.gz VAHWDMMRJLJEPA-JHJVBQTASA-N 0 3 360.480 -1.017 20 0 FAADHN C[C@@H](CC(=O)N1C[C@@H](C)[C@H](NCC(=O)N2CCOCC2)C1)NC(N)=O ZINC001214623751 793088950 /nfs/dbraw/zinc/08/89/50/793088950.db2.gz IVDXFERQZJMCSQ-FRRDWIJNSA-N 0 3 355.439 -1.271 20 0 FAADHN C[C@H](CC(=O)N1C[C@@H](C)[C@H](NCC(=O)N2CCOCC2)C1)NC(N)=O ZINC001214623769 793089025 /nfs/dbraw/zinc/08/90/25/793089025.db2.gz IVDXFERQZJMCSQ-JHJVBQTASA-N 0 3 355.439 -1.271 20 0 FAADHN CCNC(=O)NC(=O)CN[C@@H]1CN(C(=O)C[C@@H](C)NC(N)=O)C[C@H]1C ZINC001214624500 793088829 /nfs/dbraw/zinc/08/88/29/793088829.db2.gz VRQCFAXZSYALRZ-GMTAPVOTSA-N 0 3 356.427 -1.285 20 0 FAADHN CCNC(=O)NC(=O)CN[C@@H]1CN(C(=O)C[C@H](C)NC(N)=O)C[C@H]1C 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ZINC001215296393 793107039 /nfs/dbraw/zinc/10/70/39/793107039.db2.gz DJISOJULRVBSQG-MWLCHTKSSA-N 0 3 352.395 -1.066 20 0 FAADHN C[C@@H]1CN(C(=O)CN2CCNC(=O)C2)C[C@H]1NCC(=O)NC(C)(C)C ZINC001215298701 793106573 /nfs/dbraw/zinc/10/65/73/793106573.db2.gz DFHIEOUKLWBNQN-CHWSQXEVSA-N 0 3 353.467 -1.231 20 0 FAADHN C[C@@H]1CN(C(=O)CN2CCNC(=O)C2)C[C@H]1NCC(=O)N(C)C1CC1 ZINC001215298707 793106508 /nfs/dbraw/zinc/10/65/08/793106508.db2.gz DNGFVUUPDFUMAC-TZMCWYRMSA-N 0 3 351.451 -1.525 20 0 FAADHN CNC(=O)NC(=O)CN[C@@H]1CN(C(=O)CN2CCNC(=O)C2)C[C@H]1C ZINC001215298744 793106729 /nfs/dbraw/zinc/10/67/29/793106729.db2.gz FSGXCGDWDUHSNX-GHMZBOCLSA-N 0 3 354.411 -2.690 20 0 FAADHN C[C@@H]1CN(C(=O)CN2CCNC(=O)C2)C[C@H]1NCC(=O)NCC1CC1 ZINC001215298843 793106306 /nfs/dbraw/zinc/10/63/06/793106306.db2.gz JZQVDSKITJOBME-TZMCWYRMSA-N 0 3 351.451 -1.619 20 0 FAADHN CC(C)N(C)C(=O)CN[C@@H]1CN(C(=O)CN2CCNC(=O)C2)C[C@H]1C ZINC001215298900 793107106 /nfs/dbraw/zinc/10/71/06/793107106.db2.gz 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C[C@H](N[C@@H]1CN(C(=O)CN2CCNC(=O)C2)C[C@H]1C)C(=O)NC(N)=O ZINC001215302975 793106876 /nfs/dbraw/zinc/10/68/76/793106876.db2.gz MLSPZTCKVDCFPI-OUAUKWLOSA-N 0 3 354.411 -2.562 20 0 FAADHN CCCNC(=O)[C@H](C)N[C@@H]1CN(C(=O)CN2CCNC(=O)C2)C[C@H]1C ZINC001215302981 793106428 /nfs/dbraw/zinc/10/64/28/793106428.db2.gz MRTWZPGTBDKYRU-HZSPNIEDSA-N 0 3 353.467 -1.231 20 0 FAADHN CCCNC(=O)[C@@H](C)N[C@@H]1CN(C(=O)CN2CCNC(=O)C2)C[C@H]1C ZINC001215302982 793106805 /nfs/dbraw/zinc/10/68/05/793106805.db2.gz MRTWZPGTBDKYRU-MGPQQGTHSA-N 0 3 353.467 -1.231 20 0 FAADHN C[C@H](N[C@@H]1CN(C(=O)CN2CCNC(=O)C2)C[C@H]1C)C(=O)NC1CC1 ZINC001215303017 793106631 /nfs/dbraw/zinc/10/66/31/793106631.db2.gz NHVVLZYAGFGPNO-MBNYWOFBSA-N 0 3 351.451 -1.478 20 0 FAADHN C[C@@H](N[C@@H]1CN(C(=O)CN2CCNC(=O)C2)C[C@H]1C)C(=O)NC1CC1 ZINC001215303019 793107082 /nfs/dbraw/zinc/10/70/82/793107082.db2.gz NHVVLZYAGFGPNO-YRGRVCCFSA-N 0 3 351.451 -1.478 20 0 FAADHN CC(C)CNC(=O)CN[C@@H]1CN(C(=O)CN2CCNC(=O)C2)C[C@H]1C ZINC001215303228 793106850 /nfs/dbraw/zinc/10/68/50/793106850.db2.gz RPUSPZSNMGEALY-ZIAGYGMSSA-N 0 3 353.467 -1.373 20 0 FAADHN CCNC(=O)NC(=O)CN[C@@H]1CN(C(=O)[C@H]2CN(C)C(=O)N2)C[C@H]1C ZINC001215309004 793106895 /nfs/dbraw/zinc/10/68/95/793106895.db2.gz BDONWHUOJNIOHQ-GMTAPVOTSA-N 0 3 354.411 -1.708 20 0 FAADHN CCNC(=O)NC(=O)CN[C@@H]1CN(C(=O)[C@@H]2CN(C)C(=O)N2)C[C@H]1C ZINC001215309006 793106764 /nfs/dbraw/zinc/10/67/64/793106764.db2.gz BDONWHUOJNIOHQ-MXWKQRLJSA-N 0 3 354.411 -1.708 20 0 FAADHN CCOCCNC(=O)CN[C@@H]1CN(C(=O)[C@H]2CN(C)C(=O)N2)C[C@H]1C ZINC001215309216 793107138 /nfs/dbraw/zinc/10/71/38/793107138.db2.gz FCVDTYNYHAWTBA-JHJVBQTASA-N 0 3 355.439 -1.401 20 0 FAADHN CCOCCNC(=O)CN[C@@H]1CN(C(=O)[C@@H]2CN(C)C(=O)N2)C[C@H]1C ZINC001215309217 793106784 /nfs/dbraw/zinc/10/67/84/793106784.db2.gz FCVDTYNYHAWTBA-UPJWGTAASA-N 0 3 355.439 -1.401 20 0 FAADHN COCCCNC(=O)CN[C@@H]1CN(C(=O)[C@H]2CN(C)C(=O)N2)C[C@H]1C ZINC001215309546 793107665 /nfs/dbraw/zinc/10/76/65/793107665.db2.gz 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C[C@H](CC(N)=O)C(=O)N1C[C@@H](C)[C@H](NCC(=O)NC(=O)NC2CC2)C1 ZINC001215317018 793107816 /nfs/dbraw/zinc/10/78/16/793107816.db2.gz TWTJJTXGELKWOT-CKYFFXLPSA-N 0 3 353.423 -1.077 20 0 FAADHN C[C@@H](CC(N)=O)C(=O)N1C[C@@H](C)[C@H](NCC(=O)NC(=O)NC2CC2)C1 ZINC001215317019 793107711 /nfs/dbraw/zinc/10/77/11/793107711.db2.gz TWTJJTXGELKWOT-HOSYDEDBSA-N 0 3 353.423 -1.077 20 0 FAADHN CCCNC(=O)NC(=O)CN[C@@H]1CN(C(=O)[C@H]2CCNC2=O)C[C@H]1C ZINC001215317028 793107692 /nfs/dbraw/zinc/10/76/92/793107692.db2.gz UFDMJGGXNCHKRJ-GRYCIOLGSA-N 0 3 353.423 -1.205 20 0 FAADHN CCCNC(=O)NC(=O)CN[C@@H]1CN(C(=O)[C@@H]2CCNC2=O)C[C@H]1C ZINC001215317029 793107755 /nfs/dbraw/zinc/10/77/55/793107755.db2.gz UFDMJGGXNCHKRJ-IJLUTSLNSA-N 0 3 353.423 -1.205 20 0 FAADHN C[C@@H]1CN(C(=O)[C@H]2CCNC2=O)C[C@H]1NCC(=O)NC(=O)NC1CC1 ZINC001215317098 793107913 /nfs/dbraw/zinc/10/79/13/793107913.db2.gz VYBWXVDWQSNPAH-ADEWGFFLSA-N 0 3 351.407 -1.453 20 0 FAADHN C[C@@H]1CN(C(=O)[C@@H]2CCNC2=O)C[C@H]1NCC(=O)NC(=O)NC1CC1 ZINC001215317102 793107856 /nfs/dbraw/zinc/10/78/56/793107856.db2.gz VYBWXVDWQSNPAH-YUSALJHKSA-N 0 3 351.407 -1.453 20 0 FAADHN CCCNC(=O)NC(=O)CN[C@@H]1CN(C(=O)c2nnn(C)n2)C[C@H]1C ZINC001215333783 793107585 /nfs/dbraw/zinc/10/75/85/793107585.db2.gz CDNGQTHFPWWXOF-NXEZZACHSA-N 0 3 352.399 -1.504 20 0 FAADHN CCNC(=O)NC(=O)[C@H](C)N[C@@H]1CN(C(=O)c2nnn(C)n2)C[C@H]1C ZINC001215334408 793107897 /nfs/dbraw/zinc/10/78/97/793107897.db2.gz LMOCVBRWPWIKAB-KXUCPTDWSA-N 0 3 352.399 -1.506 20 0 FAADHN CCNC(=O)NC(=O)[C@@H](C)N[C@@H]1CN(C(=O)c2nnn(C)n2)C[C@H]1C ZINC001215334409 793108227 /nfs/dbraw/zinc/10/82/27/793108227.db2.gz LMOCVBRWPWIKAB-OPRDCNLKSA-N 0 3 352.399 -1.506 20 0 FAADHN C[C@@H]1CN(C(=O)c2nnn(C)n2)C[C@H]1NCC(=O)NC[C@@H]1CCCO1 ZINC001215334650 793107531 /nfs/dbraw/zinc/10/75/31/793107531.db2.gz OKOGYAYGUXESEV-GRYCIOLGSA-N 0 3 351.411 -1.445 20 0 FAADHN C[C@@H]1CN(C(=O)c2nnn(C)n2)C[C@H]1NCC(=O)NC[C@H]1CCCO1 ZINC001215334652 793107745 /nfs/dbraw/zinc/10/77/45/793107745.db2.gz 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FAADHN CCCN(C)CC(=O)N[C@@H]1CN(CCCNS(=O)(=O)CC)C[C@@H]1O ZINC001220828567 793781944 /nfs/dbraw/zinc/78/19/44/793781944.db2.gz AHHCXYAOGCOCHI-KGLIPLIRSA-N 0 3 364.512 -1.181 20 0 FAADHN CCCN(C)CC(=O)N[C@@H]1CN(CC(=O)Nc2nncs2)C[C@@H]1O ZINC001220828568 793782033 /nfs/dbraw/zinc/78/20/33/793782033.db2.gz AJJKCCZBGWJNSN-MNOVXSKESA-N 0 3 356.452 -1.020 20 0 FAADHN CCCN(C)CC(=O)N[C@@H]1CN(CCN(C)S(C)(=O)=O)C[C@@H]1O ZINC001220828591 793782557 /nfs/dbraw/zinc/78/25/57/793782557.db2.gz BGNIYFRJARUFMZ-OLZOCXBDSA-N 0 3 350.485 -1.619 20 0 FAADHN CCCN(C)CC(=O)N[C@@H]1CN(CCN2CCCS2(=O)=O)C[C@@H]1O ZINC001220829402 793781896 /nfs/dbraw/zinc/78/18/96/793781896.db2.gz QOBUYSVYWXRBGI-KGLIPLIRSA-N 0 3 362.496 -1.475 20 0 FAADHN CCCN(C)CC(=O)N[C@@H]1CN(C[C@H](O)CN2CCCC2=O)C[C@@H]1O ZINC001220829631 793782507 /nfs/dbraw/zinc/78/25/07/793782507.db2.gz XTQBLVDMYSLOIZ-ZNMIVQPWSA-N 0 3 356.467 -1.527 20 0 FAADHN CCCN(C)CC(=O)N[C@@H]1CN(CCNS(=O)(=O)CC)C[C@@H]1O ZINC001220830636 793781680 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ZINC001220852368 793783682 /nfs/dbraw/zinc/78/36/82/793783682.db2.gz HKAHTCIQZKAIPC-KGLIPLIRSA-N 0 3 353.423 -1.425 20 0 FAADHN Cc1[nH]cnc1CC(=O)N[C@@H]1CN(CCN(C)S(C)(=O)=O)C[C@@H]1O ZINC001220852393 793783510 /nfs/dbraw/zinc/78/35/10/793783510.db2.gz IBKXZEYCHHCRNV-OLZOCXBDSA-N 0 3 359.452 -1.687 20 0 FAADHN CCNC(=O)NC(=O)CN1C[C@@H](NC(=O)Cc2nc[nH]c2C)[C@@H](O)C1 ZINC001220852473 793783410 /nfs/dbraw/zinc/78/34/10/793783410.db2.gz LDFKQCGHHDTDRJ-NEPJUHHUSA-N 0 3 352.395 -1.732 20 0 FAADHN COCCCNC(=O)CN1C[C@@H](NC(=O)Cc2nc[nH]c2C)[C@@H](O)C1 ZINC001220852620 793783698 /nfs/dbraw/zinc/78/36/98/793783698.db2.gz PSFWGGXUORTPLC-KGLIPLIRSA-N 0 3 353.423 -1.425 20 0 FAADHN CCCCS(=O)(=O)NCC(=O)N[C@@H]1CN(CCCOC)C[C@@H]1O ZINC001220862712 793786402 /nfs/dbraw/zinc/78/64/02/793786402.db2.gz QXWWOINYJNPBIF-OLZOCXBDSA-N 0 3 351.469 -1.096 20 0 FAADHN N[C@@H](Cc1nn[n-]n1)C(=O)n1cc(Br)ccc1=NCC[NH3+] ZINC001220871138 793787780 /nfs/dbraw/zinc/78/77/80/793787780.db2.gz USKHTCZKFRCZPR-QMMMGPOBSA-N 0 3 355.200 -1.167 20 0 FAADHN N[C@@H](Cc1nnn[n-]1)C(=O)n1cc(Br)ccc1=NCC[NH3+] ZINC001220871138 793787772 /nfs/dbraw/zinc/78/77/72/793787772.db2.gz USKHTCZKFRCZPR-QMMMGPOBSA-N 0 3 355.200 -1.167 20 0 FAADHN [NH3+][C@@H](CCCC[N-]C(=O)C(F)(F)F)C(=O)NCCN1CCNCC1=O ZINC001220875143 793788019 /nfs/dbraw/zinc/78/80/19/793788019.db2.gz USUSCUYNPAESEW-JTQLQIEISA-N 0 3 367.372 -1.290 20 0 FAADHN N[C@H]1CCCCN(CC(=O)NCCOCCN2C(=O)C=CC2=O)C1=O ZINC001220878419 793788616 /nfs/dbraw/zinc/78/86/16/793788616.db2.gz CHLZHBDMUMPPKJ-LBPRGKRZSA-N 0 3 352.391 -1.616 20 0 FAADHN CC[C@H](C)[C@H](N)C(=O)NCC(=O)NCCOCCN1C(=O)C=CC1=O ZINC001220878950 793789033 /nfs/dbraw/zinc/78/90/33/793789033.db2.gz XSAGCUKQFQMZOL-NHYWBVRUSA-N 0 3 354.407 -1.466 20 0 FAADHN COCCCCCN1C[C@@H](NC(=O)Cn2nc(C)n(C)c2=O)[C@@H](O)C1 ZINC001220879102 793789451 /nfs/dbraw/zinc/78/94/51/793789451.db2.gz FPDNPXNCCNMJDW-KGLIPLIRSA-N 0 3 355.439 -1.132 20 0 FAADHN CCOCCCN1C[C@@H](NC(=O)CN2C(=O)NC(C)(C)C2=O)[C@@H](O)C1 ZINC001220904582 793793614 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/nfs/dbraw/zinc/83/57/94/793835794.db2.gz GPULAOYUUNLGFU-OLZOCXBDSA-N 0 3 355.439 -1.524 20 0 FAADHN CC(C)N(C)CC(=O)N[C@@H]1CN(CC(=O)N2CCNC(=O)C2)C[C@@H]1O ZINC001221093282 793834850 /nfs/dbraw/zinc/83/48/50/793834850.db2.gz HQEUPJRYHNTEKL-OLZOCXBDSA-N 0 3 355.439 -2.554 20 0 FAADHN CC(C)N(C)CC(=O)N[C@@H]1CN(CC(=O)Nc2cnccn2)C[C@@H]1O ZINC001221093286 793834595 /nfs/dbraw/zinc/83/45/95/793834595.db2.gz HRKWZKMFSPHBPO-OLZOCXBDSA-N 0 3 350.423 -1.083 20 0 FAADHN CC(C)N(C)CC(=O)N[C@@H]1CN(CCN2CCCS2(=O)=O)C[C@@H]1O ZINC001221093371 793834795 /nfs/dbraw/zinc/83/47/95/793834795.db2.gz KAHFICZVWYEEER-KGLIPLIRSA-N 0 3 362.496 -1.477 20 0 FAADHN CC(C)N(C)CC(=O)N[C@@H]1CN(CC(=O)NC[C@H]2CCCO2)C[C@@H]1O ZINC001221093529 793834665 /nfs/dbraw/zinc/83/46/65/793834665.db2.gz PKHJEXMERAXYAS-KFWWJZLASA-N 0 3 356.467 -1.217 20 0 FAADHN CC(C)N(C)CC(=O)N[C@@H]1CN(CC(=O)NC[C@@H]2CCCO2)C[C@@H]1O ZINC001221093530 793834724 /nfs/dbraw/zinc/83/47/24/793834724.db2.gz PKHJEXMERAXYAS-ZNMIVQPWSA-N 0 3 356.467 -1.217 20 0 FAADHN CC(C)N(C)CC(=O)N[C@@H]1CN(Cc2nnc3n2CCOC3)C[C@@H]1O ZINC001221093596 793835650 /nfs/dbraw/zinc/83/56/50/793835650.db2.gz REQYHGSEWRYULE-OLZOCXBDSA-N 0 3 352.439 -1.190 20 0 FAADHN CCCNC(=O)NC(=O)CN1C[C@@H](NC(=O)CN(C)C(C)C)[C@@H](O)C1 ZINC001221093805 793835162 /nfs/dbraw/zinc/83/51/62/793835162.db2.gz XWZHVQPEOOJBAN-OLZOCXBDSA-N 0 3 357.455 -1.276 20 0 FAADHN CC(C)[C@@H](C(=O)N[C@@H]1CN(Cc2nnn(C)n2)C[C@@H]1O)N1CCCC1 ZINC001221095944 793834458 /nfs/dbraw/zinc/83/44/58/793834458.db2.gz KGRGBQHSAWOLCJ-IPYPFGDCSA-N 0 3 351.455 -1.008 20 0 FAADHN CC(C)[C@H](C(=O)N[C@@H]1CN(Cc2nnn(C)n2)C[C@@H]1O)N1CCCC1 ZINC001221095945 793834981 /nfs/dbraw/zinc/83/49/81/793834981.db2.gz KGRGBQHSAWOLCJ-VNHYZAJKSA-N 0 3 351.455 -1.008 20 0 FAADHN CC(C)[C@@H](C(=O)N[C@@H]1CN(Cc2nnnn2C)C[C@@H]1O)N1CCCC1 ZINC001221096181 793834824 /nfs/dbraw/zinc/83/48/24/793834824.db2.gz OIAYKSDVLHKOBM-IPYPFGDCSA-N 0 3 351.455 -1.008 20 0 FAADHN CC(C)[C@H](C(=O)N[C@@H]1CN(Cc2nnnn2C)C[C@@H]1O)N1CCCC1 ZINC001221096182 793835219 /nfs/dbraw/zinc/83/52/19/793835219.db2.gz OIAYKSDVLHKOBM-VNHYZAJKSA-N 0 3 351.455 -1.008 20 0 FAADHN C[C@H](N)C(=O)N[C@@H](CC(N)=O)C(=O)NCc1ccn(CC(F)(F)F)n1 ZINC001221107721 793839096 /nfs/dbraw/zinc/83/90/96/793839096.db2.gz IMHXOZZTDBJJKW-CBAPKCEASA-N 0 3 364.328 -1.231 20 0 FAADHN C[C@H](N)C(=O)N[C@@H](CC(N)=O)C(=O)NCc1cn(CC(F)(F)F)cn1 ZINC001221146647 793840878 /nfs/dbraw/zinc/84/08/78/793840878.db2.gz NFFNWBCKAREBIR-CBAPKCEASA-N 0 3 364.328 -1.231 20 0 FAADHN O=C(NCc1cc(N2CCS(=O)(=O)CC2)ccn1)[C@@H]1COCCN1 ZINC001221148646 793841250 /nfs/dbraw/zinc/84/12/50/793841250.db2.gz JRJQQHOFYFHVLG-AWEZNQCLSA-N 0 3 354.432 -1.079 20 0 FAADHN CC(=O)OC[C@H](N)C(=O)NCc1cc(N2CCS(=O)(=O)CC2)ccn1 ZINC001221148651 793841020 /nfs/dbraw/zinc/84/10/20/793841020.db2.gz JUKUTXAJFLIXFQ-AWEZNQCLSA-N 0 3 370.431 -1.177 20 0 FAADHN CC(C)(C)N1CC(NC(=O)CNC(=O)CNC(=O)CNC(=O)CN)C1 ZINC001221194236 793850915 /nfs/dbraw/zinc/85/09/15/793850915.db2.gz NTKZGUZBFCATNW-UHFFFAOYSA-N 0 3 356.427 -3.107 20 0 FAADHN COC(=O)[C@](C)(NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)N)C(F)(F)F ZINC001221221099 793852433 /nfs/dbraw/zinc/85/24/33/793852433.db2.gz BWEVGHCCPFJICK-BVMVBECYSA-N 0 3 356.301 -1.696 20 0 FAADHN COC(=O)[C@@](C)(NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)N)C(F)(F)F ZINC001221221100 793852930 /nfs/dbraw/zinc/85/29/30/793852930.db2.gz BWEVGHCCPFJICK-ZJXQECPTSA-N 0 3 356.301 -1.696 20 0 FAADHN COCCOC[C@@H](O)CN1CC[C@@H]2CN(C(=O)Cn3cnnn3)[C@@H]2C1 ZINC001221253419 793853573 /nfs/dbraw/zinc/85/35/73/793853573.db2.gz POKBQWQEZGHPRV-HZSPNIEDSA-N 0 3 354.411 -1.770 20 0 FAADHN COCCOC[C@H](O)CN1CC[C@@H]2CN(C(=O)Cn3cnnn3)[C@@H]2C1 ZINC001221253420 793854017 /nfs/dbraw/zinc/85/40/17/793854017.db2.gz POKBQWQEZGHPRV-MGPQQGTHSA-N 0 3 354.411 -1.770 20 0 FAADHN CC(=O)OCN1CCC(NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)N)CC1 ZINC001221259257 793855098 /nfs/dbraw/zinc/85/50/98/793855098.db2.gz XUKMBABQQPKGOY-CABZTGNLSA-N 0 3 357.411 -2.205 20 0 FAADHN COc1ccc(CSC[C@H](N)C(=O)N2CN[C@H](N)[C@@H]3NCN[C@H]32)cc1 ZINC001221266161 793855975 /nfs/dbraw/zinc/85/59/75/793855975.db2.gz SXTKONMPLTUTNU-AJNGGQMLSA-N 0 3 366.491 -1.225 20 0 FAADHN COc1ccc(CSC[C@H](N)C(=O)N2CN[C@H](N)[C@H]3NCN[C@@H]32)cc1 ZINC001221266163 793855813 /nfs/dbraw/zinc/85/58/13/793855813.db2.gz SXTKONMPLTUTNU-LJISPDSOSA-N 0 3 366.491 -1.225 20 0 FAADHN COc1ccc(CSC[C@H](N)C(=O)N2CN[C@H](N)[C@H]3NCN[C@H]32)cc1 ZINC001221266164 793856149 /nfs/dbraw/zinc/85/61/49/793856149.db2.gz SXTKONMPLTUTNU-XGUBFFRZSA-N 0 3 366.491 -1.225 20 0 FAADHN COc1ccc(CSC[C@H](N)C(=O)N2CN[C@H](N)[C@@H]3NCN[C@@H]32)cc1 ZINC001221266166 793855159 /nfs/dbraw/zinc/85/51/59/793855159.db2.gz SXTKONMPLTUTNU-ZQDZILKHSA-N 0 3 366.491 -1.225 20 0 FAADHN C[C@H](N)C(=O)N[C@@H](CC(N)=O)C(=O)NCCNC(=O)c1cccs1 ZINC001221309066 793856659 /nfs/dbraw/zinc/85/66/59/793856659.db2.gz GOJYHTPMEWBRFH-IUCAKERBSA-N 0 3 355.420 -1.699 20 0 FAADHN COCCOC[C@@H](O)CN1CC[C@@H]2CN(C(=O)CNC(=O)OC)[C@@H]2C1 ZINC001221334116 793857287 /nfs/dbraw/zinc/85/72/87/793857287.db2.gz DPJAIESVEITPNF-HZSPNIEDSA-N 0 3 359.423 -1.101 20 0 FAADHN COCCOC[C@H](O)CN1CC[C@@H]2CN(C(=O)CNC(=O)OC)[C@@H]2C1 ZINC001221334117 793856891 /nfs/dbraw/zinc/85/68/91/793856891.db2.gz DPJAIESVEITPNF-MGPQQGTHSA-N 0 3 359.423 -1.101 20 0 FAADHN C[C@H](N)C(=O)N1[C@H](C(=O)NCCN2CCCS2(=O)=O)COC1(C)C ZINC001221337566 793857568 /nfs/dbraw/zinc/85/75/68/793857568.db2.gz SDCBNBAUBSEKKU-QWRGUYRKSA-N 0 3 362.452 -1.551 20 0 FAADHN COC(=O)C12CCC(NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)N)(CC1)C2 ZINC001221365320 793858500 /nfs/dbraw/zinc/85/85/00/793858500.db2.gz BSSALRKWQCSKIK-IJSSPPKGSA-N 0 3 354.407 -1.314 20 0 FAADHN Cn1ncc(NC(=O)[C@H]2COC3(CNC3)CN2)c(Br)c1=O ZINC001221402050 793858632 /nfs/dbraw/zinc/85/86/32/793858632.db2.gz TYOGKLZMFKSNFJ-MRVPVSSYSA-N 0 3 358.196 -1.188 20 0 FAADHN Cn1ncc(NC(=O)[C@@H]2COC3(CNC3)CN2)c(Br)c1=O ZINC001221402051 793857881 /nfs/dbraw/zinc/85/78/81/793857881.db2.gz TYOGKLZMFKSNFJ-QMMMGPOBSA-N 0 3 358.196 -1.188 20 0 FAADHN NC(=O)CC(=O)N1C[C@H]2CCN(C[C@@H](O)COC3CCOCC3)C[C@H]21 ZINC001221458881 793859595 /nfs/dbraw/zinc/85/95/95/793859595.db2.gz XTMKYKVMKLXCPJ-UMVBOHGHSA-N 0 3 355.435 -1.049 20 0 FAADHN NC(=O)CC(=O)N1C[C@H]2CCN(C[C@H](O)COC3CCOCC3)C[C@H]21 ZINC001221458882 793860200 /nfs/dbraw/zinc/86/02/00/793860200.db2.gz XTMKYKVMKLXCPJ-VNHYZAJKSA-N 0 3 355.435 -1.049 20 0 FAADHN CNC(=O)CC(=O)N1C[C@H]2CCN(CCCN3C(=O)CNC3=O)C[C@H]21 ZINC001221507853 793860710 /nfs/dbraw/zinc/86/07/10/793860710.db2.gz VHUBLZMVVWUIEG-VXGBXAGGSA-N 0 3 351.407 -1.403 20 0 FAADHN COCCOC[C@@H](O)CN1CC[C@@H]2CN(C(=O)Cn3ncnn3)[C@@H]2C1 ZINC001221554317 793864347 /nfs/dbraw/zinc/86/43/47/793864347.db2.gz NIHIDGIWQSWMRB-HZSPNIEDSA-N 0 3 354.411 -1.770 20 0 FAADHN COCCOC[C@H](O)CN1CC[C@@H]2CN(C(=O)Cn3ncnn3)[C@@H]2C1 ZINC001221554318 793863895 /nfs/dbraw/zinc/86/38/95/793863895.db2.gz NIHIDGIWQSWMRB-MGPQQGTHSA-N 0 3 354.411 -1.770 20 0 FAADHN COC[C@@H](O)CN1CC[C@@H]2CN(C(=O)Cn3cnc(C(N)=O)n3)[C@@H]2C1 ZINC001221560914 793864917 /nfs/dbraw/zinc/86/49/17/793864917.db2.gz OYXGXHIOPDMBDM-GRYCIOLGSA-N 0 3 352.395 -2.083 20 0 FAADHN COC[C@H](O)CN1CC[C@@H]2CN(C(=O)Cn3cnc(C(N)=O)n3)[C@@H]2C1 ZINC001221560915 793864979 /nfs/dbraw/zinc/86/49/79/793864979.db2.gz OYXGXHIOPDMBDM-IJLUTSLNSA-N 0 3 352.395 -2.083 20 0 FAADHN COCCOC[C@@H](O)CN1CC[C@@H]2CN(C(=O)Cn3nccn3)[C@@H]2C1 ZINC001221576686 793866309 /nfs/dbraw/zinc/86/63/09/793866309.db2.gz KFTWVZIHNOYABS-QLFBSQMISA-N 0 3 353.423 -1.165 20 0 FAADHN COCCOC[C@H](O)CN1CC[C@@H]2CN(C(=O)Cn3nccn3)[C@@H]2C1 ZINC001221576687 793866039 /nfs/dbraw/zinc/86/60/39/793866039.db2.gz KFTWVZIHNOYABS-RBSFLKMASA-N 0 3 353.423 -1.165 20 0 FAADHN COC[C@@H](O)CN1CC[C@@H]2CN(C(=O)CN3CCCS3(=O)=O)[C@@H]2C1 ZINC001221595296 793870115 /nfs/dbraw/zinc/87/01/15/793870115.db2.gz BDWATZIUBOMVAA-HZSPNIEDSA-N 0 3 361.464 -1.438 20 0 FAADHN COC[C@H](O)CN1CC[C@@H]2CN(C(=O)CN3CCCS3(=O)=O)[C@@H]2C1 ZINC001221595297 793869401 /nfs/dbraw/zinc/86/94/01/793869401.db2.gz BDWATZIUBOMVAA-MGPQQGTHSA-N 0 3 361.464 -1.438 20 0 FAADHN CNC(=O)NCC(=O)N1C[C@H]2CCN(C[C@H](O)Cn3cccn3)C[C@H]21 ZINC001221595465 793870189 /nfs/dbraw/zinc/87/01/89/793870189.db2.gz JVDONLGDEHPBRL-HZSPNIEDSA-N 0 3 350.423 -1.294 20 0 FAADHN CNC(=O)NCC(=O)N1C[C@H]2CCN(C[C@@H](O)Cn3cccn3)C[C@H]21 ZINC001221595466 793870499 /nfs/dbraw/zinc/87/04/99/793870499.db2.gz JVDONLGDEHPBRL-MGPQQGTHSA-N 0 3 350.423 -1.294 20 0 FAADHN CNC(=O)NCC(=O)N1C[C@H]2CCN(C[C@H](O)COCCOC)C[C@H]21 ZINC001221598889 793869853 /nfs/dbraw/zinc/86/98/53/793869853.db2.gz YLILJZFUPCCMIR-HZSPNIEDSA-N 0 3 358.439 -1.528 20 0 FAADHN CNC(=O)NCC(=O)N1C[C@H]2CCN(C[C@@H](O)COCCOC)C[C@H]21 ZINC001221598890 793870159 /nfs/dbraw/zinc/87/01/59/793870159.db2.gz YLILJZFUPCCMIR-MGPQQGTHSA-N 0 3 358.439 -1.528 20 0 FAADHN COC(=O)C1(O)CN(C(=O)NCCCN2CCC[C@@H]2C(=O)N(C)C)C1 ZINC001221638966 793871324 /nfs/dbraw/zinc/87/13/24/793871324.db2.gz KEAYBUCWFJFNIP-GFCCVEGCSA-N 0 3 356.423 -1.142 20 0 FAADHN COC(=O)C1(O)CN(C(=O)NCCCN2CCC[C@H]2C(=O)N(C)C)C1 ZINC001221638974 793871661 /nfs/dbraw/zinc/87/16/61/793871661.db2.gz KEAYBUCWFJFNIP-LBPRGKRZSA-N 0 3 356.423 -1.142 20 0 FAADHN COC[C@@H](O)CN1CC[C@@H]2CN(C(=O)CNC(=O)CNC(C)=O)[C@@H]2C1 ZINC001221654182 793872792 /nfs/dbraw/zinc/87/27/92/793872792.db2.gz CZQKFPVAXDGAEF-HZSPNIEDSA-N 0 3 356.423 -2.221 20 0 FAADHN COC[C@H](O)CN1CC[C@@H]2CN(C(=O)CNC(=O)CNC(C)=O)[C@@H]2C1 ZINC001221654183 793872057 /nfs/dbraw/zinc/87/20/57/793872057.db2.gz CZQKFPVAXDGAEF-MGPQQGTHSA-N 0 3 356.423 -2.221 20 0 FAADHN CC(=O)NCC(=O)NCC(=O)N1C[C@H]2CCN(CCC[C@@H](C)O)C[C@H]21 ZINC001221654842 793872207 /nfs/dbraw/zinc/87/22/07/793872207.db2.gz UUDZCUIIZIIMNJ-BPLDGKMQSA-N 0 3 354.451 -1.068 20 0 FAADHN CC(=O)NCC(=O)NCC(=O)N1C[C@H]2CCN(CCC[C@H](C)O)C[C@H]21 ZINC001221654843 793872862 /nfs/dbraw/zinc/87/28/62/793872862.db2.gz UUDZCUIIZIIMNJ-NWANDNLSSA-N 0 3 354.451 -1.068 20 0 FAADHN COC[C@@H](O)CN1CC[C@@H]2CN(C(=O)CN3CCN(C)C(=O)C3)[C@@H]2C1 ZINC001221658953 793872086 /nfs/dbraw/zinc/87/20/86/793872086.db2.gz CHKFYTSSGQBAEQ-QLFBSQMISA-N 0 3 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ZINC001222024746 793891428 /nfs/dbraw/zinc/89/14/28/793891428.db2.gz SVTGUFIIJXQRJJ-MGPQQGTHSA-N 0 3 371.463 -1.674 20 0 FAADHN COC[C@@H](O)CN1CC[C@@H]2CN(C(=O)CCS(=O)(=O)N(C)C)[C@@H]2C1 ZINC001222043065 793891827 /nfs/dbraw/zinc/89/18/27/793891827.db2.gz ULUGGKXMEILZQQ-HZSPNIEDSA-N 0 3 363.480 -1.192 20 0 FAADHN COC[C@H](O)CN1CC[C@@H]2CN(C(=O)CCS(=O)(=O)N(C)C)[C@@H]2C1 ZINC001222043066 793892555 /nfs/dbraw/zinc/89/25/55/793892555.db2.gz ULUGGKXMEILZQQ-MGPQQGTHSA-N 0 3 363.480 -1.192 20 0 FAADHN CO[C@@H](C)CN1CC[C@@H]2CN(C(=O)CNC(=O)Cn3cncn3)[C@@H]2C1 ZINC001222043995 793891878 /nfs/dbraw/zinc/89/18/78/793891878.db2.gz KXELBBAQAPSSBW-BFHYXJOUSA-N 0 3 350.423 -1.038 20 0 FAADHN CO[C@H](C)CN1CC[C@@H]2CN(C(=O)CNC(=O)Cn3cncn3)[C@@H]2C1 ZINC001222043996 793892611 /nfs/dbraw/zinc/89/26/11/793892611.db2.gz KXELBBAQAPSSBW-MGPQQGTHSA-N 0 3 350.423 -1.038 20 0 FAADHN CCOCCN1CC[C@@H]2CN(C(=O)CNC(=O)Cn3cncn3)[C@@H]2C1 ZINC001222044196 793892437 /nfs/dbraw/zinc/89/24/37/793892437.db2.gz RVWZLJYJWWOYKB-ZIAGYGMSSA-N 0 3 350.423 -1.037 20 0 FAADHN COC[C@H](C)N1CC[C@@H]2CN(C(=O)CNC(=O)Cn3cncn3)[C@@H]2C1 ZINC001222044293 793892054 /nfs/dbraw/zinc/89/20/54/793892054.db2.gz WNSOHUBEHPQKKB-BFHYXJOUSA-N 0 3 350.423 -1.038 20 0 FAADHN COC[C@@H](C)N1CC[C@@H]2CN(C(=O)CNC(=O)Cn3cncn3)[C@@H]2C1 ZINC001222044294 793892396 /nfs/dbraw/zinc/89/23/96/793892396.db2.gz WNSOHUBEHPQKKB-MGPQQGTHSA-N 0 3 350.423 -1.038 20 0 FAADHN CC(=O)NCC(=O)N1CC[C@H]2CCN(CCN3C(=O)CNC3=O)[C@H]2C1 ZINC001222205459 793893226 /nfs/dbraw/zinc/89/32/26/793893226.db2.gz ISHGKAXRHTURJZ-OLZOCXBDSA-N 0 3 351.407 -1.403 20 0 FAADHN NC(=O)NCC(=O)N1CC[C@H]2CCN(CCN3C(=O)CCC3=O)[C@H]2C1 ZINC001222229448 793893177 /nfs/dbraw/zinc/89/31/77/793893177.db2.gz DVNSNTFEDZSZCR-NEPJUHHUSA-N 0 3 351.407 -1.274 20 0 FAADHN NC(=O)NCC(=O)N1CC[C@H]2CCN(CCN3C(=O)CNC3=O)[C@H]2C1 ZINC001222257749 793894001 /nfs/dbraw/zinc/89/40/01/793894001.db2.gz WPRRIJZZKZWRCS-MNOVXSKESA-N 0 3 352.395 -1.871 20 0 FAADHN CNC(=O)CC(=O)N1CC[C@H]2CCN(CCN3C(=O)CNC3=O)[C@H]2C1 ZINC001222589031 793896599 /nfs/dbraw/zinc/89/65/99/793896599.db2.gz FELSHGJOVRVFIY-NEPJUHHUSA-N 0 3 351.407 -1.403 20 0 FAADHN C[C@H](NC(N)=O)C(=O)N1CC[C@H]2CCN(CCN3CCNC3=O)[C@H]2C1 ZINC001222594239 793896450 /nfs/dbraw/zinc/89/64/50/793896450.db2.gz LKAWZSBJDMSJBP-XQQFMLRXSA-N 0 3 352.439 -1.009 20 0 FAADHN CNC(=O)NCC(=O)N1CC[C@H]2CCN(CCN3CCNC3=O)[C@H]2C1 ZINC001222839628 793897708 /nfs/dbraw/zinc/89/77/08/793897708.db2.gz TXOKHSTUSWJFQR-OLZOCXBDSA-N 0 3 352.439 -1.137 20 0 FAADHN CNS(=O)(=O)NCC(=O)N1CC[C@H]2CCN(CCn3cncn3)[C@H]2C1 ZINC001223200872 793900710 /nfs/dbraw/zinc/90/07/10/793900710.db2.gz ULSLNBCCTCGTSP-OLZOCXBDSA-N 0 3 371.467 -1.745 20 0 FAADHN NC(=O)C(=O)N1CC[C@H]2CCN(C[C@H](O)COC3CCOCC3)[C@H]2C1 ZINC001223401647 793901806 /nfs/dbraw/zinc/90/18/06/793901806.db2.gz OKSYYJTWAWHDQI-IPYPFGDCSA-N 0 3 355.435 -1.049 20 0 FAADHN NC(=O)C(=O)N1CC[C@H]2CCN(C[C@@H](O)COC3CCOCC3)[C@H]2C1 ZINC001223401650 793901993 /nfs/dbraw/zinc/90/19/93/793901993.db2.gz OKSYYJTWAWHDQI-NFAWXSAZSA-N 0 3 355.435 -1.049 20 0 FAADHN NC(=O)[C@@H]1CC[C@H](C(=O)N2CC[C@H]3CCN(CCOCCO)[C@H]3C2)O1 ZINC001223499259 793901386 /nfs/dbraw/zinc/90/13/86/793901386.db2.gz FRHWGFHKISSAES-CBBWQLFWSA-N 0 3 355.435 -1.049 20 0 FAADHN C[C@@H]1CN(C)C[C@H](C(=O)NCC2CCN(CC(=O)NC(N)=O)CC2)O1 ZINC001223570377 793901362 /nfs/dbraw/zinc/90/13/62/793901362.db2.gz NCEYTVCRSCSZAL-DGCLKSJQSA-N 0 3 355.439 -1.271 20 0 FAADHN CN(C)S(=O)(=O)CC(=O)N1CC[C@H]2CCN(CCOCCO)[C@H]2C1 ZINC001224027538 793903470 /nfs/dbraw/zinc/90/34/70/793903470.db2.gz LGIQQNNKDWAPIF-KGLIPLIRSA-N 0 3 363.480 -1.191 20 0 FAADHN COC[C@H](O)CN1CC[C@@H]2CCN(C(=O)CS(=O)(=O)N(C)C)C[C@@H]21 ZINC001224036496 793903904 /nfs/dbraw/zinc/90/39/04/793903904.db2.gz HKNOPLYZIQDHFH-MCIONIFRSA-N 0 3 363.480 -1.192 20 0 FAADHN COC[C@@H](O)CN1CC[C@@H]2CCN(C(=O)CS(=O)(=O)N(C)C)C[C@@H]21 ZINC001224036502 793903406 /nfs/dbraw/zinc/90/34/06/793903406.db2.gz HKNOPLYZIQDHFH-RDBSUJKOSA-N 0 3 363.480 -1.192 20 0 FAADHN NC(=O)NCCC(=O)N1CC[C@H]2CCN(CCN3CCNC3=O)[C@H]2C1 ZINC001224101639 793904955 /nfs/dbraw/zinc/90/49/55/793904955.db2.gz AQFXWBNJLDTCNA-OLZOCXBDSA-N 0 3 352.439 -1.007 20 0 FAADHN CC(=O)NCC(=O)N[C@@H]1CCCC[C@H]1NCC(=O)N1CCNC(=O)C1 ZINC001224539967 793905647 /nfs/dbraw/zinc/90/56/47/793905647.db2.gz MSYQTXCRFPSCIQ-CHWSQXEVSA-N 0 3 353.423 -1.902 20 0 FAADHN CCOCCNC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)Cn1cnnn1 ZINC001224705511 793906971 /nfs/dbraw/zinc/90/69/71/793906971.db2.gz FICAXCSYSJYEDB-CHWSQXEVSA-N 0 3 353.427 -1.157 20 0 FAADHN COCCCNC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)Cn1cnnn1 ZINC001224705538 793906570 /nfs/dbraw/zinc/90/65/70/793906570.db2.gz GZIZKNAYTUZKHR-CHWSQXEVSA-N 0 3 353.427 -1.157 20 0 FAADHN CCNC(=O)NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)Cn1cnnn1 ZINC001224705884 793907008 /nfs/dbraw/zinc/90/70/08/793907008.db2.gz MUMCIVACLGODSJ-GHMZBOCLSA-N 0 3 352.399 -1.464 20 0 FAADHN NC(=O)NCC(=O)N[C@@H]1CCCC[C@H]1NCC(=O)NC1CCOCC1 ZINC001224725396 793906768 /nfs/dbraw/zinc/90/67/68/793906768.db2.gz SJUWSOHYWOHRIF-CHWSQXEVSA-N 0 3 355.439 -1.033 20 0 FAADHN NC(=O)NCC(=O)N[C@@H]1CCCC[C@H]1NCC(=O)NC(=O)NC1CC1 ZINC001224732458 793906691 /nfs/dbraw/zinc/90/66/91/793906691.db2.gz OLGRHSDABZCKGF-GHMZBOCLSA-N 0 3 354.411 -1.340 20 0 FAADHN CCCNC(=O)NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)CNC(N)=O ZINC001224732559 793907022 /nfs/dbraw/zinc/90/70/22/793907022.db2.gz PMQXCDCXPIEXAL-GHMZBOCLSA-N 0 3 356.427 -1.093 20 0 FAADHN NC(=O)NCC(=O)N[C@@H]1CCCC[C@H]1NCC(=O)N1CCNC(=O)C1 ZINC001224732618 793906798 /nfs/dbraw/zinc/90/67/98/793906798.db2.gz RLAUCQGIIVKCQT-GHMZBOCLSA-N 0 3 354.411 -2.370 20 0 FAADHN NC(=O)NCC(=O)N[C@@H]1CCCC[C@H]1NCC(=O)NC[C@H]1CCCO1 ZINC001224732811 793906961 /nfs/dbraw/zinc/90/69/61/793906961.db2.gz WSWYDVMETOHBNJ-JHJVBQTASA-N 0 3 355.439 -1.033 20 0 FAADHN NC(=O)NCC(=O)N[C@@H]1CCCC[C@H]1NCC(=O)NC[C@@H]1CCCO1 ZINC001224732812 793906988 /nfs/dbraw/zinc/90/69/88/793906988.db2.gz WSWYDVMETOHBNJ-YNEHKIRRSA-N 0 3 355.439 -1.033 20 0 FAADHN NC(=O)NCC(=O)N[C@@H]1CCCC[C@H]1NCC(=O)NC[C@H]1CCOC1 ZINC001224740498 793906936 /nfs/dbraw/zinc/90/69/36/793906936.db2.gz GJHBSSKQAISGQQ-JHJVBQTASA-N 0 3 355.439 -1.176 20 0 FAADHN NC(=O)NCC(=O)N[C@@H]1CCCC[C@H]1NCC(=O)NC[C@@H]1CCOC1 ZINC001224740499 793906784 /nfs/dbraw/zinc/90/67/84/793906784.db2.gz GJHBSSKQAISGQQ-YNEHKIRRSA-N 0 3 355.439 -1.176 20 0 FAADHN CNC(=O)NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)CNC(=O)C1CC1 ZINC001225050114 793907806 /nfs/dbraw/zinc/90/78/06/793907806.db2.gz XBUWYHPFTHVOLG-VXGBXAGGSA-N 0 3 353.423 -1.015 20 0 FAADHN CNC(=O)NC(=O)[C@@H](C)N[C@@H]1CCCC[C@H]1NC(=O)CS(C)(=O)=O ZINC001225140178 793908253 /nfs/dbraw/zinc/90/82/53/793908253.db2.gz YCDKNIJMTSUSNP-GMTAPVOTSA-N 0 3 362.452 -1.108 20 0 FAADHN CNC(=O)NC(=O)[C@H](C)N[C@@H]1CCCC[C@H]1NC(=O)CS(C)(=O)=O ZINC001225140179 793908742 /nfs/dbraw/zinc/90/87/42/793908742.db2.gz YCDKNIJMTSUSNP-HBNTYKKESA-N 0 3 362.452 -1.108 20 0 FAADHN CCNC(=O)NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)CS(C)(=O)=O ZINC001225159485 793908360 /nfs/dbraw/zinc/90/83/60/793908360.db2.gz JSKSXUOSNXIGLV-GHMZBOCLSA-N 0 3 362.452 -1.106 20 0 FAADHN CS(=O)(=O)CC(=O)N[C@@H]1CCCC[C@H]1NCC(=O)N1CCOCC1 ZINC001225160069 793908521 /nfs/dbraw/zinc/90/85/21/793908521.db2.gz SPYWJFQBHFFZGP-CHWSQXEVSA-N 0 3 361.464 -1.093 20 0 FAADHN C[C@@H](NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)CC(N)=O)C(=O)N(C)C ZINC001225501775 793908806 /nfs/dbraw/zinc/90/88/06/793908806.db2.gz WMXVYRBXWKNTGQ-IJLUTSLNSA-N 0 3 355.439 -1.528 20 0 FAADHN C[C@H](NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)CC(N)=O)C(=O)N(C)C ZINC001225501779 793908387 /nfs/dbraw/zinc/90/83/87/793908387.db2.gz WMXVYRBXWKNTGQ-QJPTWQEYSA-N 0 3 355.439 -1.528 20 0 FAADHN CNC(=O)NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)[C@@H]1CCNC(=O)C1 ZINC001225647754 793909535 /nfs/dbraw/zinc/90/95/35/793909535.db2.gz IXNFADFOOKVZBI-IJLUTSLNSA-N 0 3 353.423 -1.015 20 0 FAADHN CNC(=O)NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)[C@H]1CCNC(=O)C1 ZINC001225647755 793909341 /nfs/dbraw/zinc/90/93/41/793909341.db2.gz IXNFADFOOKVZBI-QJPTWQEYSA-N 0 3 353.423 -1.015 20 0 FAADHN CNC(=O)NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)[C@H]1COCCN1C ZINC001225708734 793909217 /nfs/dbraw/zinc/90/92/17/793909217.db2.gz UGEKKFZKMWERNG-JHJVBQTASA-N 0 3 355.439 -1.210 20 0 FAADHN CNC(=O)NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)[C@@H]1COCCN1C ZINC001225708736 793909298 /nfs/dbraw/zinc/90/92/98/793909298.db2.gz UGEKKFZKMWERNG-UPJWGTAASA-N 0 3 355.439 -1.210 20 0 FAADHN CNC(=O)NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)CN1CCOCC1 ZINC001225734210 793909429 /nfs/dbraw/zinc/90/94/29/793909429.db2.gz YNFQJJPJJWGRAJ-CHWSQXEVSA-N 0 3 355.439 -1.209 20 0 FAADHN CNC(=O)NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)CN1CN=NC1=O ZINC001225761738 793909469 /nfs/dbraw/zinc/90/94/69/793909469.db2.gz UEEMATGHXBBYPW-NXEZZACHSA-N 0 3 353.383 -1.544 20 0 FAADHN CN(C)C(=O)[C@H]1CCCN1CCCNC(=O)N(C)CCS(N)(=O)=O ZINC001225848261 793909495 /nfs/dbraw/zinc/90/94/95/793909495.db2.gz QEZLHVPZSLQHCB-GFCCVEGCSA-N 0 3 363.484 -1.141 20 0 FAADHN CN(C)C(=O)[C@@H]1CCCN1CCCNC(=O)N(C)CCS(N)(=O)=O ZINC001225848267 793909484 /nfs/dbraw/zinc/90/94/84/793909484.db2.gz QEZLHVPZSLQHCB-LBPRGKRZSA-N 0 3 363.484 -1.141 20 0 FAADHN CNC(=O)CC(=O)N[C@@H]1CCCC[C@H]1NCC(=O)N1CCNC(=O)C1 ZINC001225852683 793909530 /nfs/dbraw/zinc/90/95/30/793909530.db2.gz GVNCDLVFWNAEAD-VXGBXAGGSA-N 0 3 353.423 -1.902 20 0 FAADHN CCNC(=O)NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)[C@H](C)NC(N)=O ZINC001225869579 793909436 /nfs/dbraw/zinc/90/94/36/793909436.db2.gz PZRBKGPAWYMMJG-HBNTYKKESA-N 0 3 356.427 -1.094 20 0 FAADHN CNC(=O)NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)C1CN(C(C)=O)C1 ZINC001225876545 793909382 /nfs/dbraw/zinc/90/93/82/793909382.db2.gz WIHYRPWVTKLEOV-CHWSQXEVSA-N 0 3 353.423 -1.063 20 0 FAADHN CCNC(=O)NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)[C@H]1COC(=O)N1 ZINC001225975788 793910470 /nfs/dbraw/zinc/91/04/70/793910470.db2.gz BDHDJZCFMGPWPM-GMTAPVOTSA-N 0 3 355.395 -1.043 20 0 FAADHN CCNC(=O)NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)[C@@H]1COC(=O)N1 ZINC001225975791 793910255 /nfs/dbraw/zinc/91/02/55/793910255.db2.gz BDHDJZCFMGPWPM-MXWKQRLJSA-N 0 3 355.395 -1.043 20 0 FAADHN CC(C)[C@@H](O)C(=O)N[C@@H]1CCCC[C@H]1NCC(=O)N1CCNC(=O)C1 ZINC001226027841 793910563 /nfs/dbraw/zinc/91/05/63/793910563.db2.gz CBCLNMLSQMKTPM-XJKCOSOUSA-N 0 3 354.451 -1.021 20 0 FAADHN CNC(=O)NCCC(=O)N[C@@H]1CCCC[C@H]1NCC(=O)NC(=O)NC ZINC001226042653 793910379 /nfs/dbraw/zinc/91/03/79/793910379.db2.gz MJAKQAXXQQCKSJ-GHMZBOCLSA-N 0 3 356.427 -1.222 20 0 FAADHN CNS(=O)(=O)CCC(=O)N[C@@H]1CCCC[C@H]1NCCS(C)(=O)=O ZINC001226197418 793911134 /nfs/dbraw/zinc/91/11/34/793911134.db2.gz FZLRRNJPOITKPK-VXGBXAGGSA-N 0 3 369.509 -1.013 20 0 FAADHN CNS(=O)(=O)CCC(=O)N[C@@H]1CCCC[C@H]1NCC(=O)NC(N)=O ZINC001226197555 793911206 /nfs/dbraw/zinc/91/12/06/793911206.db2.gz ITSLUSQNBTTZNJ-NXEZZACHSA-N 0 3 363.440 -1.862 20 0 FAADHN CNC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)CN(C)S(=O)(=O)N(C)C ZINC001226197559 793911258 /nfs/dbraw/zinc/91/12/58/793911258.db2.gz ITVOJMUHYVTVAE-VXGBXAGGSA-N 0 3 363.484 -1.512 20 0 FAADHN CNC(=O)NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)C[C@@H](C)NC(N)=O ZINC001226214268 793911425 /nfs/dbraw/zinc/91/14/25/793911425.db2.gz LLVXDFBMMBZWAS-GMTAPVOTSA-N 0 3 356.427 -1.094 20 0 FAADHN CNC(=O)NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)C[C@H](C)NC(N)=O ZINC001226214270 793910926 /nfs/dbraw/zinc/91/09/26/793910926.db2.gz LLVXDFBMMBZWAS-HBNTYKKESA-N 0 3 356.427 -1.094 20 0 FAADHN COCCCNC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)Cn1ncnn1 ZINC001226288092 793911367 /nfs/dbraw/zinc/91/13/67/793911367.db2.gz BPNGDAFGILCCOF-CHWSQXEVSA-N 0 3 353.427 -1.157 20 0 FAADHN CCOCCNC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)Cn1ncnn1 ZINC001226288580 793911059 /nfs/dbraw/zinc/91/10/59/793911059.db2.gz LRZLBGZHAIYIIN-CHWSQXEVSA-N 0 3 353.427 -1.157 20 0 FAADHN CCNC(=O)NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)Cn1ncnn1 ZINC001226288715 793912179 /nfs/dbraw/zinc/91/21/79/793912179.db2.gz NTGIGKZDBAMZLD-GHMZBOCLSA-N 0 3 352.399 -1.464 20 0 FAADHN CCNC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)Cn1cnc(C(N)=O)n1 ZINC001226333877 793912038 /nfs/dbraw/zinc/91/20/38/793912038.db2.gz OYCJQKLOQFMHKJ-GHMZBOCLSA-N 0 3 351.411 -1.470 20 0 FAADHN COCC(=O)N[C@H](C)C(=O)N[C@@H]1CCCC[C@H]1NCC(=O)NC(N)=O ZINC001226401627 793911928 /nfs/dbraw/zinc/91/19/28/793911928.db2.gz VAWYBMYLVLJFLE-GMTAPVOTSA-N 0 3 357.411 -1.651 20 0 FAADHN COCC(=O)N[C@@H](C)C(=O)N[C@@H]1CCCC[C@H]1NCC(=O)NC(N)=O ZINC001226401667 793912305 /nfs/dbraw/zinc/91/23/05/793912305.db2.gz VAWYBMYLVLJFLE-HBNTYKKESA-N 0 3 357.411 -1.651 20 0 FAADHN CNC(=O)NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)C1CS(=O)(=O)C1 ZINC001226427488 793912084 /nfs/dbraw/zinc/91/20/84/793912084.db2.gz LFKDCSNNQULALY-GHMZBOCLSA-N 0 3 360.436 -1.496 20 0 FAADHN C[C@@H](N[C@@H]1CCCC[C@H]1NC(=O)C1CS(=O)(=O)C1)C(=O)NC(N)=O ZINC001226428086 793912108 /nfs/dbraw/zinc/91/21/08/793912108.db2.gz RBAWXVOCRXTEEA-FBIMIBRVSA-N 0 3 360.436 -1.369 20 0 FAADHN C[C@H](N[C@@H]1CCCC[C@H]1NC(=O)C1CS(=O)(=O)C1)C(=O)NC(N)=O ZINC001226428090 793912341 /nfs/dbraw/zinc/91/23/41/793912341.db2.gz RBAWXVOCRXTEEA-JMJZKYOTSA-N 0 3 360.436 -1.369 20 0 FAADHN CS(=O)(=O)NCCN[C@@H]1CCCC[C@H]1NC(=O)C1CS(=O)(=O)C1 ZINC001226428593 793911909 /nfs/dbraw/zinc/91/19/09/793911909.db2.gz UOTRSDGINCSSKO-VXGBXAGGSA-N 0 3 367.493 -1.403 20 0 FAADHN CNC(=O)NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)[C@@H]1CC(=O)N(C)C1 ZINC001226563481 793912202 /nfs/dbraw/zinc/91/22/02/793912202.db2.gz BIVYJFNGZQMODQ-IJLUTSLNSA-N 0 3 353.423 -1.063 20 0 FAADHN CNC(=O)NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)[C@H]1CC(=O)N(C)C1 ZINC001226563483 793911887 /nfs/dbraw/zinc/91/18/87/793911887.db2.gz BIVYJFNGZQMODQ-QJPTWQEYSA-N 0 3 353.423 -1.063 20 0 FAADHN CCS(=O)(=O)NCC(=O)N[C@@H]1CCCC[C@H]1NCC(=O)NC(N)=O ZINC001226572455 793911959 /nfs/dbraw/zinc/91/19/59/793911959.db2.gz AHFHHJJTHPMQRA-NXEZZACHSA-N 0 3 363.440 -1.862 20 0 FAADHN CCS(=O)(=O)NCC(=O)N[C@@H]1CCCC[C@H]1NCCS(C)(=O)=O ZINC001226572558 793912404 /nfs/dbraw/zinc/91/24/04/793912404.db2.gz FGHXOBDYKCMNGW-VXGBXAGGSA-N 0 3 369.509 -1.013 20 0 FAADHN CN(CC(=O)N[C@@H]1CCCC[C@H]1NCC(=O)NC(N)=O)S(C)(=O)=O ZINC001226579323 793913270 /nfs/dbraw/zinc/91/32/70/793913270.db2.gz DGQMZCAIISAGJT-NXEZZACHSA-N 0 3 363.440 -1.910 20 0 FAADHN CN(CC(=O)N[C@@H]1CCCC[C@H]1NCCS(C)(=O)=O)S(C)(=O)=O ZINC001226579394 793913171 /nfs/dbraw/zinc/91/31/71/793913171.db2.gz GEJTVUSTZWGDHD-VXGBXAGGSA-N 0 3 369.509 -1.061 20 0 FAADHN CS(=O)(=O)NCCC(=O)N[C@@H]1CCCC[C@H]1NCC(=O)NC(N)=O ZINC001226579903 793913377 /nfs/dbraw/zinc/91/33/77/793913377.db2.gz NFCZNXMPLGSHAD-NXEZZACHSA-N 0 3 363.440 -1.862 20 0 FAADHN CS(=O)(=O)CCN[C@@H]1CCCC[C@H]1NC(=O)CCNS(C)(=O)=O ZINC001226579959 793913140 /nfs/dbraw/zinc/91/31/40/793913140.db2.gz OWYYHKNNDJRAJN-VXGBXAGGSA-N 0 3 369.509 -1.013 20 0 FAADHN COCC(=O)N(C)CC(=O)N[C@@H]1CCCC[C@H]1NCC(=O)NC(N)=O ZINC001226589583 793913201 /nfs/dbraw/zinc/91/32/01/793913201.db2.gz OHTIJKLKMKLBQR-GHMZBOCLSA-N 0 3 357.411 -1.697 20 0 FAADHN COCC(=O)NCCC(=O)N[C@@H]1CCCC[C@H]1NCC(=O)NC(N)=O ZINC001226596940 793912946 /nfs/dbraw/zinc/91/29/46/793912946.db2.gz CGSRJUHEYIEARY-GHMZBOCLSA-N 0 3 357.411 -1.649 20 0 FAADHN CNC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)Cn1ccc(=O)n(C)c1=O ZINC001226612743 793912778 /nfs/dbraw/zinc/91/27/78/793912778.db2.gz AVHOWFOKMRZFSA-VXGBXAGGSA-N 0 3 351.407 -1.690 20 0 FAADHN CCNC(=O)NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)CNC(=O)NC ZINC001226627963 793913311 /nfs/dbraw/zinc/91/33/11/793913311.db2.gz KJRROBXTQOMTRY-GHMZBOCLSA-N 0 3 356.427 -1.222 20 0 FAADHN CNC(=O)NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)C[C@H]1CCNC1=O ZINC001226757934 793914551 /nfs/dbraw/zinc/91/45/51/793914551.db2.gz MNUFYEOJCLPANR-IJLUTSLNSA-N 0 3 353.423 -1.015 20 0 FAADHN CNC(=O)NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)C[C@@H]1CCNC1=O ZINC001226757935 793914093 /nfs/dbraw/zinc/91/40/93/793914093.db2.gz MNUFYEOJCLPANR-QJPTWQEYSA-N 0 3 353.423 -1.015 20 0 FAADHN CS(=O)(=O)CCN[C@@H]1CCCC[C@H]1NC(=O)CN1CCOCC1=O ZINC001226807747 793914519 /nfs/dbraw/zinc/91/45/19/793914519.db2.gz BEYCNLXADUUBOQ-CHWSQXEVSA-N 0 3 361.464 -1.093 20 0 FAADHN NC(=O)NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)CN1CCOCC1=O ZINC001226807889 793914239 /nfs/dbraw/zinc/91/42/39/793914239.db2.gz GOJHKJKJXNBKNM-GHMZBOCLSA-N 0 3 355.395 -1.943 20 0 FAADHN CS(=O)(=O)CCN[C@@H]1CCCC[C@H]1NC(=O)C[C@@H]1NC(=O)NC1=O ZINC001226844763 793914335 /nfs/dbraw/zinc/91/43/35/793914335.db2.gz RQBNWHIMXOOEKY-MXWKQRLJSA-N 0 3 360.436 -1.354 20 0 FAADHN Cn1cnc(C(=O)N[C@@H]2CCCC[C@H]2NCC(=O)NC(N)=O)cc1=O ZINC001226869169 793914425 /nfs/dbraw/zinc/91/44/25/793914425.db2.gz NVCZHYWOXJNYAP-NXEZZACHSA-N 0 3 350.379 -1.394 20 0 FAADHN CNC(=O)NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)[C@@H]1CCCNC1=O ZINC001226922349 793914614 /nfs/dbraw/zinc/91/46/14/793914614.db2.gz QEAGWEAVNARECL-IJLUTSLNSA-N 0 3 353.423 -1.015 20 0 FAADHN CNC(=O)NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)[C@H]1CCCNC1=O ZINC001226922350 793914636 /nfs/dbraw/zinc/91/46/36/793914636.db2.gz QEAGWEAVNARECL-QJPTWQEYSA-N 0 3 353.423 -1.015 20 0 FAADHN CNC(=O)NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)[C@@H](C)S(C)(=O)=O ZINC001227113366 793915453 /nfs/dbraw/zinc/91/54/53/793915453.db2.gz FUXBLVAUTGGJNR-GMTAPVOTSA-N 0 3 362.452 -1.108 20 0 FAADHN CNC(=O)NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)[C@H](C)S(C)(=O)=O ZINC001227113367 793915021 /nfs/dbraw/zinc/91/50/21/793915021.db2.gz FUXBLVAUTGGJNR-HBNTYKKESA-N 0 3 362.452 -1.108 20 0 FAADHN COCCS(=O)(=O)CC(=O)N[C@@H]1CCCC[C@H]1N[C@@H]1CCNC1=O ZINC001227114352 793915250 /nfs/dbraw/zinc/91/52/50/793915250.db2.gz QSAPPBOSLBHTIA-JHJVBQTASA-N 0 3 361.464 -1.047 20 0 FAADHN COCCS(=O)(=O)CC(=O)N[C@@H]1CCCC[C@H]1N[C@H]1CCNC1=O ZINC001227114355 793915615 /nfs/dbraw/zinc/91/56/15/793915615.db2.gz QSAPPBOSLBHTIA-UPJWGTAASA-N 0 3 361.464 -1.047 20 0 FAADHN CS(=O)(=O)CCC(=O)N[C@@H]1CCCC[C@H]1NCCNS(C)(=O)=O ZINC001227121775 793915335 /nfs/dbraw/zinc/91/53/35/793915335.db2.gz GMCBYGUKBFGIAF-VXGBXAGGSA-N 0 3 369.509 -1.013 20 0 FAADHN CNC(=O)NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)CCS(C)(=O)=O ZINC001227122215 793915597 /nfs/dbraw/zinc/91/55/97/793915597.db2.gz NVWGGMBZCJFJRP-GHMZBOCLSA-N 0 3 362.452 -1.106 20 0 FAADHN CCNC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)CNC(=O)CNC(C)=O ZINC001227135232 793915220 /nfs/dbraw/zinc/91/52/20/793915220.db2.gz HCXAGEPJRCFCNO-CHWSQXEVSA-N 0 3 355.439 -1.608 20 0 FAADHN CCNC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)CN1CCN(C)C(=O)C1 ZINC001227167033 793914976 /nfs/dbraw/zinc/91/49/76/793914976.db2.gz ZABMVQGSCGMELB-ZIAGYGMSSA-N 0 3 353.467 -1.087 20 0 FAADHN NC(=O)NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)CC1CS(=O)(=O)C1 ZINC001227176005 793915531 /nfs/dbraw/zinc/91/55/31/793915531.db2.gz PROPAVCSDOWRSS-GHMZBOCLSA-N 0 3 360.436 -1.367 20 0 FAADHN Cn1cnn(CC(=O)N[C@@H]2CCCC[C@H]2NCC(=O)NC(N)=O)c1=O ZINC001227184260 793915415 /nfs/dbraw/zinc/91/54/15/793915415.db2.gz HQLXNSFHFOBKPJ-NXEZZACHSA-N 0 3 353.383 -2.206 20 0 FAADHN Cn1cnn(CC(=O)N[C@@H]2CCCC[C@H]2NCCS(C)(=O)=O)c1=O ZINC001227184661 793916226 /nfs/dbraw/zinc/91/62/26/793916226.db2.gz NYEUNHSVSJILOM-VXGBXAGGSA-N 0 3 359.452 -1.357 20 0 FAADHN Cn1cnn(CC(=O)N[C@@H]2CCCC[C@H]2NCC(=O)NC2CC2)c1=O ZINC001227185199 793916465 /nfs/dbraw/zinc/91/64/65/793916465.db2.gz XYWOTKIBCSLQFV-CHWSQXEVSA-N 0 3 350.423 -1.123 20 0 FAADHN CCN1CCOC[C@@H]1C(=O)N[C@@H]1CCCC[C@H]1NCC(=O)NC(N)=O ZINC001227202868 793916053 /nfs/dbraw/zinc/91/60/53/793916053.db2.gz KZIYAHPGCTWPNV-JHJVBQTASA-N 0 3 355.439 -1.081 20 0 FAADHN CCN1CCOC[C@H]1C(=O)N[C@@H]1CCCC[C@H]1NCC(=O)NC(N)=O ZINC001227202869 793916602 /nfs/dbraw/zinc/91/66/02/793916602.db2.gz KZIYAHPGCTWPNV-UPJWGTAASA-N 0 3 355.439 -1.081 20 0 FAADHN CNC(=O)NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)[C@@H]1CCC(=O)NC1 ZINC001227218069 793916405 /nfs/dbraw/zinc/91/64/05/793916405.db2.gz SQILQVRFGVORPT-IJLUTSLNSA-N 0 3 353.423 -1.015 20 0 FAADHN CNC(=O)NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)[C@H]1CCC(=O)NC1 ZINC001227218073 793916455 /nfs/dbraw/zinc/91/64/55/793916455.db2.gz SQILQVRFGVORPT-QJPTWQEYSA-N 0 3 353.423 -1.015 20 0 FAADHN CNC(=O)NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)C(=O)NCC(F)F ZINC001227218552 793915916 /nfs/dbraw/zinc/91/59/16/793915916.db2.gz XNQASVDEHHXEBW-RKDXNWHRSA-N 0 3 363.365 -1.160 20 0 FAADHN CS(=O)(=O)NCCN[C@@H]1CCCC[C@H]1NC(=O)C(=O)NCC(F)F ZINC001227224418 793916443 /nfs/dbraw/zinc/91/64/43/793916443.db2.gz GBLMYPMSPOOCFE-NXEZZACHSA-N 0 3 370.422 -1.066 20 0 FAADHN C[C@H](N[C@@H]1CCCC[C@H]1NC(=O)C(=O)NCC(F)F)C(=O)NC(N)=O ZINC001227224732 793916318 /nfs/dbraw/zinc/91/63/18/793916318.db2.gz IIZHVIRGMFXFCY-DJLDLDEBSA-N 0 3 363.365 -1.032 20 0 FAADHN C[C@@H](N[C@@H]1CCCC[C@H]1NC(=O)C(=O)NCC(F)F)C(=O)NC(N)=O ZINC001227224733 793916498 /nfs/dbraw/zinc/91/64/98/793916498.db2.gz IIZHVIRGMFXFCY-IWSPIJDZSA-N 0 3 363.365 -1.032 20 0 FAADHN NC(=O)NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)CN1CCCNC1=O ZINC001227269135 793916345 /nfs/dbraw/zinc/91/63/45/793916345.db2.gz NPLAZSCYZKXMRN-GHMZBOCLSA-N 0 3 354.411 -1.386 20 0 FAADHN NC(=O)NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)[C@@H]1CCS(=O)(=O)C1 ZINC001227363019 793916477 /nfs/dbraw/zinc/91/64/77/793916477.db2.gz LBDWUCZTUJNOEP-GMTAPVOTSA-N 0 3 360.436 -1.367 20 0 FAADHN NC(=O)NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)[C@H]1CCS(=O)(=O)C1 ZINC001227363020 793916108 /nfs/dbraw/zinc/91/61/08/793916108.db2.gz LBDWUCZTUJNOEP-HBNTYKKESA-N 0 3 360.436 -1.367 20 0 FAADHN Cn1cc(C(=O)N[C@@H]2CCCC[C@H]2NCC(=O)NC(N)=O)ncc1=O ZINC001227613536 793917497 /nfs/dbraw/zinc/91/74/97/793917497.db2.gz GXOIJJRJNLTPQP-NXEZZACHSA-N 0 3 350.379 -1.394 20 0 FAADHN CNC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)[C@@H]1CS(=O)(=O)CC(=O)N1 ZINC001227654980 793916874 /nfs/dbraw/zinc/91/68/74/793916874.db2.gz AMTBTLKZELDFAP-MXWKQRLJSA-N 0 3 360.436 -2.337 20 0 FAADHN CNC(=O)NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)[C@@]1(C)CNC(=O)C1 ZINC001227663503 793916995 /nfs/dbraw/zinc/91/69/95/793916995.db2.gz VMINEJQNAKVEAU-GLKRBJQHSA-N 0 3 353.423 -1.015 20 0 FAADHN CNC(=O)NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)[C@]1(C)CNC(=O)C1 ZINC001227663504 793917451 /nfs/dbraw/zinc/91/74/51/793917451.db2.gz VMINEJQNAKVEAU-UVWXRNBGSA-N 0 3 353.423 -1.015 20 0 FAADHN CNS(=O)(=O)NCC(=O)N[C@@H]1CCCC[C@H]1NCc1n[nH]c(C)n1 ZINC001227741710 793917030 /nfs/dbraw/zinc/91/70/30/793917030.db2.gz GCOBZRDPWLBHKD-GHMZBOCLSA-N 0 3 359.456 -1.316 20 0 FAADHN CNS(=O)(=O)NCC(=O)N[C@@H]1CCCC[C@H]1NCC(=O)NC(N)=O ZINC001227742007 793917892 /nfs/dbraw/zinc/91/78/92/793917892.db2.gz IMQYXFGWRZMFCY-RKDXNWHRSA-N 0 3 364.428 -2.748 20 0 FAADHN CNS(=O)(=O)NCC(=O)N[C@@H]1CCCC[C@H]1NCc1cncn1C ZINC001227742119 793918299 /nfs/dbraw/zinc/91/82/99/793918299.db2.gz LJLSOLKRWSRVTP-CHWSQXEVSA-N 0 3 358.468 -1.009 20 0 FAADHN CNS(=O)(=O)NCC(=O)N[C@@H]1CCCC[C@H]1NCC(=O)NC(C)C ZINC001227742144 793918467 /nfs/dbraw/zinc/91/84/67/793918467.db2.gz MCVAPTQGZNTSRE-VXGBXAGGSA-N 0 3 363.484 -1.418 20 0 FAADHN CCCNC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)CNS(=O)(=O)NC ZINC001227742479 793917975 /nfs/dbraw/zinc/91/79/75/793917975.db2.gz PWSYTLFKFUOXHK-VXGBXAGGSA-N 0 3 363.484 -1.417 20 0 FAADHN CNS(=O)(=O)NCC(=O)N[C@@H]1CCCC[C@H]1NCc1ccnn1C ZINC001227742520 793918102 /nfs/dbraw/zinc/91/81/02/793918102.db2.gz QMLYMXLNPDYBNR-CHWSQXEVSA-N 0 3 358.468 -1.009 20 0 FAADHN CNS(=O)(=O)NCC(=O)N[C@@H]1CCCC[C@H]1NCC(=O)NC1CC1 ZINC001227742532 793918480 /nfs/dbraw/zinc/91/84/80/793918480.db2.gz QWAPMAOLOORYKA-VXGBXAGGSA-N 0 3 361.468 -1.664 20 0 FAADHN CNS(=O)(=O)NCC(=O)N[C@@H]1CCCC[C@H]1NCCS(C)(=O)=O ZINC001227742545 793917839 /nfs/dbraw/zinc/91/78/39/793917839.db2.gz RGSDRLBRBFELSO-GHMZBOCLSA-N 0 3 370.497 -1.898 20 0 FAADHN CNS(=O)(=O)NCC(=O)N[C@@H]1CCCC[C@H]1NCc1cnnn1C ZINC001227742565 793918035 /nfs/dbraw/zinc/91/80/35/793918035.db2.gz RMJIQUIWKISFNX-VXGBXAGGSA-N 0 3 359.456 -1.614 20 0 FAADHN CNS(=O)(=O)NCC(=O)N[C@@H]1CCCC[C@H]1NCc1cnn(C)c1 ZINC001227742759 793918213 /nfs/dbraw/zinc/91/82/13/793918213.db2.gz WHGPXDKRUNXPMK-CHWSQXEVSA-N 0 3 358.468 -1.009 20 0 FAADHN CS(=O)(=O)CCN[C@@H]1CCCC[C@H]1NC(=O)CN1CCNC(=O)C1 ZINC001227906681 793919099 /nfs/dbraw/zinc/91/90/99/793919099.db2.gz FAZYKMDQGQAUAB-CHWSQXEVSA-N 0 3 360.480 -1.520 20 0 FAADHN O=C(CN[C@@H]1CCCC[C@H]1NC(=O)CN1CCNC(=O)C1)NC1CC1 ZINC001227907254 793918858 /nfs/dbraw/zinc/91/88/58/793918858.db2.gz LKHWGDIULXAQBC-ZIAGYGMSSA-N 0 3 351.451 -1.286 20 0 FAADHN CC(C)NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)CN1CCNC(=O)C1 ZINC001227907271 793919348 /nfs/dbraw/zinc/91/93/48/793919348.db2.gz MBNONBMEOGMRHR-ZIAGYGMSSA-N 0 3 353.467 -1.040 20 0 FAADHN NC(=O)NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)CN1CCNC(=O)C1 ZINC001227907756 793918828 /nfs/dbraw/zinc/91/88/28/793918828.db2.gz OCRYISPWHLQWNI-GHMZBOCLSA-N 0 3 354.411 -2.370 20 0 FAADHN CCCNC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)CN1CCNC(=O)C1 ZINC001227908875 793919049 /nfs/dbraw/zinc/91/90/49/793919049.db2.gz XISIZQSHMJBNCN-ZIAGYGMSSA-N 0 3 353.467 -1.039 20 0 FAADHN CNC(=O)NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)[C@H]1CN(C)C(=O)N1 ZINC001227940374 793919375 /nfs/dbraw/zinc/91/93/75/793919375.db2.gz HQPXBYOFTHOKER-GMTAPVOTSA-N 0 3 354.411 -1.517 20 0 FAADHN CNC(=O)NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)[C@@H]1CN(C)C(=O)N1 ZINC001227940376 793919063 /nfs/dbraw/zinc/91/90/63/793919063.db2.gz HQPXBYOFTHOKER-MXWKQRLJSA-N 0 3 354.411 -1.517 20 0 FAADHN CCNC(=O)NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)[C@@H]1CCNC1=O ZINC001227940631 793919116 /nfs/dbraw/zinc/91/91/16/793919116.db2.gz KGYJGQYDSXQVOL-IJLUTSLNSA-N 0 3 353.423 -1.015 20 0 FAADHN CCNC(=O)NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)[C@H]1CCNC1=O ZINC001227940633 793918781 /nfs/dbraw/zinc/91/87/81/793918781.db2.gz KGYJGQYDSXQVOL-QJPTWQEYSA-N 0 3 353.423 -1.015 20 0 FAADHN CN1CCN(CCCCNC(=O)NC[C@@H](O)CS(C)(=O)=O)CC1 ZINC001227998884 793920264 /nfs/dbraw/zinc/92/02/64/793920264.db2.gz WWKCFMLSDQWKBT-CYBMUJFWSA-N 0 3 350.485 -1.281 20 0 FAADHN CN1CCN(CCCCNC(=O)NC[C@H](O)CS(C)(=O)=O)CC1 ZINC001227998885 793920304 /nfs/dbraw/zinc/92/03/04/793920304.db2.gz WWKCFMLSDQWKBT-ZDUSSCGKSA-N 0 3 350.485 -1.281 20 0 FAADHN CCNC(=O)NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)c1nnn(C)n1 ZINC001227999425 793920238 /nfs/dbraw/zinc/92/02/38/793920238.db2.gz FCVHRDVZBQVEER-NXEZZACHSA-N 0 3 352.399 -1.314 20 0 FAADHN CCOCCNC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)c1nnn(C)n1 ZINC001228000919 793920363 /nfs/dbraw/zinc/92/03/63/793920363.db2.gz YPPYJNPPUBPJEB-VXGBXAGGSA-N 0 3 353.427 -1.007 20 0 FAADHN COCCCNC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)c1nnn(C)n1 ZINC001228000978 793920322 /nfs/dbraw/zinc/92/03/22/793920322.db2.gz ZBZFKFFVRITKES-VXGBXAGGSA-N 0 3 353.427 -1.007 20 0 FAADHN CNC(=O)NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)[C@H]1CCN(C)C1=O ZINC001228069456 793920176 /nfs/dbraw/zinc/92/01/76/793920176.db2.gz JYVWBDMDYIFWDV-IJLUTSLNSA-N 0 3 353.423 -1.063 20 0 FAADHN CNC(=O)NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)[C@@H]1CCN(C)C1=O ZINC001228069457 793920059 /nfs/dbraw/zinc/92/00/59/793920059.db2.gz JYVWBDMDYIFWDV-QJPTWQEYSA-N 0 3 353.423 -1.063 20 0 FAADHN CNC(=O)NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)c1c[nH]c(=O)cn1 ZINC001228216170 793920469 /nfs/dbraw/zinc/92/04/69/793920469.db2.gz TUNGCSWXPIULGR-NXEZZACHSA-N 0 3 350.379 -1.144 20 0 FAADHN CCNC(=O)NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)[C@H]1CNC(=O)N1 ZINC001228260823 793920425 /nfs/dbraw/zinc/92/04/25/793920425.db2.gz FUKVBVFGSHARQI-GMTAPVOTSA-N 0 3 354.411 -1.470 20 0 FAADHN CCNC(=O)NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)[C@@H]1CNC(=O)N1 ZINC001228260825 793920095 /nfs/dbraw/zinc/92/00/95/793920095.db2.gz FUKVBVFGSHARQI-MXWKQRLJSA-N 0 3 354.411 -1.470 20 0 FAADHN CCOCCNC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)[C@H]1CNC(=O)N1 ZINC001228261590 793920494 /nfs/dbraw/zinc/92/04/94/793920494.db2.gz LNZVLIXCMZZWHM-JHJVBQTASA-N 0 3 355.439 -1.163 20 0 FAADHN CCOCCNC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)[C@@H]1CNC(=O)N1 ZINC001228261601 793920414 /nfs/dbraw/zinc/92/04/14/793920414.db2.gz LNZVLIXCMZZWHM-UPJWGTAASA-N 0 3 355.439 -1.163 20 0 FAADHN COCCCNC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)[C@H]1CNC(=O)N1 ZINC001228262105 793921159 /nfs/dbraw/zinc/92/11/59/793921159.db2.gz PBFRRJZPDNGZRU-JHJVBQTASA-N 0 3 355.439 -1.163 20 0 FAADHN COCCCNC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)[C@@H]1CNC(=O)N1 ZINC001228262106 793921091 /nfs/dbraw/zinc/92/10/91/793921091.db2.gz PBFRRJZPDNGZRU-UPJWGTAASA-N 0 3 355.439 -1.163 20 0 FAADHN NC(=O)NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)CCCS(N)(=O)=O ZINC001228278125 793921480 /nfs/dbraw/zinc/92/14/80/793921480.db2.gz MIRZNHNAFSTFGZ-NXEZZACHSA-N 0 3 363.440 -1.733 20 0 FAADHN NC(=O)C(=O)N[C@@H]1CCCC[C@H]1NCC(=O)NC(=O)NCC(F)(F)F ZINC001228295824 793921598 /nfs/dbraw/zinc/92/15/98/793921598.db2.gz NOBXOVPGKRCWEW-HTQZYQBOSA-N 0 3 367.328 -1.123 20 0 FAADHN COC[C@@H](C)NC(=O)NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)C(N)=O ZINC001228296283 793921038 /nfs/dbraw/zinc/92/10/38/793921038.db2.gz SKZPZVKSDSXNMH-GMTAPVOTSA-N 0 3 357.411 -1.651 20 0 FAADHN COC[C@H](C)NC(=O)NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)C(N)=O ZINC001228296292 793921572 /nfs/dbraw/zinc/92/15/72/793921572.db2.gz SKZPZVKSDSXNMH-HBNTYKKESA-N 0 3 357.411 -1.651 20 0 FAADHN COCCCS(=O)(=O)NCCN[C@@H]1CCCC[C@H]1NC(=O)C(N)=O ZINC001228296724 793921381 /nfs/dbraw/zinc/92/13/81/793921381.db2.gz YONNKBQCRFRACL-VXGBXAGGSA-N 0 3 364.468 -1.555 20 0 FAADHN CNC(=O)NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)[C@]1(C)CCNC1=O ZINC001228574605 793923059 /nfs/dbraw/zinc/92/30/59/793923059.db2.gz FZNGMBWOSCSYEO-GLKRBJQHSA-N 0 3 353.423 -1.015 20 0 FAADHN CNC(=O)NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)[C@@]1(C)CCNC1=O ZINC001228574606 793922728 /nfs/dbraw/zinc/92/27/28/793922728.db2.gz FZNGMBWOSCSYEO-UVWXRNBGSA-N 0 3 353.423 -1.015 20 0 FAADHN NC(=O)NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)[C@H]1CC[C@@H](C(N)=O)O1 ZINC001228584743 793922758 /nfs/dbraw/zinc/92/27/58/793922758.db2.gz MCVDLVOPRBQOHC-CHWFTXMASA-N 0 3 355.395 -1.769 20 0 FAADHN CN(C)C(=O)[C@@H]1C[C@@H]1C(=O)N[C@@H]1CCCC[C@H]1NCC(=O)NC(N)=O ZINC001228618636 793923080 /nfs/dbraw/zinc/92/30/80/793923080.db2.gz NKMQPNSMTCVQJC-IRCOFANPSA-N 0 3 353.423 -1.077 20 0 FAADHN CCNC(=O)NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)[C@H]1C[C@H]1C(N)=O ZINC001228619078 793923281 /nfs/dbraw/zinc/92/32/81/793923281.db2.gz TVJQELNYTSPIIK-WRWGMCAJSA-N 0 3 353.423 -1.030 20 0 FAADHN Cn1ncc(CCC(=O)N[C@@H]2CCCC[C@H]2NCC(=O)NC(N)=O)n1 ZINC001228632899 793922945 /nfs/dbraw/zinc/92/29/45/793922945.db2.gz PPFKVKPNKHKIGU-VXGBXAGGSA-N 0 3 351.411 -1.040 20 0 FAADHN NC(=O)NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)c1ccc(C(N)=O)[nH]1 ZINC001228640489 793923136 /nfs/dbraw/zinc/92/31/36/793923136.db2.gz WTRXUAABUBWQBR-RKDXNWHRSA-N 0 3 350.379 -1.061 20 0 FAADHN C[C@@H]1C(=O)N(CCN(C)C)CN1C(=O)NCCNS(=O)(=O)N(C)C ZINC001228774079 793922987 /nfs/dbraw/zinc/92/29/87/793922987.db2.gz CHSVRKWXZISJPN-LLVKDONJSA-N 0 3 364.472 -1.856 20 0 FAADHN C[C@H]1C(=O)N(CCN(C)C)CN1C(=O)NCCNS(=O)(=O)N(C)C ZINC001228774083 793923003 /nfs/dbraw/zinc/92/30/03/793923003.db2.gz CHSVRKWXZISJPN-NSHDSACASA-N 0 3 364.472 -1.856 20 0 FAADHN C[C@H](NS(C)(=O)=O)C(=O)N[C@@H]1CCCC[C@H]1NCC(=O)NC(N)=O ZINC001228791510 793924190 /nfs/dbraw/zinc/92/41/90/793924190.db2.gz IWFMBFBWSBQTQV-IVZWLZJFSA-N 0 3 363.440 -1.864 20 0 FAADHN C[C@@H](NS(C)(=O)=O)C(=O)N[C@@H]1CCCC[C@H]1NCC(=O)NC(N)=O ZINC001228791513 793923925 /nfs/dbraw/zinc/92/39/25/793923925.db2.gz IWFMBFBWSBQTQV-OPRDCNLKSA-N 0 3 363.440 -1.864 20 0 FAADHN C[C@@H](NS(C)(=O)=O)C(=O)N[C@@H]1CCCC[C@H]1NCCS(C)(=O)=O ZINC001228792294 793924001 /nfs/dbraw/zinc/92/40/01/793924001.db2.gz WONODPSGOVXAIC-IJLUTSLNSA-N 0 3 369.509 -1.014 20 0 FAADHN C[C@H](NS(C)(=O)=O)C(=O)N[C@@H]1CCCC[C@H]1NCCS(C)(=O)=O ZINC001228792296 793924128 /nfs/dbraw/zinc/92/41/28/793924128.db2.gz WONODPSGOVXAIC-QJPTWQEYSA-N 0 3 369.509 -1.014 20 0 FAADHN O=C(CN[C@@H]1CCCC[C@H]1NC(=O)[C@@H]1CC(=O)NC(=O)N1)NC1CC1 ZINC001228811460 793923903 /nfs/dbraw/zinc/92/39/03/793923903.db2.gz IUQRBNHHHMLZHI-UTUOFQBUSA-N 0 3 351.407 -1.120 20 0 FAADHN CS(=O)(=O)CCN[C@@H]1CCCC[C@H]1NC(=O)[C@@H]1CC(=O)NC(=O)N1 ZINC001228811690 793924087 /nfs/dbraw/zinc/92/40/87/793924087.db2.gz JQZJMDCRBCKORJ-MXWKQRLJSA-N 0 3 360.436 -1.354 20 0 FAADHN NC(=O)NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)[C@@H]1CC(=O)NC(=O)N1 ZINC001228811821 793923809 /nfs/dbraw/zinc/92/38/09/793923809.db2.gz LPZYEVFJSGJBSO-HLTSFMKQSA-N 0 3 354.367 -2.204 20 0 FAADHN CCNC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)CNS(=O)(=O)N(C)C ZINC001228842099 793924145 /nfs/dbraw/zinc/92/41/45/793924145.db2.gz DVEFVZMVOHSIPD-VXGBXAGGSA-N 0 3 363.484 -1.465 20 0 FAADHN CNC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)c1cn(C)c(=O)n(C)c1=O ZINC001228886434 793924043 /nfs/dbraw/zinc/92/40/43/793924043.db2.gz YUENSGUBGQZRQC-VXGBXAGGSA-N 0 3 351.407 -1.539 20 0 FAADHN CNC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)CN1C(=O)C(=O)N(C)C1=O ZINC001228901436 793923946 /nfs/dbraw/zinc/92/39/46/793923946.db2.gz MCYGOZWEMOGZKP-NXEZZACHSA-N 0 3 353.379 -1.830 20 0 FAADHN CCNC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)C[C@H](NC(C)=O)C(N)=O ZINC001228967693 793924716 /nfs/dbraw/zinc/92/47/16/793924716.db2.gz CEPDLXRUIUZDJB-UPJWGTAASA-N 0 3 355.439 -1.480 20 0 FAADHN NC(=O)NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)C1CC(=O)NC(=O)C1 ZINC001229101197 793925314 /nfs/dbraw/zinc/92/53/14/793925314.db2.gz LEPYXSNNIWVDET-NXEZZACHSA-N 0 3 353.379 -1.749 20 0 FAADHN CNC(=O)NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)C1(C(=O)NC)CC1 ZINC001229115921 793925008 /nfs/dbraw/zinc/92/50/08/793925008.db2.gz ORTKEUWMITWQLJ-GHMZBOCLSA-N 0 3 353.423 -1.015 20 0 FAADHN CNC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)[C@@H](CCC(N)=O)NC(C)=O ZINC001229150714 793925323 /nfs/dbraw/zinc/92/53/23/793925323.db2.gz MVFBCKKUEAVEAR-JHJVBQTASA-N 0 3 355.439 -1.480 20 0 FAADHN CNC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)[C@H](CCC(N)=O)NC(C)=O ZINC001229150715 793925223 /nfs/dbraw/zinc/92/52/23/793925223.db2.gz MVFBCKKUEAVEAR-UPJWGTAASA-N 0 3 355.439 -1.480 20 0 FAADHN CS(=O)(=O)CCN[C@@H]1CCCC[C@H]1NC(=O)CN1CC(=O)NC1=O ZINC001229173761 793925125 /nfs/dbraw/zinc/92/51/25/793925125.db2.gz HMORQTFDJQHCNV-GHMZBOCLSA-N 0 3 360.436 -1.400 20 0 FAADHN CN(C)S(=O)(=O)CCCN1CCC(NC(=O)[C@H]2C[C@H]2C(N)=O)CC1 ZINC001229199893 793924754 /nfs/dbraw/zinc/92/47/54/793924754.db2.gz HOYNBSWBVPPPOQ-OLZOCXBDSA-N 0 3 360.480 -1.030 20 0 FAADHN CNC(=O)NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)CCn1cnnn1 ZINC001229296183 793925713 /nfs/dbraw/zinc/92/57/13/793925713.db2.gz SWMBAZRFJXMSQK-GHMZBOCLSA-N 0 3 352.399 -1.464 20 0 FAADHN NC(=O)NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)c1cc(C(N)=O)c[nH]1 ZINC001229327320 793926546 /nfs/dbraw/zinc/92/65/46/793926546.db2.gz NNQZFSLCRZGCKP-NXEZZACHSA-N 0 3 350.379 -1.061 20 0 FAADHN NC(=O)NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)C(=O)NCC(F)(F)F ZINC001229347078 793925821 /nfs/dbraw/zinc/92/58/21/793925821.db2.gz LHHHXTYLJOMBCO-HTQZYQBOSA-N 0 3 367.328 -1.123 20 0 FAADHN CNC(=O)NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)C(=O)NCC1CC1 ZINC001229373450 793925847 /nfs/dbraw/zinc/92/58/47/793925847.db2.gz KYKCQGMKWSFWMS-VXGBXAGGSA-N 0 3 353.423 -1.015 20 0 FAADHN C[C@H](NC(=O)Cn1cnnn1)C(=O)N[C@@H]1CCCC[C@H]1NCC(N)=O ZINC001229561897 793926479 /nfs/dbraw/zinc/92/64/79/793926479.db2.gz GNDGVGOLMMOXFD-HBNTYKKESA-N 0 3 352.399 -2.320 20 0 FAADHN C[C@@H](NC(=O)Cn1cnnn1)C(=O)N[C@@H]1CCCC[C@H]1NCC(N)=O ZINC001229624013 793925799 /nfs/dbraw/zinc/92/57/99/793925799.db2.gz GNDGVGOLMMOXFD-GMTAPVOTSA-N 0 3 352.399 -2.320 20 0 FAADHN NS(=O)(=O)CCOCCNC(=O)NC[C@H]1CCN1C1CCOCC1 ZINC001229741266 793926991 /nfs/dbraw/zinc/92/69/91/793926991.db2.gz ZUCMQWHYVUNJGR-CYBMUJFWSA-N 0 3 364.468 -1.156 20 0 FAADHN NS(=O)(=O)CCOCCNC(=O)NC[C@@H]1CCN1C1CCOCC1 ZINC001229741267 793927398 /nfs/dbraw/zinc/92/73/98/793927398.db2.gz ZUCMQWHYVUNJGR-ZDUSSCGKSA-N 0 3 364.468 -1.156 20 0 FAADHN NC(=O)c1cn(CCCCNC(=O)N2CCN3C[C@H](O)C[C@H]3C2)nn1 ZINC001229979063 793928326 /nfs/dbraw/zinc/92/83/26/793928326.db2.gz CUOMFPFHYDXZNC-NWDGAFQWSA-N 0 3 351.411 -1.382 20 0 FAADHN CN(C)S(=O)(=O)CC(=O)N[C@@H]1CCCC[C@H]1NCCS(C)(=O)=O ZINC001230010071 793928302 /nfs/dbraw/zinc/92/83/02/793928302.db2.gz DNSQWKKOQDMMMJ-VXGBXAGGSA-N 0 3 369.509 -1.061 20 0 FAADHN CN(C)S(=O)(=O)CC(=O)N[C@@H]1CCCC[C@H]1NCC(=O)NC(N)=O ZINC001230010455 793928225 /nfs/dbraw/zinc/92/82/25/793928225.db2.gz KOFFRBRYIZTCCP-NXEZZACHSA-N 0 3 363.440 -1.910 20 0 FAADHN Cn1nc(C(=O)N[C@@H]2CCCC[C@H]2NCC(=O)NC(N)=O)ccc1=O ZINC001230065323 793928189 /nfs/dbraw/zinc/92/81/89/793928189.db2.gz DXKPNPVHFCRADU-NXEZZACHSA-N 0 3 350.379 -1.394 20 0 FAADHN NC(=O)NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)CN1C(=O)CNC1=O ZINC001230077585 793928341 /nfs/dbraw/zinc/92/83/41/793928341.db2.gz LODFQCDWQNEZCR-RKDXNWHRSA-N 0 3 354.367 -2.250 20 0 FAADHN NC(=O)NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)CN1C(=O)CCC1=O ZINC001230085594 793928403 /nfs/dbraw/zinc/92/84/03/793928403.db2.gz ZAYMZUOZDRTIMS-NXEZZACHSA-N 0 3 353.379 -1.653 20 0 FAADHN CCNC(=O)NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)CCNC(N)=O ZINC001230091920 793928104 /nfs/dbraw/zinc/92/81/04/793928104.db2.gz VUUKVFRJYMRHSS-GHMZBOCLSA-N 0 3 356.427 -1.093 20 0 FAADHN CNC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)CN1CCS(=O)(=O)CC1 ZINC001230137174 793928472 /nfs/dbraw/zinc/92/84/72/793928472.db2.gz OHNWNJAGGAOFEN-CHWSQXEVSA-N 0 3 360.480 -1.520 20 0 FAADHN NC(=O)NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)c1c[nH]c(C(N)=O)c1 ZINC001230149256 793928074 /nfs/dbraw/zinc/92/80/74/793928074.db2.gz BIRURXPXQVTVKE-NXEZZACHSA-N 0 3 350.379 -1.061 20 0 FAADHN NC(=O)NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)[C@@H]1CCS(=O)(=O)N1 ZINC001230164221 793928361 /nfs/dbraw/zinc/92/83/61/793928361.db2.gz INHVLAHAOGYQNE-BBBLOLIVSA-N 0 3 361.424 -2.110 20 0 FAADHN NC(=O)NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)[C@H]1CCS(=O)(=O)N1 ZINC001230164222 793929339 /nfs/dbraw/zinc/92/93/39/793929339.db2.gz INHVLAHAOGYQNE-OPRDCNLKSA-N 0 3 361.424 -2.110 20 0 FAADHN O=C(CN[C@@H]1CCCC[C@H]1NC(=O)[C@H]1CCS(=O)(=O)N1)NC1CC1 ZINC001230164236 793929325 /nfs/dbraw/zinc/92/93/25/793929325.db2.gz JAZXVRSCFBGGOK-JHJVBQTASA-N 0 3 358.464 -1.026 20 0 FAADHN O=C(CN[C@@H]1CCCC[C@H]1NC(=O)[C@@H]1CCS(=O)(=O)N1)NC1CC1 ZINC001230164237 793928957 /nfs/dbraw/zinc/92/89/57/793928957.db2.gz JAZXVRSCFBGGOK-UPJWGTAASA-N 0 3 358.464 -1.026 20 0 FAADHN CS(=O)(=O)CCN[C@@H]1CCCC[C@H]1NC(=O)[C@H]1CCS(=O)(=O)N1 ZINC001230164949 793928899 /nfs/dbraw/zinc/92/88/99/793928899.db2.gz ZUMURYBOCPTFGQ-IJLUTSLNSA-N 0 3 367.493 -1.260 20 0 FAADHN CS(=O)(=O)CCN[C@@H]1CCCC[C@H]1NC(=O)[C@@H]1CCS(=O)(=O)N1 ZINC001230164951 793928949 /nfs/dbraw/zinc/92/89/49/793928949.db2.gz ZUMURYBOCPTFGQ-UTUOFQBUSA-N 0 3 367.493 -1.260 20 0 FAADHN CNS(=O)(=O)CC(=O)N[C@@H]1CCCC[C@H]1NCCS(C)(=O)=O ZINC001230174464 793929171 /nfs/dbraw/zinc/92/91/71/793929171.db2.gz DUHQELIRXAJRHZ-GHMZBOCLSA-N 0 3 355.482 -1.403 20 0 FAADHN CNC(=O)NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)CS(=O)(=O)NC ZINC001230174912 793928971 /nfs/dbraw/zinc/92/89/71/793928971.db2.gz ONCIMKXANVBIFX-NXEZZACHSA-N 0 3 363.440 -1.992 20 0 FAADHN NC(=O)NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)[C@H]1CCCS1(=O)=O ZINC001230208072 793929040 /nfs/dbraw/zinc/92/90/40/793929040.db2.gz FSMQXWRRWDEVFH-GMTAPVOTSA-N 0 3 360.436 -1.225 20 0 FAADHN NC(=O)NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)[C@@H]1CCCS1(=O)=O ZINC001230208077 793928877 /nfs/dbraw/zinc/92/88/77/793928877.db2.gz FSMQXWRRWDEVFH-MXWKQRLJSA-N 0 3 360.436 -1.225 20 0 FAADHN CNC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)CNC(=O)Cn1cncn1 ZINC001230247902 793929211 /nfs/dbraw/zinc/92/92/11/793929211.db2.gz OZJSGZIUMXARTB-VXGBXAGGSA-N 0 3 351.411 -1.843 20 0 FAADHN CNC(=O)NC(C)(C)C(=O)N[C@@H]1CCCC[C@H]1NCC(=O)NC(N)=O ZINC001230262179 793929357 /nfs/dbraw/zinc/92/93/57/793929357.db2.gz LEWJSLCGFFEYDS-NXEZZACHSA-N 0 3 356.427 -1.094 20 0 FAADHN CCS(=O)(=O)CC(=O)N[C@@H]1CCCC[C@H]1NCC(=O)NC(=O)NC ZINC001230266453 793929027 /nfs/dbraw/zinc/92/90/27/793929027.db2.gz INUGEKQEPHJOFA-GHMZBOCLSA-N 0 3 362.452 -1.106 20 0 FAADHN CCNC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)c1cn(CC(N)=O)nn1 ZINC001230275026 793930035 /nfs/dbraw/zinc/93/00/35/793930035.db2.gz ZAXYSGXLLUXCFR-GHMZBOCLSA-N 0 3 351.411 -1.470 20 0 FAADHN Cn1cc(C(=O)N[C@@H]2CCCC[C@H]2NCC(=O)NC(N)=O)n(C)c1=O ZINC001230292158 793930206 /nfs/dbraw/zinc/93/02/06/793930206.db2.gz DJVBNMXJGJIVQM-NXEZZACHSA-N 0 3 352.395 -1.451 20 0 FAADHN NC(=O)NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)[C@@H]1CCCN1C(N)=O ZINC001230359003 793930095 /nfs/dbraw/zinc/93/00/95/793930095.db2.gz LVIWGNAOPBTKCO-MXWKQRLJSA-N 0 3 354.411 -1.259 20 0 FAADHN C[C@@H](C(=O)N[C@@H]1CCCC[C@H]1NCC(=O)NC(N)=O)N1CCOCC1 ZINC001230382703 793930075 /nfs/dbraw/zinc/93/00/75/793930075.db2.gz UXSCWDAVZQIJQD-YNEHKIRRSA-N 0 3 355.439 -1.081 20 0 FAADHN Cn1cc(CCC(=O)N[C@@H]2CCCC[C@H]2NCC(=O)NC(N)=O)nn1 ZINC001230383990 793930238 /nfs/dbraw/zinc/93/02/38/793930238.db2.gz WVQQNMQHASSSKW-VXGBXAGGSA-N 0 3 351.411 -1.040 20 0 FAADHN NC(=O)NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)C[C@H]1CC(=O)NC1=O ZINC001230394085 793930126 /nfs/dbraw/zinc/93/01/26/793930126.db2.gz ZKEZSHUSDMJMBE-IVZWLZJFSA-N 0 3 353.379 -1.749 20 0 FAADHN NC(=O)NC(=O)CN[C@@H]1CCCC[C@H]1NC(=O)C[C@@H]1CC(=O)NC1=O ZINC001230394086 793930290 /nfs/dbraw/zinc/93/02/90/793930290.db2.gz ZKEZSHUSDMJMBE-OPRDCNLKSA-N 0 3 353.379 -1.749 20 0 FAADHN C[C@@H]1[C@H](C(=O)NCC[C@H]2CN(CC(N)=O)CCS2(=O)=O)CCN1C ZINC001230461888 793929947 /nfs/dbraw/zinc/92/99/47/793929947.db2.gz HVAUGXYFMXPFBP-FRRDWIJNSA-N 0 3 360.480 -1.583 20 0 FAADHN C[C@@H]1[C@H](C(=O)NCC[C@@H]2CN(CC(N)=O)CCS2(=O)=O)CCN1C ZINC001230461889 793929853 /nfs/dbraw/zinc/92/98/53/793929853.db2.gz HVAUGXYFMXPFBP-JHJVBQTASA-N 0 3 360.480 -1.583 20 0 FAADHN COC(=O)[C@@H]1C[C@@H](C(=O)OC)CN(Cc2cn(C)c(=O)n(C)c2=O)C1 ZINC001231770605 793936416 /nfs/dbraw/zinc/93/64/16/793936416.db2.gz ONGAJNXNSCDJLI-GHMZBOCLSA-N 0 3 353.375 -1.132 20 0 FAADHN COC(=O)[C@@H]1C[C@H](C(=O)OC)CN(Cc2cn(C)c(=O)n(C)c2=O)C1 ZINC001231770609 793936639 /nfs/dbraw/zinc/93/66/39/793936639.db2.gz ONGAJNXNSCDJLI-PHIMTYICSA-N 0 3 353.375 -1.132 20 0 FAADHN COC(=O)[C@H]1C[C@H](C(=O)OC)CN(Cc2cn(C)c(=O)n(C)c2=O)C1 ZINC001231770610 793936479 /nfs/dbraw/zinc/93/64/79/793936479.db2.gz ONGAJNXNSCDJLI-QWRGUYRKSA-N 0 3 353.375 -1.132 20 0 FAADHN Cn1cc(CN2CCN(CCN3CCOCC3)CC2)c(=O)n(C)c1=O ZINC001231770864 793936508 /nfs/dbraw/zinc/93/65/08/793936508.db2.gz AELZVEMVBJDXBJ-UHFFFAOYSA-N 0 3 351.451 -1.466 20 0 FAADHN CN(C)S(=O)(=O)N1CC(NC(=O)N[C@@H]2CCCN(CCCO)C2)C1 ZINC001233944641 793946892 /nfs/dbraw/zinc/94/68/92/793946892.db2.gz MLWKGLMRXAZLTM-GFCCVEGCSA-N 0 3 363.484 -1.377 20 0 FAADHN CN(C)S(=O)(=O)N1CC(NC(=O)N[C@H]2CCCN(CCCO)C2)C1 ZINC001233944648 793946872 /nfs/dbraw/zinc/94/68/72/793946872.db2.gz MLWKGLMRXAZLTM-LBPRGKRZSA-N 0 3 363.484 -1.377 20 0 FAADHN CN1CCN(CCNC(=O)NC[C@@H](O)CS(C)(=O)=O)CC1(C)C ZINC001235709043 793952530 /nfs/dbraw/zinc/95/25/30/793952530.db2.gz YCRQFMATKIHTGX-GFCCVEGCSA-N 0 3 350.485 -1.283 20 0 FAADHN CN1CCN(CCNC(=O)NC[C@H](O)CS(C)(=O)=O)CC1(C)C ZINC001235709051 793952042 /nfs/dbraw/zinc/95/20/42/793952042.db2.gz YCRQFMATKIHTGX-LBPRGKRZSA-N 0 3 350.485 -1.283 20 0 FAADHN CS(=O)(=O)c1cccc(S(=O)(=O)N[C@@]23CCN[C@H]2CC(=O)N3)c1 ZINC001238325726 793957256 /nfs/dbraw/zinc/95/72/56/793957256.db2.gz CRRUMJHTUFYVGS-AAEUAGOBSA-N 0 3 359.429 -1.054 20 0 FAADHN CS(=O)(=O)c1cccc(S(=O)(=O)N[C@]23CCN[C@@H]2CC(=O)N3)c1 ZINC001238325750 793957171 /nfs/dbraw/zinc/95/71/71/793957171.db2.gz CRRUMJHTUFYVGS-DGCLKSJQSA-N 0 3 359.429 -1.054 20 0 FAADHN CS(=O)(=O)c1cccc(S(=O)(=O)N[C@]23CCN[C@H]2CC(=O)N3)c1 ZINC001238325756 793957228 /nfs/dbraw/zinc/95/72/28/793957228.db2.gz CRRUMJHTUFYVGS-WCQYABFASA-N 0 3 359.429 -1.054 20 0 FAADHN CS(=O)(=O)c1cccc(S(=O)(=O)N[C@@]23CCN[C@@H]2CC(=O)N3)c1 ZINC001238325761 793957417 /nfs/dbraw/zinc/95/74/17/793957417.db2.gz CRRUMJHTUFYVGS-YPMHNXCESA-N 0 3 359.429 -1.054 20 0 FAADHN CS(=O)(=O)c1ccc(S(=O)(=O)N[C@@]23CCN[C@H]2CC(=O)N3)cc1 ZINC001238326314 793957130 /nfs/dbraw/zinc/95/71/30/793957130.db2.gz DIYZHXFPPVIDLM-AAEUAGOBSA-N 0 3 359.429 -1.054 20 0 FAADHN CS(=O)(=O)c1ccc(S(=O)(=O)N[C@]23CCN[C@@H]2CC(=O)N3)cc1 ZINC001238326322 793957580 /nfs/dbraw/zinc/95/75/80/793957580.db2.gz DIYZHXFPPVIDLM-DGCLKSJQSA-N 0 3 359.429 -1.054 20 0 FAADHN CS(=O)(=O)c1ccc(S(=O)(=O)N[C@]23CCN[C@H]2CC(=O)N3)cc1 ZINC001238326329 793957192 /nfs/dbraw/zinc/95/71/92/793957192.db2.gz DIYZHXFPPVIDLM-WCQYABFASA-N 0 3 359.429 -1.054 20 0 FAADHN CS(=O)(=O)c1ccc(S(=O)(=O)N[C@@]23CCN[C@@H]2CC(=O)N3)cc1 ZINC001238326342 793957443 /nfs/dbraw/zinc/95/74/43/793957443.db2.gz DIYZHXFPPVIDLM-YPMHNXCESA-N 0 3 359.429 -1.054 20 0 FAADHN CS(=O)(=O)c1ccccc1S(=O)(=O)N[C@@]12CCN[C@H]1CC(=O)N2 ZINC001238334311 793957340 /nfs/dbraw/zinc/95/73/40/793957340.db2.gz YILOKEYFMLVBTK-AAEUAGOBSA-N 0 3 359.429 -1.054 20 0 FAADHN CS(=O)(=O)c1ccccc1S(=O)(=O)N[C@]12CCN[C@@H]1CC(=O)N2 ZINC001238334314 793957489 /nfs/dbraw/zinc/95/74/89/793957489.db2.gz YILOKEYFMLVBTK-DGCLKSJQSA-N 0 3 359.429 -1.054 20 0 FAADHN CS(=O)(=O)c1ccccc1S(=O)(=O)N[C@]12CCN[C@H]1CC(=O)N2 ZINC001238334318 793957184 /nfs/dbraw/zinc/95/71/84/793957184.db2.gz YILOKEYFMLVBTK-WCQYABFASA-N 0 3 359.429 -1.054 20 0 FAADHN CS(=O)(=O)c1ccccc1S(=O)(=O)N[C@@]12CCN[C@@H]1CC(=O)N2 ZINC001238334323 793957502 /nfs/dbraw/zinc/95/75/02/793957502.db2.gz YILOKEYFMLVBTK-YPMHNXCESA-N 0 3 359.429 -1.054 20 0 FAADHN COc1ccc(OC)c([C@H](O)CNC(=O)CNS(=O)(=O)CCN)c1 ZINC001238564759 793958870 /nfs/dbraw/zinc/95/88/70/793958870.db2.gz IHXUDBHYVDIKQH-GFCCVEGCSA-N 0 3 361.420 -1.269 20 0 FAADHN COc1ccc(OC)c([C@@H](O)CNC(=O)CNS(=O)(=O)CCN)c1 ZINC001238564760 793958806 /nfs/dbraw/zinc/95/88/06/793958806.db2.gz IHXUDBHYVDIKQH-LBPRGKRZSA-N 0 3 361.420 -1.269 20 0 FAADHN COC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](C)NS(=O)(=O)CCN ZINC001238898465 793960960 /nfs/dbraw/zinc/96/09/60/793960960.db2.gz GDSBRUVKSOQPND-CIUDSAMLSA-N 0 3 352.413 -2.565 20 0 FAADHN COC(=O)[C@H](CCCCNS(=O)(=O)CCN)NC(=O)CNC(C)=O ZINC001238916845 793961027 /nfs/dbraw/zinc/96/10/27/793961027.db2.gz BFWPZXCEKBIDLF-NSHDSACASA-N 0 3 366.440 -2.171 20 0 FAADHN Cn1nc(C(=O)N2CCN(C)CC2)c2c1CN(S(=O)(=O)CCN)CC2 ZINC001239074379 793961052 /nfs/dbraw/zinc/96/10/52/793961052.db2.gz DPFIIGPBGSIXSU-UHFFFAOYSA-N 0 3 370.479 -1.546 20 0 FAADHN NCCS(=O)(=O)N1C[C@@H](NC(=O)c2cnccn2)[C@H]2OCCC[C@H]2C1 ZINC001239074702 793960890 /nfs/dbraw/zinc/96/08/90/793960890.db2.gz GURBCJODHFDDPN-YUTCNCBUSA-N 0 3 369.447 -1.026 20 0 FAADHN CN(C)C(=O)COC[C@H]1Cn2nccc2CN(S(=O)(=O)CCN)C1 ZINC001239076102 793961036 /nfs/dbraw/zinc/96/10/36/793961036.db2.gz ODOZVFRKDYHSHE-GFCCVEGCSA-N 0 3 359.452 -1.292 20 0 FAADHN CN(C)C(=O)COC[C@@H]1Cn2nccc2CN(S(=O)(=O)CCN)C1 ZINC001239076117 793960655 /nfs/dbraw/zinc/96/06/55/793960655.db2.gz ODOZVFRKDYHSHE-LBPRGKRZSA-N 0 3 359.452 -1.292 20 0 FAADHN COCC(=O)NCc1cc(=O)n2c(n1)CN(S(=O)(=O)CCN)CCC2 ZINC001239076266 793960844 /nfs/dbraw/zinc/96/08/44/793960844.db2.gz PIQJHYJZDBPFKM-UHFFFAOYSA-N 0 3 373.435 -2.000 20 0 FAADHN NCCS(=O)(=O)N1C[C@H](C(=O)N2CCOCC2)C2(C1)CCOCC2 ZINC001239076376 793960992 /nfs/dbraw/zinc/96/09/92/793960992.db2.gz STAKXBCAHPQJMM-CYBMUJFWSA-N 0 3 361.464 -1.138 20 0 FAADHN NCCS(=O)(=O)N1C[C@@H](C(=O)N2CCOCC2)C2(C1)CCOCC2 ZINC001239076377 793960867 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NCCS(=O)(=O)N1CCC2(CC1)CN(c1cncnc1)C(=O)CO2 ZINC001239082321 793961988 /nfs/dbraw/zinc/96/19/88/793961988.db2.gz RHUCBUYFAIKOQI-UHFFFAOYSA-N 0 3 355.420 -1.037 20 0 FAADHN NCCS(=O)(=O)N1C[C@@H](NC(=O)c2cnccn2)[C@@H]2OCCC[C@@H]21 ZINC001239082362 793961688 /nfs/dbraw/zinc/96/16/88/793961688.db2.gz SAUOLUULPWCZHY-AGIUHOORSA-N 0 3 355.420 -1.273 20 0 FAADHN NCCS(=O)(=O)N1CC[C@@H]2[C@@H](CO[C@H]2CC(=O)N2CCOCC2)C1 ZINC001239082435 793961625 /nfs/dbraw/zinc/96/16/25/793961625.db2.gz QXFMEXVNVMAFDA-MCIONIFRSA-N 0 3 361.464 -1.139 20 0 FAADHN CC(C)CN1C[C@@]23CN(S(=O)(=O)CCN)C[C@@H](C[C@@H]2S1(=O)=O)O3 ZINC001239082444 793962114 /nfs/dbraw/zinc/96/21/14/793962114.db2.gz QYWLPQRXUDDWLH-AGIUHOORSA-N 0 3 367.493 -1.212 20 0 FAADHN Cn1cc(N2C[C@@]3(COCCN(S(=O)(=O)CCN)C3)OCC2=O)cn1 ZINC001239082541 793962128 /nfs/dbraw/zinc/96/21/28/793962128.db2.gz XPJDJBAGHMOIII-AWEZNQCLSA-N 0 3 373.435 -1.857 20 0 FAADHN Cn1cc(N2C[C@]3(COCCN(S(=O)(=O)CCN)C3)OCC2=O)cn1 ZINC001239082545 793961582 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NCCS(=O)(=O)N1Cc2nccn2C[C@H](Cn2ncccc2=O)C1 ZINC001239083544 793961710 /nfs/dbraw/zinc/96/17/10/793961710.db2.gz WNOZBWFWQZCLQY-LBPRGKRZSA-N 0 3 352.420 -1.140 20 0 FAADHN Cn1ccnc1C(=O)N[C@@H]1CN(S(=O)(=O)CCN)[C@@H]2CCCO[C@H]12 ZINC001239083683 793961662 /nfs/dbraw/zinc/96/16/62/793961662.db2.gz CHMFOTWFDNVJMO-IJLUTSLNSA-N 0 3 357.436 -1.330 20 0 FAADHN COC(=O)[C@H]1CN(S(=O)(=O)c2nc3nc(Cl)ccn3n2)C[C@@H]1N ZINC001239134306 793961873 /nfs/dbraw/zinc/96/18/73/793961873.db2.gz HBZXIOVAKDMFCT-BQBZGAKWSA-N 0 3 360.783 -1.102 20 0 FAADHN COC(=O)[C@H]1CN(S(=O)(=O)c2nc3nc(Cl)ccn3n2)C[C@H]1N ZINC001239134307 793961917 /nfs/dbraw/zinc/96/19/17/793961917.db2.gz HBZXIOVAKDMFCT-NKWVEPMBSA-N 0 3 360.783 -1.102 20 0 FAADHN COC(=O)[C@@H]1CN(S(=O)(=O)c2nc3nc(Cl)ccn3n2)C[C@H]1N ZINC001239134308 793961800 /nfs/dbraw/zinc/96/18/00/793961800.db2.gz HBZXIOVAKDMFCT-RNFRBKRXSA-N 0 3 360.783 -1.102 20 0 FAADHN COC(=O)[C@@H]1CN(S(=O)(=O)c2nc3nc(Cl)ccn3n2)C[C@@H]1N ZINC001239134309 793962062 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CC[C@@H](CNC(=O)[C@H]1C[C@H]1C(N)=O)NCc1cc(=O)n(C)c(=O)n1C ZINC001269472180 789685656 /nfs/dbraw/zinc/68/56/56/789685656.db2.gz WRDRZMWRTORUDH-WCQGTBRESA-N 0 3 351.407 -1.810 20 0 FAADHN CN1CCN(CCCN2CC3(CN(C(=O)CCO)C3)OCC2=O)CC1 ZINC001270095942 789697218 /nfs/dbraw/zinc/69/72/18/789697218.db2.gz QAQRSTVORKBKCA-UHFFFAOYSA-N 0 3 354.451 -1.554 20 0 FAADHN CCCNC(=O)NC(=O)CNC[C@@H]1CCCN1C(=O)[C@H]1C[C@H]1C(N)=O ZINC001270136268 789699484 /nfs/dbraw/zinc/69/94/84/789699484.db2.gz GHJUFZYNEJTBQT-TUAOUCFPSA-N 0 3 353.423 -1.076 20 0 FAADHN CCCNC(=O)NC(=O)CNC[C@H]1CCCN1C(=O)[C@H]1C[C@H]1C(N)=O ZINC001270136269 789699438 /nfs/dbraw/zinc/69/94/38/789699438.db2.gz GHJUFZYNEJTBQT-UTUOFQBUSA-N 0 3 353.423 -1.076 20 0 FAADHN CN(C)CCN1C(=O)COCC12CN(C(=O)[C@@H]1CCN(C)C(=O)C1)C2 ZINC001270171095 789700592 /nfs/dbraw/zinc/70/05/92/789700592.db2.gz LASPEEUSWDIWJZ-CYBMUJFWSA-N 0 3 352.435 -1.144 20 0 FAADHN CN(C)CCN1C(=O)COCC12CN(C(=O)[C@H]1CCN(C)C(=O)C1)C2 ZINC001270171096 789700572 /nfs/dbraw/zinc/70/05/72/789700572.db2.gz LASPEEUSWDIWJZ-ZDUSSCGKSA-N 0 3 352.435 -1.144 20 0 FAADHN CN(C)CCN1CC2(CN(C(=O)[C@@H]3CCN(C)C(=O)C3)C2)OCC1=O ZINC001270171358 789700403 /nfs/dbraw/zinc/70/04/03/789700403.db2.gz MIKQPVSGXYGTLQ-CYBMUJFWSA-N 0 3 352.435 -1.144 20 0 FAADHN CN(C)CCN1CC2(CN(C(=O)[C@H]3CCN(C)C(=O)C3)C2)OCC1=O ZINC001270171359 789700189 /nfs/dbraw/zinc/70/01/89/789700189.db2.gz MIKQPVSGXYGTLQ-ZDUSSCGKSA-N 0 3 352.435 -1.144 20 0 FAADHN O=C(CN(CCO)CCO)N1C[C@H]2CC[C@@H](C1)N2CCn1ccnc1 ZINC001270176490 789702236 /nfs/dbraw/zinc/70/22/36/789702236.db2.gz YODLYBVUDXRTGS-IYBDPMFKSA-N 0 3 351.451 -1.155 20 0 FAADHN O=C(CNC[C@H]1CCCN1C(=O)[C@]12C[C@H]1COC2)N1CCNC(=O)C1 ZINC001270210849 789703606 /nfs/dbraw/zinc/70/36/06/789703606.db2.gz BYHSKCBHMSRWPL-AHIWAGSCSA-N 0 3 350.419 -1.438 20 0 FAADHN CN(C)CCN1C(=O)COCC12CN(C(=O)[C@@H](CO)n1ccnc1)C2 ZINC001270302303 789706499 /nfs/dbraw/zinc/70/64/99/789706499.db2.gz XWBSVGGFPSGAGJ-CYBMUJFWSA-N 0 3 351.407 -1.582 20 0 FAADHN CN(C)CCN1C(=O)COCC12CN(C(=O)[C@H](CO)n1ccnc1)C2 ZINC001270302304 789706081 /nfs/dbraw/zinc/70/60/81/789706081.db2.gz XWBSVGGFPSGAGJ-ZDUSSCGKSA-N 0 3 351.407 -1.582 20 0 FAADHN CN(C)CCN1CC2(CN(C(=O)[C@@H](CO)n3ccnc3)C2)OCC1=O ZINC001270302327 789706145 /nfs/dbraw/zinc/70/61/45/789706145.db2.gz YQOIYNXISFEBAV-CYBMUJFWSA-N 0 3 351.407 -1.582 20 0 FAADHN CN(C)CCN1CC2(CN(C(=O)[C@H](CO)n3ccnc3)C2)OCC1=O ZINC001270302328 789705972 /nfs/dbraw/zinc/70/59/72/789705972.db2.gz YQOIYNXISFEBAV-ZDUSSCGKSA-N 0 3 351.407 -1.582 20 0 FAADHN CC(=O)N1CSC[C@@H]1C(=O)N1CC2(C1)CN(CCN(C)C)C(=O)CO2 ZINC001270313154 789706100 /nfs/dbraw/zinc/70/61/00/789706100.db2.gz XOMKJRHAEXHYBR-CYBMUJFWSA-N 0 3 370.475 -1.091 20 0 FAADHN CC(=O)N1CSC[C@H]1C(=O)N1CC2(C1)CN(CCN(C)C)C(=O)CO2 ZINC001270313155 789706230 /nfs/dbraw/zinc/70/62/30/789706230.db2.gz XOMKJRHAEXHYBR-ZDUSSCGKSA-N 0 3 370.475 -1.091 20 0 FAADHN CC(=O)N1CSC[C@@H]1C(=O)N1CC2(C1)COCC(=O)N2CCN(C)C ZINC001270313330 789707321 /nfs/dbraw/zinc/70/73/21/789707321.db2.gz ZYXISOQCXSTHOE-CYBMUJFWSA-N 0 3 370.475 -1.091 20 0 FAADHN CC(=O)N1CSC[C@H]1C(=O)N1CC2(C1)COCC(=O)N2CCN(C)C ZINC001270313331 789707361 /nfs/dbraw/zinc/70/73/61/789707361.db2.gz ZYXISOQCXSTHOE-ZDUSSCGKSA-N 0 3 370.475 -1.091 20 0 FAADHN CN(C)CCN1C[C@@]2(F)CN(C(=O)Cc3nc(N)n[nH]3)C[C@@]2(F)C1=O ZINC001270314318 789707032 /nfs/dbraw/zinc/70/70/32/789707032.db2.gz JXVLOUIVLCBYSZ-ZIAGYGMSSA-N 0 3 357.365 -1.408 20 0 FAADHN CN(C)CCN1C[C@]2(CCN(C(=O)C3=NNC(=O)CC3)C2)OCC1=O ZINC001270314465 789707494 /nfs/dbraw/zinc/70/74/94/789707494.db2.gz LOEVPPNKQXLRTD-INIZCTEOSA-N 0 3 351.407 -1.356 20 0 FAADHN CN(C)CCN1C[C@@]2(CCN(C(=O)C3=NNC(=O)CC3)C2)OCC1=O ZINC001270314466 789707476 /nfs/dbraw/zinc/70/74/76/789707476.db2.gz LOEVPPNKQXLRTD-MRXNPFEDSA-N 0 3 351.407 -1.356 20 0 FAADHN CN(C)CCN1C[C@@]2(F)CN(C(=O)C3=NNC(=O)CC3)C[C@@]2(F)C1=O ZINC001270314755 789707201 /nfs/dbraw/zinc/70/72/01/789707201.db2.gz QEGYZZRZPZEXGF-HUUCEWRRSA-N 0 3 357.361 -1.085 20 0 FAADHN CN(C)CCN1C[C@@]2(CCN(C(=O)Cc3nc(N)n[nH]3)C2)OCC1=O ZINC001270314818 789707427 /nfs/dbraw/zinc/70/74/27/789707427.db2.gz RYHNHLDDKNPEKO-HNNXBMFYSA-N 0 3 351.411 -1.679 20 0 FAADHN CN(C)CCN1C[C@]2(CCN(C(=O)Cc3nc(N)n[nH]3)C2)OCC1=O ZINC001270314819 789707244 /nfs/dbraw/zinc/70/72/44/789707244.db2.gz RYHNHLDDKNPEKO-OAHLLOKOSA-N 0 3 351.411 -1.679 20 0 FAADHN CN(C)CCN1CC2(CN(C(=O)CN3C(=O)CNC3=O)C2)OCC1=O ZINC001270351926 790316847 /nfs/dbraw/zinc/31/68/47/790316847.db2.gz ADCVMNDCBLPIGA-UHFFFAOYSA-N 0 3 353.379 -2.460 20 0 FAADHN CN(C)CCN1C(=O)COCC12CN(C(=O)CN1C(=O)CNC1=O)C2 ZINC001270352123 790317892 /nfs/dbraw/zinc/31/78/92/790317892.db2.gz BFHBIXMGXMZENH-UHFFFAOYSA-N 0 3 353.379 -2.460 20 0 FAADHN CN(C)CCN1CC[C@@]2(CCN(C(=O)CN3C(=O)CNC3=O)C2)C1=O ZINC001270353464 790316960 /nfs/dbraw/zinc/31/69/60/790316960.db2.gz KWINLCBWKCUCKR-INIZCTEOSA-N 0 3 351.407 -1.449 20 0 FAADHN CN(C)CCN1CC[C@]2(CCN(C(=O)CN3C(=O)CNC3=O)C2)C1=O ZINC001270353465 790316528 /nfs/dbraw/zinc/31/65/28/790316528.db2.gz KWINLCBWKCUCKR-MRXNPFEDSA-N 0 3 351.407 -1.449 20 0 FAADHN CN(C)CCN1CC[C@@]2(CCCN2C(=O)CN2C(=O)CNC2=O)C1=O ZINC001270353666 790317253 /nfs/dbraw/zinc/31/72/53/790317253.db2.gz MEAZZVAPMIHFNY-INIZCTEOSA-N 0 3 351.407 -1.307 20 0 FAADHN CN(C)CCN1CC[C@]2(CCCN2C(=O)CN2C(=O)CNC2=O)C1=O ZINC001270353668 790317355 /nfs/dbraw/zinc/31/73/55/790317355.db2.gz MEAZZVAPMIHFNY-MRXNPFEDSA-N 0 3 351.407 -1.307 20 0 FAADHN CN(C)CCN1C(=O)CC[C@@H]2[C@H]1CCN2C(=O)CN1C(=O)CNC1=O ZINC001270354059 790317915 /nfs/dbraw/zinc/31/79/15/790317915.db2.gz QNAOTBXYUIKFHE-VXGBXAGGSA-N 0 3 351.407 -1.308 20 0 FAADHN CC(=O)N[C@@H](CO)C(=O)N1CC[C@@]2(C1)CN(CCN(C)C)C(=O)CO2 ZINC001270381624 790319071 /nfs/dbraw/zinc/31/90/71/790319071.db2.gz OYCSFQSNKCMFIH-BBRMVZONSA-N 0 3 356.423 -2.125 20 0 FAADHN CC(=O)N[C@@H](CO)C(=O)N1CC[C@]2(C1)CN(CCN(C)C)C(=O)CO2 ZINC001270381632 790319267 /nfs/dbraw/zinc/31/92/67/790319267.db2.gz OYCSFQSNKCMFIH-XJKSGUPXSA-N 0 3 356.423 -2.125 20 0 FAADHN CC(=O)N[C@@H](CO)C(=O)N1CCC2(CCN(CCN(C)C)C2=O)CC1 ZINC001270382452 790318940 /nfs/dbraw/zinc/31/89/40/790318940.db2.gz VQSXNHCLKQYKGQ-AWEZNQCLSA-N 0 3 354.451 -1.114 20 0 FAADHN CC(=O)N[C@@H](CO)C(=O)N1C[C@@]2(F)C(=O)N(CCN(C)C)C[C@@]2(F)C1 ZINC001270382511 790318840 /nfs/dbraw/zinc/31/88/40/790318840.db2.gz VSTIXAZVRPAIPN-NILFDRSVSA-N 0 3 362.377 -1.854 20 0 FAADHN CN(C)CCN1CC2(CN(C(=O)C3=NN(C)C(=O)CC3)C2)OCC1=O ZINC001270439503 790319711 /nfs/dbraw/zinc/31/97/11/790319711.db2.gz CTTAGIZZADHMCJ-UHFFFAOYSA-N 0 3 351.407 -1.404 20 0 FAADHN CN(C)CCN1C(=O)COCC12CN(C(=O)C1=NN(C)C(=O)CC1)C2 ZINC001270442370 790319806 /nfs/dbraw/zinc/31/98/06/790319806.db2.gz QGJJIMSHPQURJF-UHFFFAOYSA-N 0 3 351.407 -1.404 20 0 FAADHN CN(C)CCN1C[C@@]2(CCN(C(=O)[C@@H]3CSCC(=O)N3)C2)OCC1=O ZINC001270474353 790319641 /nfs/dbraw/zinc/31/96/41/790319641.db2.gz DKQOPVYUJMPMSN-BLLLJJGKSA-N 0 3 370.475 -1.391 20 0 FAADHN CN(C)CCN1C[C@]2(CCN(C(=O)[C@@H]3CSCC(=O)N3)C2)OCC1=O ZINC001270474354 790320158 /nfs/dbraw/zinc/32/01/58/790320158.db2.gz DKQOPVYUJMPMSN-LRDDRELGSA-N 0 3 370.475 -1.391 20 0 FAADHN CN(C)CCN1C[C@@]2(CCN(C(=O)[C@H]3CSCC(=O)N3)C2)OCC1=O ZINC001270474355 790320245 /nfs/dbraw/zinc/32/02/45/790320245.db2.gz DKQOPVYUJMPMSN-MLGOLLRUSA-N 0 3 370.475 -1.391 20 0 FAADHN CN(C)CCN1C[C@]2(CCN(C(=O)[C@H]3CSCC(=O)N3)C2)OCC1=O ZINC001270474356 790319777 /nfs/dbraw/zinc/31/97/77/790319777.db2.gz DKQOPVYUJMPMSN-WBMJQRKESA-N 0 3 370.475 -1.391 20 0 FAADHN CN(C)CCN1CC2(CN(C(=O)[C@H]3CSCC(=O)N3)C2)OCC1=O ZINC001270474659 790319671 /nfs/dbraw/zinc/31/96/71/790319671.db2.gz HJRBXWUJYZVAIJ-LLVKDONJSA-N 0 3 356.448 -1.781 20 0 FAADHN CN(C)CCN1CC2(CN(C(=O)[C@@H]3CSCC(=O)N3)C2)OCC1=O ZINC001270474661 790320224 /nfs/dbraw/zinc/32/02/24/790320224.db2.gz HJRBXWUJYZVAIJ-NSHDSACASA-N 0 3 356.448 -1.781 20 0 FAADHN CN(C)CCN1C(=O)COCC12CN(C(=O)[C@H]1CSCC(=O)N1)C2 ZINC001270476347 790320964 /nfs/dbraw/zinc/32/09/64/790320964.db2.gz XXQSBKGYLPJYBH-LLVKDONJSA-N 0 3 356.448 -1.781 20 0 FAADHN CN(C)CCN1C(=O)COCC12CN(C(=O)[C@@H]1CSCC(=O)N1)C2 ZINC001270476348 790320667 /nfs/dbraw/zinc/32/06/67/790320667.db2.gz XXQSBKGYLPJYBH-NSHDSACASA-N 0 3 356.448 -1.781 20 0 FAADHN CN(C)CCN1C[C@@]2(F)CN(C(=O)CNS(C)(=O)=O)C[C@@]2(F)C1=O ZINC001270502506 790322454 /nfs/dbraw/zinc/32/24/54/790322454.db2.gz IMBBTGXVPIKVBA-CHWSQXEVSA-N 0 3 368.406 -1.802 20 0 FAADHN CN(C)CCN1C[C@@]2(CCN(C(=O)CNS(C)(=O)=O)C2)OCC1=O ZINC001270502762 790323532 /nfs/dbraw/zinc/32/35/32/790323532.db2.gz NYJNLKWDPKYNQX-AWEZNQCLSA-N 0 3 362.452 -2.073 20 0 FAADHN CN(C)CCN1C[C@]2(CCN(C(=O)CNS(C)(=O)=O)C2)OCC1=O ZINC001270502763 790323268 /nfs/dbraw/zinc/32/32/68/790323268.db2.gz NYJNLKWDPKYNQX-CQSZACIVSA-N 0 3 362.452 -2.073 20 0 FAADHN CN(C)CCN1CCC2(CCN(C(=O)CNS(C)(=O)=O)CC2)C1=O ZINC001270503111 790323467 /nfs/dbraw/zinc/32/34/67/790323467.db2.gz WCDPEMWQZUZDKZ-UHFFFAOYSA-N 0 3 360.480 -1.062 20 0 FAADHN C[C@@H](O)C(=O)N1CC2(C1)CN(CCCN1CCN(C)CC1)C(=O)CO2 ZINC001270504013 790324692 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CCCN(C)CC(=O)N1C[C@@H](NC(=O)CC2CS(=O)(=O)C2)[C@@H](O)C1 ZINC001289666264 794333708 /nfs/dbraw/zinc/33/37/08/794333708.db2.gz KPOUCQAKPIFAPM-OLZOCXBDSA-N 0 3 361.464 -1.549 20 0 FAADHN CCN(C)C(C)(C)C(=O)N1C[C@@H](NC(=O)C(=O)NCC(F)F)[C@@H](O)C1 ZINC001289667367 794334711 /nfs/dbraw/zinc/33/47/11/794334711.db2.gz JXMNOGQGKGCLGB-ZJUUUORDSA-N 0 3 364.393 -1.214 20 0 FAADHN CC[C@@H](C(=O)N1C[C@@H](NC(=O)C(=O)NCC(F)F)[C@@H](O)C1)N(C)C ZINC001289668140 794334594 /nfs/dbraw/zinc/33/45/94/794334594.db2.gz VROORFSQSYGFDW-UTLUCORTSA-N 0 3 350.366 -1.604 20 0 FAADHN CC(C)N(C)CC(=O)N1C[C@@H](NC(=O)C[C@H]2CC(=O)NC2=O)[C@@H](O)C1 ZINC001289675459 794336716 /nfs/dbraw/zinc/33/67/16/794336716.db2.gz YEUAASWBYZOOKV-TUAOUCFPSA-N 0 3 354.407 -1.933 20 0 FAADHN CC(C)N(C)CC(=O)N1C[C@@H](NC(=O)C[C@@H]2CC(=O)NC2=O)[C@@H](O)C1 ZINC001289675460 794336648 /nfs/dbraw/zinc/33/66/48/794336648.db2.gz YEUAASWBYZOOKV-UTUOFQBUSA-N 0 3 354.407 -1.933 20 0 FAADHN 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CC[C@@H](C(=O)N[C@@H]1CN(C(=O)CCS(=O)(=O)NC)C[C@@H]1O)N(C)C ZINC001289688605 794338213 /nfs/dbraw/zinc/33/82/13/794338213.db2.gz QLEGOEBORYFIHB-WOPDTQHZSA-N 0 3 364.468 -2.046 20 0 FAADHN CC[C@@H](C(=O)N[C@@H]1CN(C(=O)CCCS(C)(=O)=O)C[C@@H]1O)N(C)C ZINC001289688856 794339134 /nfs/dbraw/zinc/33/91/34/794339134.db2.gz WIACCXBQOSITMS-AGIUHOORSA-N 0 3 363.480 -1.161 20 0 FAADHN CC[C@H](C(=O)N[C@@H]1CN(C(=O)CCCS(C)(=O)=O)C[C@@H]1O)N(C)C ZINC001289688857 794338948 /nfs/dbraw/zinc/33/89/48/794338948.db2.gz WIACCXBQOSITMS-UPJWGTAASA-N 0 3 363.480 -1.161 20 0 FAADHN CC[C@@H](C(=O)N[C@@H]1CN(C(=O)CN2CCOCC2=O)C[C@@H]1O)N(C)C ZINC001289688947 794339241 /nfs/dbraw/zinc/33/92/41/794339241.db2.gz YSCIQTOUNWIGNA-AGIUHOORSA-N 0 3 356.423 -2.127 20 0 FAADHN CC[C@H](C(=O)N[C@@H]1CN(C(=O)C(=O)NCC(F)F)C[C@@H]1O)N(C)C ZINC001289689005 794339046 /nfs/dbraw/zinc/33/90/46/794339046.db2.gz YXNLJNOSQWEISX-BBBLOLIVSA-N 0 3 350.366 -1.604 20 0 FAADHN CC[C@@H](C(=O)N[C@@H]1CN(C(=O)C(=O)NCC(F)F)C[C@@H]1O)N(C)C 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