smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name C[C@@H](C(=O)N1CCOCC1)N1CC[NH+](CCC(=O)N2CC[NH2+]CC2)CC1 ZINC000262051400 483308345 /nfs/dbraw/zinc/30/83/45/483308345.db2.gz IHZODZQNXKQBOJ-INIZCTEOSA-N 2 0 367.494 -1.327 20 0 FAADRP C[C@H](C(=O)N1CCOCC1)N1CC[NH+](CCC(=O)N2CC[NH2+]CC2)CC1 ZINC000262051403 483308745 /nfs/dbraw/zinc/30/87/45/483308745.db2.gz IHZODZQNXKQBOJ-MRXNPFEDSA-N 2 0 367.494 -1.327 20 0 FAADRP C[NH+](C)CCN1C[C@@H](C(=O)N2CCC[C@H](C(=O)NCC[NH3+])C2)CC1=O ZINC000262553905 482918564 /nfs/dbraw/zinc/91/85/64/482918564.db2.gz VBBILYVKPVXTQB-KBPBESRZSA-N 2 0 353.467 -1.290 20 0 FAADRP C[NH+](C)CCN1C[C@@H](C(=O)N2CCC[C@@H](C(=O)NCC[NH3+])C2)CC1=O ZINC000262553906 482919160 /nfs/dbraw/zinc/91/91/60/482919160.db2.gz VBBILYVKPVXTQB-KGLIPLIRSA-N 2 0 353.467 -1.290 20 0 FAADRP C[NH+](C)CCN1C[C@H](C(=O)N2CCC[C@H](C(=O)NCC[NH3+])C2)CC1=O ZINC000262553907 483546093 /nfs/dbraw/zinc/54/60/93/483546093.db2.gz VBBILYVKPVXTQB-UONOGXRCSA-N 2 0 353.467 -1.290 20 0 FAADRP C[NH+](C)CCN1C[C@H](C(=O)N2CCC[C@@H](C(=O)NCC[NH3+])C2)CC1=O ZINC000262553908 482918471 /nfs/dbraw/zinc/91/84/71/482918471.db2.gz VBBILYVKPVXTQB-ZIAGYGMSSA-N 2 0 353.467 -1.290 20 0 FAADRP CN1CCN(S(=O)(=O)N2CCN(C(=O)[C@H]3COCCN3)CC2)CC1 ZINC000262630916 483557813 /nfs/dbraw/zinc/55/78/13/483557813.db2.gz MKIUBCVDSITDEK-CYBMUJFWSA-N 2 0 361.468 -2.389 20 0 FAADRP CN1CCN(S(=O)(=O)N2CCN(C(=O)[C@@H]3COCCN3)CC2)CC1 ZINC000262630918 483558401 /nfs/dbraw/zinc/55/84/01/483558401.db2.gz MKIUBCVDSITDEK-ZDUSSCGKSA-N 2 0 361.468 -2.389 20 0 FAADRP CC(C)[C@H]([NH3+])C(=O)NCC(=O)N1CCN(C(=O)C[NH+]2CCCC2)CC1 ZINC000263078603 483310712 /nfs/dbraw/zinc/31/07/12/483310712.db2.gz CVEBPYZOLJNSPG-INIZCTEOSA-N 2 0 353.467 -1.148 20 0 FAADRP CC(C)[C@H]([NH3+])C(=O)NCC(=O)Nc1cnn(CC(=O)NCC[NH+](C)C)c1 ZINC000263255793 483589748 /nfs/dbraw/zinc/58/97/48/483589748.db2.gz QQERIRZNVHGVDT-HNNXBMFYSA-N 2 0 367.454 -1.401 20 0 FAADRP C[N@@H+]1CCC[C@H]1C(=O)N1CCN(C(=O)C(=O)NCCn2ccnc2)CC1 ZINC000283276107 483050250 /nfs/dbraw/zinc/05/02/50/483050250.db2.gz GFFNTDDEMKTORI-AWEZNQCLSA-N 2 0 362.434 -1.236 20 0 FAADRP C[N@@H+]1CCC[C@@H]1C(=O)N1CCN(C(=O)C(=O)NCCn2ccnc2)CC1 ZINC000283276109 483050113 /nfs/dbraw/zinc/05/01/13/483050113.db2.gz GFFNTDDEMKTORI-CQSZACIVSA-N 2 0 362.434 -1.236 20 0 FAADRP O=C(NCCC[NH+]1CCN(c2cc[nH+]cc2)CC1)C(=O)N1CCNC(=O)C1 ZINC000286130814 483064053 /nfs/dbraw/zinc/06/40/53/483064053.db2.gz UNOWKHBFYJKGKZ-UHFFFAOYSA-N 2 0 374.445 -1.332 20 0 FAADRP Cn1ccnc1CNC(=O)C(=O)N1CCN(C(=O)[C@H]2CCC[N@@H+]2C)CC1 ZINC000286732003 483067771 /nfs/dbraw/zinc/06/77/71/483067771.db2.gz FRDWLSWUCCROBH-CYBMUJFWSA-N 2 0 362.434 -1.199 20 0 FAADRP Cn1ccnc1CNC(=O)C(=O)N1CCN(C(=O)[C@@H]2CCC[N@@H+]2C)CC1 ZINC000286732008 483067448 /nfs/dbraw/zinc/06/74/48/483067448.db2.gz FRDWLSWUCCROBH-ZDUSSCGKSA-N 2 0 362.434 -1.199 20 0 FAADRP C[C@@H]1C[C@H](O)C[NH+]1CC(=O)N1CCN(C(=O)C[N@H+]2C[C@@H](O)C[C@H]2C)CC1 ZINC000328856056 483109371 /nfs/dbraw/zinc/10/93/71/483109371.db2.gz XEHGAQMKHRHIPS-WCVJEAGWSA-N 2 0 368.478 -1.433 20 0 FAADRP [NH3+][C@@H]1CCCN(C(=O)C(=O)N2CCN(C(=O)C[NH+]3CCCC3)CC2)C1 ZINC000331569751 272832610 /nfs/dbraw/zinc/83/26/10/272832610.db2.gz DDWDEJGTVBVGRT-CQSZACIVSA-N 2 0 351.451 -1.297 20 0 FAADRP C[C@H]1C[NH2+]CCN1C(=O)C(=O)N1CCN(C(=O)C[NH+]2CCCC2)CC1 ZINC000331596781 483165043 /nfs/dbraw/zinc/16/50/43/483165043.db2.gz HVQADSRYAZCNFD-AWEZNQCLSA-N 2 0 351.451 -1.427 20 0 FAADRP C[C@@H]1C[NH2+]CCN1C(=O)C(=O)N1CCN(C(=O)C[NH+]2CCCC2)CC1 ZINC000331596783 272832259 /nfs/dbraw/zinc/83/22/59/272832259.db2.gz HVQADSRYAZCNFD-CQSZACIVSA-N 2 0 351.451 -1.427 20 0 FAADRP C[C@H]1CN(C(=O)C(=O)N2CCN(C(=O)C[NH+]3CCCC3)CC2)CC[NH2+]1 ZINC000331601000 483165146 /nfs/dbraw/zinc/16/51/46/483165146.db2.gz IMWYWBNXQJUTTP-AWEZNQCLSA-N 2 0 351.451 -1.427 20 0 FAADRP C[C@@H]1CN(C(=O)C(=O)N2CCN(C(=O)C[NH+]3CCCC3)CC2)CC[NH2+]1 ZINC000331601003 483166201 /nfs/dbraw/zinc/16/62/01/483166201.db2.gz IMWYWBNXQJUTTP-CQSZACIVSA-N 2 0 351.451 -1.427 20 0 FAADRP CC1(C)CN(C(=O)C(=O)N2CCN(C(=O)C[NH+]3CCCC3)CC2)CC[NH2+]1 ZINC000331601222 483165761 /nfs/dbraw/zinc/16/57/61/483165761.db2.gz IRFRXZIKJFUFOI-UHFFFAOYSA-N 2 0 365.478 -1.037 20 0 FAADRP CC[N@@H+]1CC[C@@H](NC(=O)C(=O)N2CCN(C(=O)[C@@H]3CCC[NH+]3C)CC2)C1 ZINC000331604205 483165959 /nfs/dbraw/zinc/16/59/59/483165959.db2.gz DSCPRWAVQPMYNK-CABCVRRESA-N 2 0 365.478 -1.038 20 0 FAADRP CC[N@@H+]1CC[C@H](NC(=O)C(=O)N2CCN(C(=O)[C@@H]3CCC[NH+]3C)CC2)C1 ZINC000331604208 483165085 /nfs/dbraw/zinc/16/50/85/483165085.db2.gz DSCPRWAVQPMYNK-GJZGRUSLSA-N 2 0 365.478 -1.038 20 0 FAADRP CC[N@@H+]1CC[C@@H](NC(=O)C(=O)N2CCN(C(=O)[C@H]3CCC[NH+]3C)CC2)C1 ZINC000331604212 483166221 /nfs/dbraw/zinc/16/62/21/483166221.db2.gz DSCPRWAVQPMYNK-HUUCEWRRSA-N 2 0 365.478 -1.038 20 0 FAADRP CC[N@@H+]1CC[C@H](NC(=O)C(=O)N2CCN(C(=O)[C@H]3CCC[NH+]3C)CC2)C1 ZINC000331604216 483165625 /nfs/dbraw/zinc/16/56/25/483165625.db2.gz DSCPRWAVQPMYNK-LSDHHAIUSA-N 2 0 365.478 -1.038 20 0 FAADRP CN(C(=O)C(=O)N1CCN(C(=O)[C@@H]2CCC[N@@H+]2C)CC1)[C@H]1C[NH2+]C[C@@H]1O ZINC000331605777 483164905 /nfs/dbraw/zinc/16/49/05/483164905.db2.gz VURJZHCBPNMLQP-IHRRRGAJSA-N 2 0 367.450 -2.458 20 0 FAADRP CN(C(=O)C(=O)N1CCN(C(=O)[C@H]2CCC[N@@H+]2C)CC1)[C@H]1C[NH2+]C[C@@H]1O ZINC000331605791 483165003 /nfs/dbraw/zinc/16/50/03/483165003.db2.gz VURJZHCBPNMLQP-RDBSUJKOSA-N 2 0 367.450 -2.458 20 0 FAADRP C[N@@H+]1CCC[C@@H]1C(=O)N1CCN(C(=O)C(=O)N[C@H]2CCC[C@@H]2C[NH3+])CC1 ZINC000331607014 483165209 /nfs/dbraw/zinc/16/52/09/483165209.db2.gz FCTSIARHYHNQJT-QLFBSQMISA-N 2 0 365.478 -1.005 20 0 FAADRP C[N@@H+]1CCC[C@@H]1C(=O)N1CCN(C(=O)C(=O)N[C@@H]2CCC[C@@H]2C[NH3+])CC1 ZINC000331607032 483165237 /nfs/dbraw/zinc/16/52/37/483165237.db2.gz FCTSIARHYHNQJT-RBSFLKMASA-N 2 0 365.478 -1.005 20 0 FAADRP C[N@@H+]1CCC[C@@H]1C(=O)N1CCN(C(=O)C(=O)N[C@@H]2CCC[C@H]2C[NH3+])CC1 ZINC000331607045 483164966 /nfs/dbraw/zinc/16/49/66/483164966.db2.gz FCTSIARHYHNQJT-RRFJBIMHSA-N 2 0 365.478 -1.005 20 0 FAADRP C[N@@H+]1CCC[C@@H]1C(=O)N1CCN(C(=O)C(=O)N[C@H]2CCC[C@H]2C[NH3+])CC1 ZINC000331607056 483166167 /nfs/dbraw/zinc/16/61/67/483166167.db2.gz FCTSIARHYHNQJT-SOUVJXGZSA-N 2 0 365.478 -1.005 20 0 FAADRP C[C@@H]1CN(C(=O)C(=O)N2CCN(C(=O)C[NH+]3CCCC3)CC2)C[C@H](C)[NH2+]1 ZINC000331608508 483165919 /nfs/dbraw/zinc/16/59/19/483165919.db2.gz JRNJFIIJAWSASA-GASCZTMLSA-N 2 0 365.478 -1.038 20 0 FAADRP C[C@H]1CN(C(=O)C(=O)N2CCN(C(=O)C[NH+]3CCCC3)CC2)C[C@H](C)[NH2+]1 ZINC000331608512 272832720 /nfs/dbraw/zinc/83/27/20/272832720.db2.gz JRNJFIIJAWSASA-GJZGRUSLSA-N 2 0 365.478 -1.038 20 0 FAADRP C[C@@H]1CN(C(=O)C(=O)N2CCN(C(=O)C[NH+]3CCCC3)CC2)C[C@@H](C)[NH2+]1 ZINC000331608514 483165176 /nfs/dbraw/zinc/16/51/76/483165176.db2.gz JRNJFIIJAWSASA-HUUCEWRRSA-N 2 0 365.478 -1.038 20 0 FAADRP C[C@@H]1CN(C(=O)C(=O)N2CCN(C(=O)C[NH+]3CCCC3)CC2)[C@@H](C)C[NH2+]1 ZINC000331626227 483167970 /nfs/dbraw/zinc/16/79/70/483167970.db2.gz MRRYLLMDQPJFJG-CABCVRRESA-N 2 0 365.478 -1.038 20 0 FAADRP C[C@H]1CN(C(=O)C(=O)N2CCN(C(=O)C[NH+]3CCCC3)CC2)[C@@H](C)C[NH2+]1 ZINC000331626234 483167343 /nfs/dbraw/zinc/16/73/43/483167343.db2.gz MRRYLLMDQPJFJG-GJZGRUSLSA-N 2 0 365.478 -1.038 20 0 FAADRP C[C@@H]1CN(C(=O)C(=O)N2CCN(C(=O)C[NH+]3CCCC3)CC2)[C@H](C)C[NH2+]1 ZINC000331626242 483167954 /nfs/dbraw/zinc/16/79/54/483167954.db2.gz MRRYLLMDQPJFJG-HUUCEWRRSA-N 2 0 365.478 -1.038 20 0 FAADRP C[C@@H]1C[NH2+][C@@H](C)CN1C(=O)C(=O)N1CCN(C(=O)C[NH+]2CCCC2)CC1 ZINC000331626246 483167562 /nfs/dbraw/zinc/16/75/62/483167562.db2.gz MRRYLLMDQPJFJG-LSDHHAIUSA-N 2 0 365.478 -1.038 20 0 FAADRP C[NH2+][C@H]1CCCN(C(=O)C(=O)N2CCN(C(=O)C[NH+]3CCCC3)CC2)C1 ZINC000331628032 483168132 /nfs/dbraw/zinc/16/81/32/483168132.db2.gz NASWLQWCDSUTBB-HNNXBMFYSA-N 2 0 365.478 -1.037 20 0 FAADRP C[NH2+][C@@H]1CCCN(C(=O)C(=O)N2CCN(C(=O)C[NH+]3CCCC3)CC2)C1 ZINC000331628034 483168155 /nfs/dbraw/zinc/16/81/55/483168155.db2.gz NASWLQWCDSUTBB-OAHLLOKOSA-N 2 0 365.478 -1.037 20 0 FAADRP [NH3+]C[C@H]1CN(C(=O)C(=O)N2CCN(C(=O)C[NH+]3CCCC3)CC2)CCO1 ZINC000331645909 483166979 /nfs/dbraw/zinc/16/69/79/483166979.db2.gz QIVMGPDBUMAPNJ-AWEZNQCLSA-N 2 0 367.450 -2.061 20 0 FAADRP [NH3+]C[C@@H]1CN(C(=O)C(=O)N2CCN(C(=O)C[NH+]3CCCC3)CC2)CCO1 ZINC000331645919 483167784 /nfs/dbraw/zinc/16/77/84/483167784.db2.gz QIVMGPDBUMAPNJ-CQSZACIVSA-N 2 0 367.450 -2.061 20 0 FAADRP C[NH+](C)[C@H]1CCN(C(=O)C(=O)N2CCC[C@@H](C(=O)N3CC[NH2+]CC3)C2)C1 ZINC000331774812 483170840 /nfs/dbraw/zinc/17/08/40/483170840.db2.gz JFRNYSRJDWTJJV-CABCVRRESA-N 2 0 365.478 -1.181 20 0 FAADRP C[NH+](C)[C@H]1CCN(C(=O)C(=O)N2CCC[C@H](C(=O)N3CC[NH2+]CC3)C2)C1 ZINC000331774816 483169374 /nfs/dbraw/zinc/16/93/74/483169374.db2.gz JFRNYSRJDWTJJV-GJZGRUSLSA-N 2 0 365.478 -1.181 20 0 FAADRP C[NH+](C)[C@@H]1CCN(C(=O)C(=O)N2CCC[C@@H](C(=O)N3CC[NH2+]CC3)C2)C1 ZINC000331774817 272833405 /nfs/dbraw/zinc/83/34/05/272833405.db2.gz JFRNYSRJDWTJJV-HUUCEWRRSA-N 2 0 365.478 -1.181 20 0 FAADRP C[NH+](C)[C@@H]1CCN(C(=O)C(=O)N2CCC[C@H](C(=O)N3CC[NH2+]CC3)C2)C1 ZINC000331774820 483170556 /nfs/dbraw/zinc/17/05/56/483170556.db2.gz JFRNYSRJDWTJJV-LSDHHAIUSA-N 2 0 365.478 -1.181 20 0 FAADRP C[NH2+]C[C@H]1CCCN1C(=O)C(=O)N1CCN(C(=O)[C@@H]2CCC[N@@H+]2C)CC1 ZINC000331802927 483170677 /nfs/dbraw/zinc/17/06/77/483170677.db2.gz CCIKACMOVZXXIM-CABCVRRESA-N 2 0 365.478 -1.038 20 0 FAADRP C[NH2+]C[C@@H]1CCCN1C(=O)C(=O)N1CCN(C(=O)[C@@H]2CCC[N@@H+]2C)CC1 ZINC000331802931 483170255 /nfs/dbraw/zinc/17/02/55/483170255.db2.gz CCIKACMOVZXXIM-GJZGRUSLSA-N 2 0 365.478 -1.038 20 0 FAADRP C[NH2+]C[C@H]1CCCN1C(=O)C(=O)N1CCN(C(=O)[C@H]2CCC[N@@H+]2C)CC1 ZINC000331802935 483169193 /nfs/dbraw/zinc/16/91/93/483169193.db2.gz CCIKACMOVZXXIM-HUUCEWRRSA-N 2 0 365.478 -1.038 20 0 FAADRP C[NH2+]C[C@@H]1CCCN1C(=O)C(=O)N1CCN(C(=O)[C@H]2CCC[N@@H+]2C)CC1 ZINC000331802938 483170228 /nfs/dbraw/zinc/17/02/28/483170228.db2.gz CCIKACMOVZXXIM-LSDHHAIUSA-N 2 0 365.478 -1.038 20 0 FAADRP CN(C(=O)C(=O)N1CC[NH+](CC2CCOCC2)CC1)[C@H]1C[NH2+]C[C@@H]1O ZINC000331803303 483170213 /nfs/dbraw/zinc/17/02/13/483170213.db2.gz KQESPYRESKJQMD-GJZGRUSLSA-N 2 0 354.451 -1.652 20 0 FAADRP C[C@@H]1CN(C(=O)C(=O)N2CCN(C(=O)[C@H]3CCC[N@@H+]3C)CC2)C[C@@H]1[NH3+] ZINC000331822383 483170721 /nfs/dbraw/zinc/17/07/21/483170721.db2.gz HSRPNXJIOBBXJZ-HZSPNIEDSA-N 2 0 351.451 -1.443 20 0 FAADRP C[C@@H]1CN(C(=O)C(=O)N2CCN(C(=O)[C@@H]3CCC[N@@H+]3C)CC2)C[C@H]1[NH3+] ZINC000331822386 483169625 /nfs/dbraw/zinc/16/96/25/483169625.db2.gz HSRPNXJIOBBXJZ-MCIONIFRSA-N 2 0 351.451 -1.443 20 0 FAADRP C[C@@H]1CN(C(=O)C(=O)N2CCN(C(=O)[C@H]3CCC[N@@H+]3C)CC2)C[C@H]1[NH3+] ZINC000331822389 483170460 /nfs/dbraw/zinc/17/04/60/483170460.db2.gz HSRPNXJIOBBXJZ-MGPQQGTHSA-N 2 0 351.451 -1.443 20 0 FAADRP C[C@@H]1CN(C(=O)C(=O)N2CCN(C(=O)[C@@H]3CCC[N@@H+]3C)CC2)C[C@@H]1[NH3+] ZINC000331822393 483170982 /nfs/dbraw/zinc/17/09/82/483170982.db2.gz HSRPNXJIOBBXJZ-RDBSUJKOSA-N 2 0 351.451 -1.443 20 0 FAADRP C[NH2+][C@H]1CCN(C(=O)C(=O)N2CCN(C(=O)[C@@H]3CCC[N@@H+]3C)CC2)C1 ZINC000331859704 483172000 /nfs/dbraw/zinc/17/20/00/483172000.db2.gz QGTWGYQBSUKCFP-KBPBESRZSA-N 2 0 351.451 -1.428 20 0 FAADRP C[NH2+][C@@H]1CCN(C(=O)C(=O)N2CCN(C(=O)[C@@H]3CCC[N@@H+]3C)CC2)C1 ZINC000331859706 483172687 /nfs/dbraw/zinc/17/26/87/483172687.db2.gz QGTWGYQBSUKCFP-KGLIPLIRSA-N 2 0 351.451 -1.428 20 0 FAADRP C[NH2+][C@H]1CCN(C(=O)C(=O)N2CCN(C(=O)[C@H]3CCC[N@@H+]3C)CC2)C1 ZINC000331859708 483171939 /nfs/dbraw/zinc/17/19/39/483171939.db2.gz QGTWGYQBSUKCFP-UONOGXRCSA-N 2 0 351.451 -1.428 20 0 FAADRP C[NH2+][C@@H]1CCN(C(=O)C(=O)N2CCN(C(=O)[C@H]3CCC[N@@H+]3C)CC2)C1 ZINC000331859710 483171643 /nfs/dbraw/zinc/17/16/43/483171643.db2.gz QGTWGYQBSUKCFP-ZIAGYGMSSA-N 2 0 351.451 -1.428 20 0 FAADRP C[C@@H]1CC[NH2+]C[C@@H]1NC(=O)C(=O)N1CCN(C(=O)[C@@H]2CCC[N@@H+]2C)CC1 ZINC000331861149 483171508 /nfs/dbraw/zinc/17/15/08/483171508.db2.gz ITWXWIPVOUPWKM-ILXRZTDVSA-N 2 0 365.478 -1.134 20 0 FAADRP C[C@@H]1CC[NH2+]C[C@H]1NC(=O)C(=O)N1CCN(C(=O)[C@@H]2CCC[N@@H+]2C)CC1 ZINC000331861150 483172517 /nfs/dbraw/zinc/17/25/17/483172517.db2.gz ITWXWIPVOUPWKM-KFWWJZLASA-N 2 0 365.478 -1.134 20 0 FAADRP C[C@@H]1CC[NH2+]C[C@@H]1NC(=O)C(=O)N1CCN(C(=O)[C@H]2CCC[N@@H+]2C)CC1 ZINC000331861151 483171917 /nfs/dbraw/zinc/17/19/17/483171917.db2.gz ITWXWIPVOUPWKM-QLFBSQMISA-N 2 0 365.478 -1.134 20 0 FAADRP C[C@@H]1CC[NH2+]C[C@H]1NC(=O)C(=O)N1CCN(C(=O)[C@H]2CCC[N@@H+]2C)CC1 ZINC000331861152 483172298 /nfs/dbraw/zinc/17/22/98/483172298.db2.gz ITWXWIPVOUPWKM-RBSFLKMASA-N 2 0 365.478 -1.134 20 0 FAADRP C[N@@H+]1CCC[C@H]1C(=O)N1CCN(C(=O)C(=O)N[C@H]2CCC[NH2+]C2)CC1 ZINC000331887799 483171871 /nfs/dbraw/zinc/17/18/71/483171871.db2.gz NOJYVAFTQGCSNI-KBPBESRZSA-N 2 0 351.451 -1.380 20 0 FAADRP C[N@@H+]1CCC[C@H]1C(=O)N1CCN(C(=O)C(=O)N[C@@H]2CCC[NH2+]C2)CC1 ZINC000331887802 483171985 /nfs/dbraw/zinc/17/19/85/483171985.db2.gz NOJYVAFTQGCSNI-KGLIPLIRSA-N 2 0 351.451 -1.380 20 0 FAADRP C[N@@H+]1CCC[C@@H]1C(=O)N1CCN(C(=O)C(=O)N[C@H]2CCC[NH2+]C2)CC1 ZINC000331887804 483172666 /nfs/dbraw/zinc/17/26/66/483172666.db2.gz NOJYVAFTQGCSNI-UONOGXRCSA-N 2 0 351.451 -1.380 20 0 FAADRP C[N@@H+]1CCC[C@@H]1C(=O)N1CCN(C(=O)C(=O)N[C@@H]2CCC[NH2+]C2)CC1 ZINC000331887816 483172044 /nfs/dbraw/zinc/17/20/44/483172044.db2.gz NOJYVAFTQGCSNI-ZIAGYGMSSA-N 2 0 351.451 -1.380 20 0 FAADRP C[NH+](C)[C@@H]1CCN(C(=O)C(=O)N2CCN(C(=O)[C@@H]3CCC[N@@H+]3C)CC2)C1 ZINC000331888884 483171595 /nfs/dbraw/zinc/17/15/95/483171595.db2.gz IOWLJQHQOMAMQM-CABCVRRESA-N 2 0 365.478 -1.086 20 0 FAADRP C[NH+](C)[C@H]1CCN(C(=O)C(=O)N2CCN(C(=O)[C@@H]3CCC[N@@H+]3C)CC2)C1 ZINC000331888888 483172621 /nfs/dbraw/zinc/17/26/21/483172621.db2.gz IOWLJQHQOMAMQM-GJZGRUSLSA-N 2 0 365.478 -1.086 20 0 FAADRP C[NH+](C)[C@@H]1CCN(C(=O)C(=O)N2CCN(C(=O)[C@H]3CCC[N@@H+]3C)CC2)C1 ZINC000331888893 483172144 /nfs/dbraw/zinc/17/21/44/483172144.db2.gz IOWLJQHQOMAMQM-HUUCEWRRSA-N 2 0 365.478 -1.086 20 0 FAADRP C[NH+](C)[C@H]1CCN(C(=O)C(=O)N2CCN(C(=O)[C@H]3CCC[N@@H+]3C)CC2)C1 ZINC000331888899 483172765 /nfs/dbraw/zinc/17/27/65/483172765.db2.gz IOWLJQHQOMAMQM-LSDHHAIUSA-N 2 0 365.478 -1.086 20 0 FAADRP C[N@@H+]1CCC[C@H]1C(=O)N1CCN(C(=O)C(=O)NC2CC[NH+](C)CC2)CC1 ZINC000331901379 483172219 /nfs/dbraw/zinc/17/22/19/483172219.db2.gz PVYYOLPRJGEBLF-HNNXBMFYSA-N 2 0 365.478 -1.038 20 0 FAADRP C[N@@H+]1CCC[C@@H]1C(=O)N1CCN(C(=O)C(=O)NC2CC[NH+](C)CC2)CC1 ZINC000331901388 483171809 /nfs/dbraw/zinc/17/18/09/483171809.db2.gz PVYYOLPRJGEBLF-OAHLLOKOSA-N 2 0 365.478 -1.038 20 0 FAADRP C[N@@H+]1CCC[C@H]1C(=O)N1CCN(C(=O)C(=O)N2CCC[C@H]2C[NH3+])CC1 ZINC000331931019 483172462 /nfs/dbraw/zinc/17/24/62/483172462.db2.gz MYFRJSOEJFQISH-KBPBESRZSA-N 2 0 351.451 -1.299 20 0 FAADRP C[N@@H+]1CCC[C@H]1C(=O)N1CCN(C(=O)C(=O)N2CCC[C@@H]2C[NH3+])CC1 ZINC000331931024 483172548 /nfs/dbraw/zinc/17/25/48/483172548.db2.gz MYFRJSOEJFQISH-KGLIPLIRSA-N 2 0 351.451 -1.299 20 0 FAADRP C[N@@H+]1CCC[C@@H]1C(=O)N1CCN(C(=O)C(=O)N2CCC[C@H]2C[NH3+])CC1 ZINC000331931029 483172723 /nfs/dbraw/zinc/17/27/23/483172723.db2.gz MYFRJSOEJFQISH-UONOGXRCSA-N 2 0 351.451 -1.299 20 0 FAADRP C[N@@H+]1CCC[C@@H]1C(=O)N1CCN(C(=O)C(=O)N2CCC[C@@H]2C[NH3+])CC1 ZINC000331931034 483172748 /nfs/dbraw/zinc/17/27/48/483172748.db2.gz MYFRJSOEJFQISH-ZIAGYGMSSA-N 2 0 351.451 -1.299 20 0 FAADRP CC(C)[N@@H+]1CCO[C@@H](CN2CCN(C(=O)C(=O)N3CC[C@@H]([NH3+])C3)CC2)C1 ZINC000332255606 483175523 /nfs/dbraw/zinc/17/55/23/483175523.db2.gz DWPKMLPKFAKNRV-CVEARBPZSA-N 2 0 367.494 -1.201 20 0 FAADRP CC(C)[N@@H+]1CCO[C@H](CN2CCN(C(=O)C(=O)N3CC[C@@H]([NH3+])C3)CC2)C1 ZINC000332255612 272834562 /nfs/dbraw/zinc/83/45/62/272834562.db2.gz DWPKMLPKFAKNRV-HZPDHXFCSA-N 2 0 367.494 -1.201 20 0 FAADRP C[NH2+][C@@H]1CCCN(C(=O)C(=O)N2CCN(C(=O)[C@@H]3CCC[N@@H+]3C)CC2)C1 ZINC000332439417 483177046 /nfs/dbraw/zinc/17/70/46/483177046.db2.gz AMWYLNOLAYGMAK-CABCVRRESA-N 2 0 365.478 -1.038 20 0 FAADRP 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AHMOBQLOCMQEQK-KGLIPLIRSA-N 2 0 351.451 -1.395 20 0 FAADRP C[N@@H+]1CCC[C@@H]1C(=O)N1CCN(C(=O)C(=O)NC[C@H]([NH3+])C2CC2)CC1 ZINC000419852978 483295829 /nfs/dbraw/zinc/29/58/29/483295829.db2.gz AHMOBQLOCMQEQK-UONOGXRCSA-N 2 0 351.451 -1.395 20 0 FAADRP C[N@@H+]1CCC[C@@H]1C(=O)N1CCN(C(=O)C(=O)NC[C@@H]([NH3+])C2CC2)CC1 ZINC000419852979 483295607 /nfs/dbraw/zinc/29/56/07/483295607.db2.gz AHMOBQLOCMQEQK-ZIAGYGMSSA-N 2 0 351.451 -1.395 20 0 FAADRP CC(C)C[N@@H+]1CCO[C@@H](CNC(=O)C(=O)NCCCN2CC[NH2+]CC2)C1 ZINC000419859047 483295557 /nfs/dbraw/zinc/29/55/57/483295557.db2.gz XYUBMORORUSAJG-INIZCTEOSA-N 2 0 369.510 -1.129 20 0 FAADRP CC(C)C[N@@H+]1CCO[C@H](CNC(=O)C(=O)NCCCN2CC[NH2+]CC2)C1 ZINC000419859048 483295890 /nfs/dbraw/zinc/29/58/90/483295890.db2.gz XYUBMORORUSAJG-MRXNPFEDSA-N 2 0 369.510 -1.129 20 0 FAADRP C[NH+](C)CCN(C[C@@H]1CCCO1)C(=O)C(=O)NCCN1CC[NH2+]CC1 ZINC000419861478 483295667 /nfs/dbraw/zinc/29/56/67/483295667.db2.gz FBAQYGMIYKDRFR-HNNXBMFYSA-N 2 0 355.483 -1.423 20 0 FAADRP C[NH+](C)CCN(C[C@H]1CCCO1)C(=O)C(=O)NCCN1CC[NH2+]CC1 ZINC000419861479 483295435 /nfs/dbraw/zinc/29/54/35/483295435.db2.gz FBAQYGMIYKDRFR-OAHLLOKOSA-N 2 0 355.483 -1.423 20 0 FAADRP [NH3+][C@@H](CNC(=O)C(=O)N1CCN(C(=O)C[NH+]2CCCC2)CC1)C1CC1 ZINC000419874018 483297242 /nfs/dbraw/zinc/29/72/42/483297242.db2.gz VQBAFRLDRVXYNX-AWEZNQCLSA-N 2 0 351.451 -1.394 20 0 FAADRP [NH3+][C@H](CNC(=O)C(=O)N1CCN(C(=O)C[NH+]2CCCC2)CC1)C1CC1 ZINC000419874021 483297208 /nfs/dbraw/zinc/29/72/08/483297208.db2.gz VQBAFRLDRVXYNX-CQSZACIVSA-N 2 0 351.451 -1.394 20 0 FAADRP C[NH+](C)CCN(C[C@@H]1CCCO1)C(=O)C(=O)NCCCN1CC[NH2+]CC1 ZINC000419874625 483295722 /nfs/dbraw/zinc/29/57/22/483295722.db2.gz UGEDWRKQNZOPIV-INIZCTEOSA-N 2 0 369.510 -1.033 20 0 FAADRP C[NH+](C)CCN(C[C@H]1CCCO1)C(=O)C(=O)NCCCN1CC[NH2+]CC1 ZINC000419874879 483295978 /nfs/dbraw/zinc/29/59/78/483295978.db2.gz UGEDWRKQNZOPIV-MRXNPFEDSA-N 2 0 369.510 -1.033 20 0 FAADRP CC[NH+](CC)CCO[C@H]1CCN(C(=O)C(=O)NCCN2CC[NH2+]CC2)C1 ZINC000419875946 483295499 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351.451 -1.379 20 0 FAADRP CC[NH+](CC)CC(=O)N1CCN(C(=O)C(=O)NC[C@@H]2CCC[NH2+]2)CC1 ZINC000419895268 483296904 /nfs/dbraw/zinc/29/69/04/483296904.db2.gz RWHNHFKTZRPNPI-AWEZNQCLSA-N 2 0 353.467 -1.133 20 0 FAADRP CC[NH+](CC)CC(=O)N1CCN(C(=O)C(=O)NC[C@H]2CCC[NH2+]2)CC1 ZINC000419895269 483297174 /nfs/dbraw/zinc/29/71/74/483297174.db2.gz RWHNHFKTZRPNPI-CQSZACIVSA-N 2 0 353.467 -1.133 20 0 FAADRP CCC[NH2+]CCNC(=O)C(=O)N1CCN(C(=O)C[NH+]2CCCC2)CC1 ZINC000419906529 483296623 /nfs/dbraw/zinc/29/66/23/483296623.db2.gz CMNUKJAKBQGCJA-UHFFFAOYSA-N 2 0 353.467 -1.131 20 0 FAADRP CCC[NH2+]CCNC(=O)C(=O)N1CCN(C(=O)[C@@H]2CCC[N@@H+]2C)CC1 ZINC000419910702 483297229 /nfs/dbraw/zinc/29/72/29/483297229.db2.gz QLRITCAECYHLME-AWEZNQCLSA-N 2 0 353.467 -1.133 20 0 FAADRP CCC[NH2+]CCNC(=O)C(=O)N1CCN(C(=O)[C@H]2CCC[N@@H+]2C)CC1 ZINC000419910703 483296650 /nfs/dbraw/zinc/29/66/50/483296650.db2.gz QLRITCAECYHLME-CQSZACIVSA-N 2 0 353.467 -1.133 20 0 FAADRP O=C(C[NH+]1CCCC1)N1CCN(C(=O)C(=O)N[C@H]2CCC[NH2+]C2)CC1 ZINC000419913343 483296485 /nfs/dbraw/zinc/29/64/85/483296485.db2.gz NNGNZIIDQIPGMC-AWEZNQCLSA-N 2 0 351.451 -1.379 20 0 FAADRP O=C(C[NH+]1CCCC1)N1CCN(C(=O)C(=O)N[C@@H]2CCC[NH2+]C2)CC1 ZINC000419914010 483297068 /nfs/dbraw/zinc/29/70/68/483297068.db2.gz NNGNZIIDQIPGMC-CQSZACIVSA-N 2 0 351.451 -1.379 20 0 FAADRP C[NH2+]C[C@H](C)CNC(=O)C(=O)N1CCN(C(=O)C[NH+]2CCCC2)CC1 ZINC000419950469 483297656 /nfs/dbraw/zinc/29/76/56/483297656.db2.gz MMXDJWQVMQLPEC-AWEZNQCLSA-N 2 0 353.467 -1.275 20 0 FAADRP C[NH2+]C[C@@H](C)CNC(=O)C(=O)N1CCN(C(=O)C[NH+]2CCCC2)CC1 ZINC000419950470 483297964 /nfs/dbraw/zinc/29/79/64/483297964.db2.gz MMXDJWQVMQLPEC-CQSZACIVSA-N 2 0 353.467 -1.275 20 0 FAADRP C[NH2+]C[C@H](C)CNC(=O)C(=O)N1CCN(C(=O)[C@@H]2CCC[N@@H+]2C)CC1 ZINC000419963854 483296689 /nfs/dbraw/zinc/29/66/89/483296689.db2.gz ZPVYANWRZSRCCF-KBPBESRZSA-N 2 0 353.467 -1.277 20 0 FAADRP C[NH2+]C[C@@H](C)CNC(=O)C(=O)N1CCN(C(=O)[C@@H]2CCC[N@@H+]2C)CC1 ZINC000419963857 483296471 /nfs/dbraw/zinc/29/64/71/483296471.db2.gz ZPVYANWRZSRCCF-KGLIPLIRSA-N 2 0 353.467 -1.277 20 0 FAADRP C[NH2+]C[C@H](C)CNC(=O)C(=O)N1CCN(C(=O)[C@H]2CCC[N@@H+]2C)CC1 ZINC000419963858 483296610 /nfs/dbraw/zinc/29/66/10/483296610.db2.gz ZPVYANWRZSRCCF-UONOGXRCSA-N 2 0 353.467 -1.277 20 0 FAADRP C[NH2+]C[C@@H](C)CNC(=O)C(=O)N1CCN(C(=O)[C@H]2CCC[N@@H+]2C)CC1 ZINC000419963859 483296754 /nfs/dbraw/zinc/29/67/54/483296754.db2.gz ZPVYANWRZSRCCF-ZIAGYGMSSA-N 2 0 353.467 -1.277 20 0 FAADRP CC[NH+](CC)CC(=O)N1CCN(C(=O)C(=O)NC[C@@H](C)C[NH2+]C)CC1 ZINC000419964692 483297282 /nfs/dbraw/zinc/29/72/82/483297282.db2.gz GAEWGXDDNXYAKL-AWEZNQCLSA-N 2 0 355.483 -1.029 20 0 FAADRP CC[NH+](CC)CC(=O)N1CCN(C(=O)C(=O)NC[C@H](C)C[NH2+]C)CC1 ZINC000419964694 272856314 /nfs/dbraw/zinc/85/63/14/272856314.db2.gz GAEWGXDDNXYAKL-CQSZACIVSA-N 2 0 355.483 -1.029 20 0 FAADRP CC(C)[C@@H]([NH3+])CNC(=O)C(=O)N1CCN(C(=O)C[NH+]2CCCC2)CC1 ZINC000419976823 483298219 /nfs/dbraw/zinc/29/82/19/483298219.db2.gz MOIPHNPSHRHQJJ-AWEZNQCLSA-N 2 0 353.467 -1.148 20 0 FAADRP CC(C)[C@H]([NH3+])CNC(=O)C(=O)N1CCN(C(=O)C[NH+]2CCCC2)CC1 ZINC000419976826 272856095 /nfs/dbraw/zinc/85/60/95/272856095.db2.gz MOIPHNPSHRHQJJ-CQSZACIVSA-N 2 0 353.467 -1.148 20 0 FAADRP CC(C)[C@@H]([NH3+])CNC(=O)C(=O)N1CCN(C(=O)[C@@H]2CCC[N@@H+]2C)CC1 ZINC000419977844 483298321 /nfs/dbraw/zinc/29/83/21/483298321.db2.gz NQVQDVPMGWCPNE-KBPBESRZSA-N 2 0 353.467 -1.149 20 0 FAADRP CC(C)[C@H]([NH3+])CNC(=O)C(=O)N1CCN(C(=O)[C@@H]2CCC[N@@H+]2C)CC1 ZINC000419977845 483297732 /nfs/dbraw/zinc/29/77/32/483297732.db2.gz NQVQDVPMGWCPNE-KGLIPLIRSA-N 2 0 353.467 -1.149 20 0 FAADRP CC(C)[C@@H]([NH3+])CNC(=O)C(=O)N1CCN(C(=O)[C@H]2CCC[N@@H+]2C)CC1 ZINC000419977848 483297612 /nfs/dbraw/zinc/29/76/12/483297612.db2.gz NQVQDVPMGWCPNE-UONOGXRCSA-N 2 0 353.467 -1.149 20 0 FAADRP CC(C)[C@H]([NH3+])CNC(=O)C(=O)N1CCN(C(=O)[C@H]2CCC[N@@H+]2C)CC1 ZINC000419977850 483298095 /nfs/dbraw/zinc/29/80/95/483298095.db2.gz NQVQDVPMGWCPNE-ZIAGYGMSSA-N 2 0 353.467 -1.149 20 0 FAADRP [NH3+]C[C@H](NC(=O)C(=O)N1CCN(C(=O)C[NH+]2CCCC2)CC1)C1CC1 ZINC000420024501 483299422 /nfs/dbraw/zinc/29/94/22/483299422.db2.gz ALRWPWJBRHOFTP-AWEZNQCLSA-N 2 0 351.451 -1.394 20 0 FAADRP [NH3+]C[C@@H](NC(=O)C(=O)N1CCN(C(=O)C[NH+]2CCCC2)CC1)C1CC1 ZINC000420024503 483298912 /nfs/dbraw/zinc/29/89/12/483298912.db2.gz ALRWPWJBRHOFTP-CQSZACIVSA-N 2 0 351.451 -1.394 20 0 FAADRP CC[NH+](CC)CC(=O)N1CCN(C(=O)C(=O)N[C@@H](C[NH3+])C2CC2)CC1 ZINC000420039872 272856881 /nfs/dbraw/zinc/85/68/81/272856881.db2.gz OJCYQMCAYAXQSL-AWEZNQCLSA-N 2 0 353.467 -1.148 20 0 FAADRP CC[NH+](CC)CC(=O)N1CCN(C(=O)C(=O)N[C@H](C[NH3+])C2CC2)CC1 ZINC000420039873 483299060 /nfs/dbraw/zinc/29/90/60/483299060.db2.gz OJCYQMCAYAXQSL-CQSZACIVSA-N 2 0 353.467 -1.148 20 0 FAADRP CC[NH+](CC)CC(=O)N1CCN(C(=O)C(=O)NCC2([NH3+])CCC2)CC1 ZINC000420088700 483298928 /nfs/dbraw/zinc/29/89/28/483298928.db2.gz IJHMGJNAPBDDQO-UHFFFAOYSA-N 2 0 353.467 -1.003 20 0 FAADRP [NH3+]C1(CNC(=O)C(=O)N2CCN(C(=O)C[NH+]3CCCC3)CC2)CCC1 ZINC000420122900 483300645 /nfs/dbraw/zinc/30/06/45/483300645.db2.gz LGEALJMQQLFMJN-UHFFFAOYSA-N 2 0 351.451 -1.249 20 0 FAADRP COCC[NH2+]CCNC(=O)C(=O)N1CCN(C(=O)C[NH+]2CCCC2)CC1 ZINC000420165118 483300154 /nfs/dbraw/zinc/30/01/54/483300154.db2.gz MQIOKECZLFYNRX-UHFFFAOYSA-N 2 0 369.466 -1.895 20 0 FAADRP CC[NH2+][C@H](C)CNC(=O)C(=O)N1CCN(C(=O)C[NH+]2CCCC2)CC1 ZINC000420165122 483299977 /nfs/dbraw/zinc/29/99/77/483299977.db2.gz GHZVJQBOYSYOLK-CQSZACIVSA-N 2 0 353.467 -1.133 20 0 FAADRP COCC[NH2+]CCNC(=O)C(=O)N1CCN(C(=O)[C@@H]2CCC[N@@H+]2C)CC1 ZINC000420167175 483300116 /nfs/dbraw/zinc/30/01/16/483300116.db2.gz OQBGFOONRXJFAX-AWEZNQCLSA-N 2 0 369.466 -1.896 20 0 FAADRP COCC[NH2+]CCNC(=O)C(=O)N1CCN(C(=O)[C@H]2CCC[N@@H+]2C)CC1 ZINC000420167177 483300073 /nfs/dbraw/zinc/30/00/73/483300073.db2.gz OQBGFOONRXJFAX-CQSZACIVSA-N 2 0 369.466 -1.896 20 0 FAADRP CC[NH2+][C@H](C)CNC(=O)C(=O)N1CCN(C(=O)[C@@H]2CCC[N@@H+]2C)CC1 ZINC000420168981 483300619 /nfs/dbraw/zinc/30/06/19/483300619.db2.gz LDTALIDBJPLTSQ-KGLIPLIRSA-N 2 0 353.467 -1.134 20 0 FAADRP CC[NH2+][C@H](C)CNC(=O)C(=O)N1CCN(C(=O)[C@H]2CCC[N@@H+]2C)CC1 ZINC000420168982 483300661 /nfs/dbraw/zinc/30/06/61/483300661.db2.gz LDTALIDBJPLTSQ-ZIAGYGMSSA-N 2 0 353.467 -1.134 20 0 FAADRP COCC[NH2+]CCNC(=O)C(=O)N1CCN(C[C@@H]2CCCC[N@@H+]2C)CC1 ZINC000420176568 483300517 /nfs/dbraw/zinc/30/05/17/483300517.db2.gz AEHJRDKHWZYONG-INIZCTEOSA-N 2 0 369.510 -1.033 20 0 FAADRP COCC[NH2+]CCNC(=O)C(=O)N1CCN(C[C@H]2CCCC[N@@H+]2C)CC1 ZINC000420176574 272857570 /nfs/dbraw/zinc/85/75/70/272857570.db2.gz AEHJRDKHWZYONG-MRXNPFEDSA-N 2 0 369.510 -1.033 20 0 FAADRP CC[NH+](CC)CC(=O)N1CCN(C(=O)C(=O)NC[C@@H]2C[NH2+]CCO2)CC1 ZINC000420196168 483301631 /nfs/dbraw/zinc/30/16/31/483301631.db2.gz LEGBXNDSCZDZMH-AWEZNQCLSA-N 2 0 369.466 -1.896 20 0 FAADRP CC[NH+](CC)CC(=O)N1CCN(C(=O)C(=O)NC[C@H]2C[NH2+]CCO2)CC1 ZINC000420196169 483301868 /nfs/dbraw/zinc/30/18/68/483301868.db2.gz LEGBXNDSCZDZMH-CQSZACIVSA-N 2 0 369.466 -1.896 20 0 FAADRP C[N@@H+]1CCCC[C@@H]1CN1CCN(C(=O)C(=O)NC[C@@H]2C[NH2+]CCO2)CC1 ZINC000420197982 483301427 /nfs/dbraw/zinc/30/14/27/483301427.db2.gz JXKPMVUXZCRWRG-CVEARBPZSA-N 2 0 367.494 -1.281 20 0 FAADRP C[N@@H+]1CCCC[C@H]1CN1CCN(C(=O)C(=O)NC[C@@H]2C[NH2+]CCO2)CC1 ZINC000420197987 483301643 /nfs/dbraw/zinc/30/16/43/483301643.db2.gz JXKPMVUXZCRWRG-HOTGVXAUSA-N 2 0 367.494 -1.281 20 0 FAADRP C[N@@H+]1CCCC[C@@H]1CN1CCN(C(=O)C(=O)NC[C@H]2C[NH2+]CCO2)CC1 ZINC000420197989 483301182 /nfs/dbraw/zinc/30/11/82/483301182.db2.gz JXKPMVUXZCRWRG-HZPDHXFCSA-N 2 0 367.494 -1.281 20 0 FAADRP C[N@@H+]1CCCC[C@H]1CN1CCN(C(=O)C(=O)NC[C@H]2C[NH2+]CCO2)CC1 ZINC000420197991 483300952 /nfs/dbraw/zinc/30/09/52/483300952.db2.gz JXKPMVUXZCRWRG-JKSUJKDBSA-N 2 0 367.494 -1.281 20 0 FAADRP COc1c[nH+]ccc1N1CCN(C(=O)C(=O)NC[C@H]2C[NH2+]CCO2)CC1 ZINC000420214834 483301802 /nfs/dbraw/zinc/30/18/02/483301802.db2.gz ZUQXOYVSTVXVMZ-CYBMUJFWSA-N 2 0 363.418 -1.157 20 0 FAADRP COc1c[nH+]ccc1N1CCN(C(=O)C(=O)NC[C@@H]2C[NH2+]CCO2)CC1 ZINC000420214835 483301393 /nfs/dbraw/zinc/30/13/93/483301393.db2.gz ZUQXOYVSTVXVMZ-ZDUSSCGKSA-N 2 0 363.418 -1.157 20 0 FAADRP COc1cc[nH+]c(N2CCN(C(=O)C(=O)NC[C@@H]3C[NH2+]CCO3)CC2)c1 ZINC000420214884 483301829 /nfs/dbraw/zinc/30/18/29/483301829.db2.gz ZYUAGIVHFVBECR-AWEZNQCLSA-N 2 0 363.418 -1.157 20 0 FAADRP COc1cc[nH+]c(N2CCN(C(=O)C(=O)NC[C@H]3C[NH2+]CCO3)CC2)c1 ZINC000420214887 483301748 /nfs/dbraw/zinc/30/17/48/483301748.db2.gz ZYUAGIVHFVBECR-CQSZACIVSA-N 2 0 363.418 -1.157 20 0 FAADRP CN(CC[NH+](C)C)C(=O)C(=O)NC[C@@H](N1CC[NH2+]CC1)C(F)(F)F ZINC000420220791 483301143 /nfs/dbraw/zinc/30/11/43/483301143.db2.gz PPXJXLNAMWHLGY-LLVKDONJSA-N 2 0 353.389 -1.041 20 0 FAADRP CN(CC[NH+](C)C)C(=O)C(=O)NC[C@H](N1CC[NH2+]CC1)C(F)(F)F ZINC000420220794 483301998 /nfs/dbraw/zinc/30/19/98/483301998.db2.gz PPXJXLNAMWHLGY-NSHDSACASA-N 2 0 353.389 -1.041 20 0 FAADRP CN(CC[NH+](C)C)C(=O)C(=O)N1CCC[C@H](C(=O)N2CC[NH2+]CC2)C1 ZINC000423059810 483319603 /nfs/dbraw/zinc/31/96/03/483319603.db2.gz GRQLODLWHNKNAM-AWEZNQCLSA-N 2 0 353.467 -1.323 20 0 FAADRP CN(CC[NH+](C)C)C(=O)C(=O)N1CCC[C@@H](C(=O)N2CC[NH2+]CC2)C1 ZINC000423059811 483319617 /nfs/dbraw/zinc/31/96/17/483319617.db2.gz GRQLODLWHNKNAM-CQSZACIVSA-N 2 0 353.467 -1.323 20 0 FAADRP [NH3+][C@H]1CCCN(C(=O)C(=O)N2CCN(C(=O)C[NH+]3CCCC3)CC2)C1 ZINC000423241142 483321403 /nfs/dbraw/zinc/32/14/03/483321403.db2.gz DDWDEJGTVBVGRT-AWEZNQCLSA-N 2 0 351.451 -1.297 20 0 FAADRP CC[NH+](CC)CC(=O)N1CCN(C(=O)C(=O)N2CCC[C@H]([NH3+])C2)CC1 ZINC000423244577 483321494 /nfs/dbraw/zinc/32/14/94/483321494.db2.gz HTAYYZKNBZJKTF-AWEZNQCLSA-N 2 0 353.467 -1.051 20 0 FAADRP CC[NH+](CC)CC(=O)N1CCN(C(=O)C(=O)N2CCC[C@@H]([NH3+])C2)CC1 ZINC000423244578 483321628 /nfs/dbraw/zinc/32/16/28/483321628.db2.gz HTAYYZKNBZJKTF-CQSZACIVSA-N 2 0 353.467 -1.051 20 0 FAADRP CC[NH+](CC)CC(=O)N1CCN(C(=O)C(=O)N2CCO[C@@H](C[NH3+])C2)CC1 ZINC000423245422 483320747 /nfs/dbraw/zinc/32/07/47/483320747.db2.gz IVBUETCCNHYHKM-AWEZNQCLSA-N 2 0 369.466 -1.815 20 0 FAADRP CC[NH+](CC)CC(=O)N1CCN(C(=O)C(=O)N2CCO[C@H](C[NH3+])C2)CC1 ZINC000423245423 483321669 /nfs/dbraw/zinc/32/16/69/483321669.db2.gz IVBUETCCNHYHKM-CQSZACIVSA-N 2 0 369.466 -1.815 20 0 FAADRP CC[NH+](CC)CC(=O)N1CCN(C(=O)C(=O)N2CC[NH2+][C@@H](C)C2)CC1 ZINC000423248390 483321828 /nfs/dbraw/zinc/32/18/28/483321828.db2.gz NGRWKAGRBZNVHG-AWEZNQCLSA-N 2 0 353.467 -1.181 20 0 FAADRP CC[NH+](CC)CC(=O)N1CCN(C(=O)C(=O)N2CC[NH2+][C@H](C)C2)CC1 ZINC000423248537 483320845 /nfs/dbraw/zinc/32/08/45/483320845.db2.gz NGRWKAGRBZNVHG-CQSZACIVSA-N 2 0 353.467 -1.181 20 0 FAADRP CC[NH+](CC)CC(=O)N1CCN(C(=O)C(=O)N2C[C@@H](C)[C@H]([NH3+])C2)CC1 ZINC000423250238 483321927 /nfs/dbraw/zinc/32/19/27/483321927.db2.gz QAQHIZIDOKGOQY-ZIAGYGMSSA-N 2 0 353.467 -1.195 20 0 FAADRP CC[NH+](CC)CC(=O)N1CCN(C(=O)C(=O)N2C[C@H]3C[NH2+]C[C@H]3C2)CC1 ZINC000423251424 483321266 /nfs/dbraw/zinc/32/12/66/483321266.db2.gz SCVKZJBHQPMQTB-GASCZTMLSA-N 2 0 365.478 -1.323 20 0 FAADRP C[NH2+]CCCN(C)C(=O)C(=O)N1CCN(C(=O)C[NH+]2CCCC2)CC1 ZINC000423253529 483321052 /nfs/dbraw/zinc/32/10/52/483321052.db2.gz WAPCVNXABJPEHR-UHFFFAOYSA-N 2 0 353.467 -1.179 20 0 FAADRP CC[NH+](CC)CC(=O)N1CCN(C(=O)C(=O)N2CC[C@H]([NH2+]C)C2)CC1 ZINC000423254681 483321755 /nfs/dbraw/zinc/32/17/55/483321755.db2.gz ZDBGVHIAMBPYBS-AWEZNQCLSA-N 2 0 353.467 -1.181 20 0 FAADRP CC[NH+](CC)CC(=O)N1CCN(C(=O)C(=O)N2CC[C@@H]([NH2+]C)C2)CC1 ZINC000423254682 483321681 /nfs/dbraw/zinc/32/16/81/483321681.db2.gz ZDBGVHIAMBPYBS-CQSZACIVSA-N 2 0 353.467 -1.181 20 0 FAADRP COCCN(CC[NH+](C)C)C(=O)C(=O)N1CCC[C@H](C(=O)NCC[NH3+])C1 ZINC000423258533 483320657 /nfs/dbraw/zinc/32/06/57/483320657.db2.gz BSMBOGRKTWIDKY-AWEZNQCLSA-N 2 0 371.482 -1.664 20 0 FAADRP COCCN(CC[NH+](C)C)C(=O)C(=O)N1CCC[C@@H](C(=O)NCC[NH3+])C1 ZINC000423258534 483320717 /nfs/dbraw/zinc/32/07/17/483320717.db2.gz BSMBOGRKTWIDKY-CQSZACIVSA-N 2 0 371.482 -1.664 20 0 FAADRP COCCN(CC[NH+](C)C)C(=O)C(=O)N1CCN([C@H]2CC[NH2+]C2)CC1 ZINC000423260244 483320834 /nfs/dbraw/zinc/32/08/34/483320834.db2.gz HCHRVYPYFPRMBM-HNNXBMFYSA-N 2 0 355.483 -1.471 20 0 FAADRP COCCN(CC[NH+](C)C)C(=O)C(=O)N1CCN([C@@H]2CC[NH2+]C2)CC1 ZINC000423260245 483320625 /nfs/dbraw/zinc/32/06/25/483320625.db2.gz HCHRVYPYFPRMBM-OAHLLOKOSA-N 2 0 355.483 -1.471 20 0 FAADRP COCCN(CC[NH+](C)C)C(=O)C(=O)N1CC[C@H](N2CC[NH2+]CC2)C1 ZINC000423260662 483321192 /nfs/dbraw/zinc/32/11/92/483321192.db2.gz HYFLVBWQFICELM-HNNXBMFYSA-N 2 0 355.483 -1.471 20 0 FAADRP COCCN(CC[NH+](C)C)C(=O)C(=O)N1CC[C@@H](N2CC[NH2+]CC2)C1 ZINC000423260663 483321915 /nfs/dbraw/zinc/32/19/15/483321915.db2.gz HYFLVBWQFICELM-OAHLLOKOSA-N 2 0 355.483 -1.471 20 0 FAADRP COc1cc[nH+]c(N2CCN(C(=O)C(=O)N3CCO[C@@H](C[NH3+])C3)CC2)c1 ZINC000423265259 483320872 /nfs/dbraw/zinc/32/08/72/483320872.db2.gz ZVQMNJDRWLDXMH-AWEZNQCLSA-N 2 0 363.418 -1.075 20 0 FAADRP COc1cc[nH+]c(N2CCN(C(=O)C(=O)N3CCO[C@H](C[NH3+])C3)CC2)c1 ZINC000423265265 483321487 /nfs/dbraw/zinc/32/14/87/483321487.db2.gz ZVQMNJDRWLDXMH-CQSZACIVSA-N 2 0 363.418 -1.075 20 0 FAADRP C[N@@H+]1CCCC[C@@H]1CN1CCN(C(=O)C(=O)N2CCO[C@@H](C[NH3+])C2)CC1 ZINC000423285649 483321527 /nfs/dbraw/zinc/32/15/27/483321527.db2.gz ZMTKXKYYRNLQJX-CVEARBPZSA-N 2 0 367.494 -1.199 20 0 FAADRP C[N@@H+]1CCCC[C@H]1CN1CCN(C(=O)C(=O)N2CCO[C@@H](C[NH3+])C2)CC1 ZINC000423285654 483321282 /nfs/dbraw/zinc/32/12/82/483321282.db2.gz ZMTKXKYYRNLQJX-HOTGVXAUSA-N 2 0 367.494 -1.199 20 0 FAADRP C[N@@H+]1CCCC[C@@H]1CN1CCN(C(=O)C(=O)N2CCO[C@H](C[NH3+])C2)CC1 ZINC000423285656 483320769 /nfs/dbraw/zinc/32/07/69/483320769.db2.gz ZMTKXKYYRNLQJX-HZPDHXFCSA-N 2 0 367.494 -1.199 20 0 FAADRP C[N@@H+]1CCCC[C@H]1CN1CCN(C(=O)C(=O)N2CCO[C@H](C[NH3+])C2)CC1 ZINC000423285658 483321210 /nfs/dbraw/zinc/32/12/10/483321210.db2.gz ZMTKXKYYRNLQJX-JKSUJKDBSA-N 2 0 367.494 -1.199 20 0 FAADRP COc1c[nH+]ccc1N1CCN(C(=O)C(=O)N2CCO[C@H](C[NH3+])C2)CC1 ZINC000423376454 483322740 /nfs/dbraw/zinc/32/27/40/483322740.db2.gz JJWDVWDHXJGDKS-CYBMUJFWSA-N 2 0 363.418 -1.075 20 0 FAADRP COc1c[nH+]ccc1N1CCN(C(=O)C(=O)N2CCO[C@@H](C[NH3+])C2)CC1 ZINC000423376457 483322553 /nfs/dbraw/zinc/32/25/53/483322553.db2.gz JJWDVWDHXJGDKS-ZDUSSCGKSA-N 2 0 363.418 -1.075 20 0 FAADRP C[N@@H+]1CCC[C@H]1C(=O)N1CCN(C(=O)C(=O)N2CCC[C@H]([NH3+])C2)CC1 ZINC000423526009 483322752 /nfs/dbraw/zinc/32/27/52/483322752.db2.gz UVAAJCVDIKPENS-KBPBESRZSA-N 2 0 351.451 -1.299 20 0 FAADRP C[N@@H+]1CCC[C@@H]1C(=O)N1CCN(C(=O)C(=O)N2CCC[C@H]([NH3+])C2)CC1 ZINC000423526012 483322926 /nfs/dbraw/zinc/32/29/26/483322926.db2.gz UVAAJCVDIKPENS-UONOGXRCSA-N 2 0 351.451 -1.299 20 0 FAADRP C[NH2+]CCCN(C)C(=O)C(=O)N1CCN(C(=O)[C@@H]2CCC[N@@H+]2C)CC1 ZINC000423528829 483323804 /nfs/dbraw/zinc/32/38/04/483323804.db2.gz WWGMAFNWRPPPPP-AWEZNQCLSA-N 2 0 353.467 -1.181 20 0 FAADRP C[NH2+]CCCN(C)C(=O)C(=O)N1CCN(C(=O)[C@H]2CCC[N@@H+]2C)CC1 ZINC000423528830 483323304 /nfs/dbraw/zinc/32/33/04/483323304.db2.gz WWGMAFNWRPPPPP-CQSZACIVSA-N 2 0 353.467 -1.181 20 0 FAADRP C[NH2+]C[C@@H]1CCCN1C(=O)C(=O)N1CCN(C(=O)C[NH+]2CCCC2)CC1 ZINC000423585959 483325060 /nfs/dbraw/zinc/32/50/60/483325060.db2.gz CFIFYHBVXTZSFU-HNNXBMFYSA-N 2 0 365.478 -1.037 20 0 FAADRP C[NH2+]C[C@H]1CCCN1C(=O)C(=O)N1CCN(C(=O)C[NH+]2CCCC2)CC1 ZINC000423585960 483324865 /nfs/dbraw/zinc/32/48/65/483324865.db2.gz CFIFYHBVXTZSFU-OAHLLOKOSA-N 2 0 365.478 -1.037 20 0 FAADRP CC[NH+](CC)CC(=O)N1CCN(C(=O)C(=O)N2CC[NH2+]C[C@@H]2C)CC1 ZINC000423607527 483324619 /nfs/dbraw/zinc/32/46/19/483324619.db2.gz MVTBQLZNNMFDDT-AWEZNQCLSA-N 2 0 353.467 -1.181 20 0 FAADRP CC[NH+](CC)CC(=O)N1CCN(C(=O)C(=O)N2CC[NH2+]C[C@H]2C)CC1 ZINC000423607528 483324364 /nfs/dbraw/zinc/32/43/64/483324364.db2.gz MVTBQLZNNMFDDT-CQSZACIVSA-N 2 0 353.467 -1.181 20 0 FAADRP CC[NH+](CC)CC(=O)N1CCN(C(=O)C(=O)N2CCC[NH2+]CC2)CC1 ZINC000423619211 483325621 /nfs/dbraw/zinc/32/56/21/483325621.db2.gz ZYJDIVLNDJETCL-UHFFFAOYSA-N 2 0 353.467 -1.179 20 0 FAADRP C[C@@H]1CN(C(=O)C(=O)N2CCC[C@@H](C(=O)NCC[NH3+])C2)C[C@H](C)N1C ZINC000423632037 483325497 /nfs/dbraw/zinc/32/54/97/483325497.db2.gz NIOCSDFVDWJEJV-HZSPNIEDSA-N 2 0 353.467 -1.149 20 0 FAADRP C[C@@H]1CN(C(=O)C(=O)N2CCC[C@H](C(=O)NCC[NH3+])C2)C[C@H](C)N1C ZINC000423632038 483325195 /nfs/dbraw/zinc/32/51/95/483325195.db2.gz NIOCSDFVDWJEJV-MJBXVCDLSA-N 2 0 353.467 -1.149 20 0 FAADRP CC[NH+](CC)CC(=O)N1CCN(C(=O)C(=O)N2CCC[C@@H]2C[NH3+])CC1 ZINC000423649130 483326832 /nfs/dbraw/zinc/32/68/32/483326832.db2.gz OZEKVMGWKDWECN-CQSZACIVSA-N 2 0 353.467 -1.051 20 0 FAADRP C[N@@H+]1CC[C@@H]2CN(C(=O)C(=O)N3CCCC[C@H]3CNC(=O)CC[NH3+])C[C@@H]21 ZINC000423654324 483326965 /nfs/dbraw/zinc/32/69/65/483326965.db2.gz AKEIFEQCDYTEJG-ILXRZTDVSA-N 2 0 365.478 -1.005 20 0 FAADRP C[N@@H+]1CC[C@@H]2CN(C(=O)C(=O)N3CCCC[C@@H]3CNC(=O)CC[NH3+])C[C@@H]21 ZINC000423654325 483326976 /nfs/dbraw/zinc/32/69/76/483326976.db2.gz AKEIFEQCDYTEJG-KFWWJZLASA-N 2 0 365.478 -1.005 20 0 FAADRP C[C@H]1CN(C(=O)C(=O)N(C)[C@H]2C[NH2+]C[C@@H]2O)CCN1C1CC[NH+](C)CC1 ZINC000423669170 483326849 /nfs/dbraw/zinc/32/68/49/483326849.db2.gz RPPTWIUJPMTEOJ-BPUTZDHNSA-N 2 0 367.494 -1.596 20 0 FAADRP C[C@@H]1CN(C(=O)C(=O)N(C)[C@H]2C[NH2+]C[C@@H]2O)CCN1C1CC[NH+](C)CC1 ZINC000423669174 483326773 /nfs/dbraw/zinc/32/67/73/483326773.db2.gz RPPTWIUJPMTEOJ-KBMXLJTQSA-N 2 0 367.494 -1.596 20 0 FAADRP CC[NH+](CC)CC(=O)N1CCN(C(=O)C(=O)N2CC[C@@H]3C[NH2+]C[C@@H]32)CC1 ZINC000423716577 483327279 /nfs/dbraw/zinc/32/72/79/483327279.db2.gz XRLGDDSLRNLGIU-CABCVRRESA-N 2 0 365.478 -1.181 20 0 FAADRP COCC[N@@H+]1CC[C@@H](NC(=O)C(=O)N2C[C@@H](c3cnn(C)c3)[C@H]([NH3+])C2)C1 ZINC000424522133 483338538 /nfs/dbraw/zinc/33/85/38/483338538.db2.gz MQSQYPUHRSMMGC-QLFBSQMISA-N 2 0 364.450 -1.490 20 0 FAADRP COCC[N@@H+]1CC[C@H](NC(=O)C(=O)N2C[C@@H](c3cnn(C)c3)[C@H]([NH3+])C2)C1 ZINC000424522135 483338452 /nfs/dbraw/zinc/33/84/52/483338452.db2.gz MQSQYPUHRSMMGC-SOUVJXGZSA-N 2 0 364.450 -1.490 20 0 FAADRP COCC[N@H+](C)CCCNC(=O)C(=O)N1C[C@@H](c2cnn(C)c2)[C@H]([NH3+])C1 ZINC000424532933 483339563 /nfs/dbraw/zinc/33/95/63/483339563.db2.gz YBHHBGMDDRGXTB-LSDHHAIUSA-N 2 0 366.466 -1.242 20 0 FAADRP COCCC[N@H+](C)CCNC(=O)C(=O)N1C[C@@H](c2cnn(C)c2)[C@H]([NH3+])C1 ZINC000424534855 483339454 /nfs/dbraw/zinc/33/94/54/483339454.db2.gz ZQPNJOQDTSGCFI-LSDHHAIUSA-N 2 0 366.466 -1.242 20 0 FAADRP COCCN(CC[NH+](C)C)C(=O)C(=O)N1C[C@@H](c2cnn(C)c2)[C@H]([NH3+])C1 ZINC000424536181 483339374 /nfs/dbraw/zinc/33/93/74/483339374.db2.gz BCEOIZMEIUAZRR-LSDHHAIUSA-N 2 0 366.466 -1.290 20 0 FAADRP COCC[N@H+](C)CCNC(=O)C(=O)N1C[C@@H](c2cnn(C)c2)[C@H]([NH3+])C1 ZINC000424547157 483340508 /nfs/dbraw/zinc/34/05/08/483340508.db2.gz JVAIUOXBIDYWCJ-UONOGXRCSA-N 2 0 352.439 -1.632 20 0 FAADRP CC(=O)N1CCN(C(=O)[C@H](C)[N@@H+]2CCC[C@@H](C(=O)NCC[NH3+])C2)CC1 ZINC000430605652 483355110 /nfs/dbraw/zinc/35/51/10/483355110.db2.gz UARMFBRVYCEIQB-DZGCQCFKSA-N 2 0 353.467 -1.148 20 0 FAADRP CC(=O)N1CCN(C(=O)[C@@H](C)[N@@H+]2CCC[C@H](C(=O)NCC[NH3+])C2)CC1 ZINC000430605653 483355450 /nfs/dbraw/zinc/35/54/50/483355450.db2.gz UARMFBRVYCEIQB-HIFRSBDPSA-N 2 0 353.467 -1.148 20 0 FAADRP CC(=O)N1CCN(C(=O)[C@@H](C)[N@@H+]2CCC[C@@H](C(=O)NCC[NH3+])C2)CC1 ZINC000430605654 483355020 /nfs/dbraw/zinc/35/50/20/483355020.db2.gz UARMFBRVYCEIQB-UKRRQHHQSA-N 2 0 353.467 -1.148 20 0 FAADRP CC(=O)N1CCN(C(=O)[C@H](C)[N@@H+]2CCC[C@H](C(=O)NCC[NH3+])C2)CC1 ZINC000430605655 483355073 /nfs/dbraw/zinc/35/50/73/483355073.db2.gz UARMFBRVYCEIQB-ZFWWWQNUSA-N 2 0 353.467 -1.148 20 0 FAADRP Cn1cc(S(=O)(=O)NCC[N@@H+]2CCC[C@@H](C(=O)NCC[NH3+])C2)cn1 ZINC000430608182 483355618 /nfs/dbraw/zinc/35/56/18/483355618.db2.gz DSNFVUPVMHSSOT-GFCCVEGCSA-N 2 0 358.468 -1.515 20 0 FAADRP Cn1cc(S(=O)(=O)NCC[N@@H+]2CCC[C@H](C(=O)NCC[NH3+])C2)cn1 ZINC000430608184 483355816 /nfs/dbraw/zinc/35/58/16/483355816.db2.gz DSNFVUPVMHSSOT-LBPRGKRZSA-N 2 0 358.468 -1.515 20 0 FAADRP COCCCS(=O)(=O)NCC[N@@H+]1CCC[C@@H](C(=O)NCC[NH3+])C1 ZINC000430614950 483355631 /nfs/dbraw/zinc/35/56/31/483355631.db2.gz AOGNQEBMGBOGOC-CYBMUJFWSA-N 2 0 350.485 -1.271 20 0 FAADRP COCCCS(=O)(=O)NCC[N@@H+]1CCC[C@H](C(=O)NCC[NH3+])C1 ZINC000430614953 483355483 /nfs/dbraw/zinc/35/54/83/483355483.db2.gz AOGNQEBMGBOGOC-ZDUSSCGKSA-N 2 0 350.485 -1.271 20 0 FAADRP CC(=O)N1CCN(C(=O)C[N@@H+]2CCC[C@H](C(=O)N3CC[NH2+]CC3)C2)CC1 ZINC000430615813 483355030 /nfs/dbraw/zinc/35/50/30/483355030.db2.gz DFKQLFJRUBJPHN-INIZCTEOSA-N 2 0 365.478 -1.179 20 0 FAADRP CC(=O)N1CCN(C(=O)C[N@@H+]2CCC[C@@H](C(=O)N3CC[NH2+]CC3)C2)CC1 ZINC000430615814 483355206 /nfs/dbraw/zinc/35/52/06/483355206.db2.gz DFKQLFJRUBJPHN-MRXNPFEDSA-N 2 0 365.478 -1.179 20 0 FAADRP NC(=O)[C@@H]1CCCN(C(=O)C[N@@H+]2CCC[C@H](C(=O)N3CC[NH2+]CC3)C2)C1 ZINC000430620791 483355180 /nfs/dbraw/zinc/35/51/80/483355180.db2.gz CBVLMZQPIHYSEH-CABCVRRESA-N 2 0 365.478 -1.146 20 0 FAADRP NC(=O)[C@H]1CCCN(C(=O)C[N@@H+]2CCC[C@H](C(=O)N3CC[NH2+]CC3)C2)C1 ZINC000430620792 483355408 /nfs/dbraw/zinc/35/54/08/483355408.db2.gz CBVLMZQPIHYSEH-GJZGRUSLSA-N 2 0 365.478 -1.146 20 0 FAADRP NC(=O)[C@@H]1CCCN(C(=O)C[N@@H+]2CCC[C@@H](C(=O)N3CC[NH2+]CC3)C2)C1 ZINC000430620793 483355272 /nfs/dbraw/zinc/35/52/72/483355272.db2.gz CBVLMZQPIHYSEH-HUUCEWRRSA-N 2 0 365.478 -1.146 20 0 FAADRP NC(=O)[C@H]1CCCN(C(=O)C[N@@H+]2CCC[C@@H](C(=O)N3CC[NH2+]CC3)C2)C1 ZINC000430620794 483355690 /nfs/dbraw/zinc/35/56/90/483355690.db2.gz CBVLMZQPIHYSEH-LSDHHAIUSA-N 2 0 365.478 -1.146 20 0 FAADRP CC(C)C[N@@H+]1CCO[C@@H](CNC(=O)CN(C)CC(=O)N2CC[NH2+]CC2)C1 ZINC000430621127 483355821 /nfs/dbraw/zinc/35/58/21/483355821.db2.gz CZMGUPOLGKHISY-INIZCTEOSA-N 2 0 369.510 -1.177 20 0 FAADRP CC(C)C[N@@H+]1CCO[C@H](CNC(=O)CN(C)CC(=O)N2CC[NH2+]CC2)C1 ZINC000430621128 483355853 /nfs/dbraw/zinc/35/58/53/483355853.db2.gz CZMGUPOLGKHISY-MRXNPFEDSA-N 2 0 369.510 -1.177 20 0 FAADRP COC[C@H](C)NC(=O)NC(=O)C[N@@H+]1CCC[C@H](C(=O)N2CC[NH2+]CC2)C1 ZINC000430623926 483355866 /nfs/dbraw/zinc/35/58/66/483355866.db2.gz HKSYGFWFRWSUCP-KBPBESRZSA-N 2 0 369.466 -1.009 20 0 FAADRP COC[C@@H](C)NC(=O)NC(=O)C[N@@H+]1CCC[C@H](C(=O)N2CC[NH2+]CC2)C1 ZINC000430623927 483355098 /nfs/dbraw/zinc/35/50/98/483355098.db2.gz HKSYGFWFRWSUCP-KGLIPLIRSA-N 2 0 369.466 -1.009 20 0 FAADRP COC[C@H](C)NC(=O)NC(=O)C[N@@H+]1CCC[C@@H](C(=O)N2CC[NH2+]CC2)C1 ZINC000430623928 483355763 /nfs/dbraw/zinc/35/57/63/483355763.db2.gz HKSYGFWFRWSUCP-UONOGXRCSA-N 2 0 369.466 -1.009 20 0 FAADRP COC[C@@H](C)NC(=O)NC(=O)C[N@@H+]1CCC[C@@H](C(=O)N2CC[NH2+]CC2)C1 ZINC000430623929 483355724 /nfs/dbraw/zinc/35/57/24/483355724.db2.gz HKSYGFWFRWSUCP-ZIAGYGMSSA-N 2 0 369.466 -1.009 20 0 FAADRP [NH3+]CCNC(=O)[C@H]1CCC[N@H+](CC(=O)NCCCN2CCCC2=O)C1 ZINC000430633871 483355251 /nfs/dbraw/zinc/35/52/51/483355251.db2.gz QONQIHSFXDTZBI-AWEZNQCLSA-N 2 0 353.467 -1.098 20 0 FAADRP [NH3+]CCNC(=O)[C@@H]1CCC[N@H+](CC(=O)NCCCN2CCCC2=O)C1 ZINC000430633873 483355648 /nfs/dbraw/zinc/35/56/48/483355648.db2.gz QONQIHSFXDTZBI-CQSZACIVSA-N 2 0 353.467 -1.098 20 0 FAADRP C[C@H](C(=O)N(C)CC(=O)NC1CC1)[N@@H+]1CCC[C@@H](C(=O)NCC[NH3+])C1 ZINC000430635387 483355165 /nfs/dbraw/zinc/35/51/65/483355165.db2.gz GUJBDYORYVRBCZ-CHWSQXEVSA-N 2 0 353.467 -1.101 20 0 FAADRP C[C@H](C(=O)N(C)CC(=O)NC1CC1)[N@@H+]1CCC[C@H](C(=O)NCC[NH3+])C1 ZINC000430635389 483355050 /nfs/dbraw/zinc/35/50/50/483355050.db2.gz GUJBDYORYVRBCZ-OLZOCXBDSA-N 2 0 353.467 -1.101 20 0 FAADRP C[C@@H](C(=O)N(C)CC(=O)NC1CC1)[N@@H+]1CCC[C@@H](C(=O)NCC[NH3+])C1 ZINC000430635390 483355515 /nfs/dbraw/zinc/35/55/15/483355515.db2.gz GUJBDYORYVRBCZ-QWHCGFSZSA-N 2 0 353.467 -1.101 20 0 FAADRP C[C@@H](C(=O)N(C)CC(=O)NC1CC1)[N@@H+]1CCC[C@H](C(=O)NCC[NH3+])C1 ZINC000430635392 483355713 /nfs/dbraw/zinc/35/57/13/483355713.db2.gz GUJBDYORYVRBCZ-STQMWFEESA-N 2 0 353.467 -1.101 20 0 FAADRP C[C@H](C(=O)N1CCC[C@H](C(N)=O)C1)[N@@H+]1CCC[C@@H](C(=O)NCC[NH3+])C1 ZINC000430644158 483355808 /nfs/dbraw/zinc/35/58/08/483355808.db2.gz TUYBZQRFYJRMCD-HZSPNIEDSA-N 2 0 353.467 -1.114 20 0 FAADRP C[C@H](C(=O)N1CCC[C@@H](C(N)=O)C1)[N@@H+]1CCC[C@H](C(=O)NCC[NH3+])C1 ZINC000430644163 483355000 /nfs/dbraw/zinc/35/50/00/483355000.db2.gz TUYBZQRFYJRMCD-MCIONIFRSA-N 2 0 353.467 -1.114 20 0 FAADRP C[C@H](C(=O)N1CCC[C@@H](C(N)=O)C1)[N@@H+]1CCC[C@@H](C(=O)NCC[NH3+])C1 ZINC000430644166 483355793 /nfs/dbraw/zinc/35/57/93/483355793.db2.gz TUYBZQRFYJRMCD-MGPQQGTHSA-N 2 0 353.467 -1.114 20 0 FAADRP C[C@H](C(=O)N1CCC[C@H](C(N)=O)C1)[N@@H+]1CCC[C@H](C(=O)NCC[NH3+])C1 ZINC000430644169 483355474 /nfs/dbraw/zinc/35/54/74/483355474.db2.gz TUYBZQRFYJRMCD-RDBSUJKOSA-N 2 0 353.467 -1.114 20 0 FAADRP [NH3+]CCNC(=O)[C@H]1CCC[N@H+](CC(=O)N2CCN(C(=O)C3CC3)CC2)C1 ZINC000430645498 483355363 /nfs/dbraw/zinc/35/53/63/483355363.db2.gz CPTRGSREQAGILU-HNNXBMFYSA-N 2 0 365.478 -1.146 20 0 FAADRP [NH3+]CCNC(=O)[C@@H]1CCC[N@H+](CC(=O)N2CCN(C(=O)C3CC3)CC2)C1 ZINC000430645500 483356278 /nfs/dbraw/zinc/35/62/78/483356278.db2.gz CPTRGSREQAGILU-OAHLLOKOSA-N 2 0 365.478 -1.146 20 0 FAADRP CC(=O)N[C@H]1CCCN(C(=O)C[N@@H+]2CCC[C@@H](C(=O)NCC[NH3+])C2)C1 ZINC000430655124 483357203 /nfs/dbraw/zinc/35/72/03/483357203.db2.gz REICVCNFDSFDFY-CABCVRRESA-N 2 0 353.467 -1.100 20 0 FAADRP CC(=O)N[C@H]1CCCN(C(=O)C[N@@H+]2CCC[C@H](C(=O)NCC[NH3+])C2)C1 ZINC000430655125 483357133 /nfs/dbraw/zinc/35/71/33/483357133.db2.gz REICVCNFDSFDFY-GJZGRUSLSA-N 2 0 353.467 -1.100 20 0 FAADRP CC(=O)N[C@@H]1CCCN(C(=O)C[N@@H+]2CCC[C@@H](C(=O)NCC[NH3+])C2)C1 ZINC000430655126 483356486 /nfs/dbraw/zinc/35/64/86/483356486.db2.gz REICVCNFDSFDFY-HUUCEWRRSA-N 2 0 353.467 -1.100 20 0 FAADRP CC(=O)N[C@@H]1CCCN(C(=O)C[N@@H+]2CCC[C@H](C(=O)NCC[NH3+])C2)C1 ZINC000430655127 483357109 /nfs/dbraw/zinc/35/71/09/483357109.db2.gz REICVCNFDSFDFY-LSDHHAIUSA-N 2 0 353.467 -1.100 20 0 FAADRP O=C(C[NH+]1CCC[C@H](O)C1)N1CCN(C(=O)C[N@H+]2CCC[C@H](O)C2)CC1 ZINC000434696693 483363862 /nfs/dbraw/zinc/36/38/62/483363862.db2.gz GWKFUEOHKIYJOK-HOTGVXAUSA-N 2 0 368.478 -1.429 20 0 FAADRP O=C(C[NH+]1CCC[C@@H]1CO)N1CCN(C(=O)C[N@H+]2CCC[C@@H]2CO)CC1 ZINC000434803268 483365459 /nfs/dbraw/zinc/36/54/59/483365459.db2.gz AFLUOWVQVMCCBS-HZPDHXFCSA-N 2 0 368.478 -1.429 20 0 FAADRP O=C(C[NH+]1CCC[C@H]1CO)N1CCN(C(=O)C[N@H+]2CCC[C@H]2CO)CC1 ZINC000436204051 483367164 /nfs/dbraw/zinc/36/71/64/483367164.db2.gz AFLUOWVQVMCCBS-HOTGVXAUSA-N 2 0 368.478 -1.429 20 0 FAADRP O=C(C[NH+]1CCC[C@H]1CO)N1CCN(C(=O)C[N@H+]2CCC[C@@H]2CO)CC1 ZINC000436204052 483366924 /nfs/dbraw/zinc/36/69/24/483366924.db2.gz AFLUOWVQVMCCBS-IYBDPMFKSA-N 2 0 368.478 -1.429 20 0 FAADRP CCOCCN1CCN(C(=O)C(=O)Nc2ccn(CC[NH+](C)C)n2)CC1 ZINC000446732505 483774384 /nfs/dbraw/zinc/77/43/84/483774384.db2.gz RYLGREYVKSWQFC-UHFFFAOYSA-N 2 0 366.466 -0.436 20 0 FAADRP COCC[N@@H+]1CC[C@@H](NC(=O)C(=O)Nc2ccn(CC[NH+](C)C)n2)C1 ZINC000446784477 483768514 /nfs/dbraw/zinc/76/85/14/483768514.db2.gz NARPSUPAOVLJES-CYBMUJFWSA-N 2 0 352.439 -0.780 20 0 FAADRP COCC[N@@H+]1CC[C@H](NC(=O)C(=O)Nc2ccn(CC[NH+](C)C)n2)C1 ZINC000446784479 483768507 /nfs/dbraw/zinc/76/85/07/483768507.db2.gz NARPSUPAOVLJES-ZDUSSCGKSA-N 2 0 352.439 -0.780 20 0 FAADRP CNS(=O)(=O)NCC(=O)NCCC[NH+]1CCN(c2cc[nH+]cc2)CC1 ZINC000448835943 483386675 /nfs/dbraw/zinc/38/66/75/483386675.db2.gz NEJSFEPGHUXALD-UHFFFAOYSA-N 2 0 370.479 -1.236 20 0 FAADRP CC1[C@@H](C(=O)NC[C@@](C)(O)C[NH+](C)C)[C@@H]1C(=O)NC[C@@](C)(O)C[NH+](C)C ZINC000450204165 483386593 /nfs/dbraw/zinc/38/65/93/483386593.db2.gz IWNGCFMXPMXUEK-DTTOXWODSA-N 2 0 372.510 -1.274 20 0 FAADRP CC1[C@@H](C(=O)NC[C@](C)(O)C[NH+](C)C)[C@@H]1C(=O)NC[C@](C)(O)C[NH+](C)C ZINC000450204166 483386972 /nfs/dbraw/zinc/38/69/72/483386972.db2.gz IWNGCFMXPMXUEK-KNCCTNLNSA-N 2 0 372.510 -1.274 20 0 FAADRP C[C@@H]1[C@@H](C(=O)NC[C@@](C)(O)C[NH+](C)C)[C@@H]1C(=O)NC[C@](C)(O)C[NH+](C)C ZINC000450204167 272869346 /nfs/dbraw/zinc/86/93/46/272869346.db2.gz IWNGCFMXPMXUEK-NBZYUPRNSA-N 2 0 372.510 -1.274 20 0 FAADRP CN(CC[NH+](C)C)C(=O)C(=O)N1CCN(C(=O)C[NH+]2CCCC2)CC1 ZINC000459892128 483400499 /nfs/dbraw/zinc/40/04/99/483400499.db2.gz CLWZESDFZUJAII-UHFFFAOYSA-N 2 0 353.467 -1.227 20 0 FAADRP CN(CC[NH+](C)C)C(=O)C(=O)N1CCN(C(=O)[C@@H]2CCC[N@@H+]2C)CC1 ZINC000459892255 483400964 /nfs/dbraw/zinc/40/09/64/483400964.db2.gz DLNNXRDWXNMRJD-AWEZNQCLSA-N 2 0 353.467 -1.229 20 0 FAADRP CN(CC[NH+](C)C)C(=O)C(=O)N1CCN(C(=O)[C@H]2CCC[N@@H+]2C)CC1 ZINC000459892258 483401074 /nfs/dbraw/zinc/40/10/74/483401074.db2.gz DLNNXRDWXNMRJD-CQSZACIVSA-N 2 0 353.467 -1.229 20 0 FAADRP CC(C)[C@@H](CO)[NH2+]CC(=O)N1CCN(C(=O)C[NH2+][C@H](CO)C(C)C)CC1 ZINC000464478096 483410728 /nfs/dbraw/zinc/41/07/28/483410728.db2.gz CSRWSTUZMBEYDI-HZPDHXFCSA-N 2 0 372.510 -1.130 20 0 FAADRP Cn1ncc2c1ncnc2N1CCN(C(=O)CN(CC[NH3+])CCO)CC1 ZINC000466991276 483412683 /nfs/dbraw/zinc/41/26/83/483412683.db2.gz GEBVHGOVZIQGIW-UHFFFAOYSA-N 2 0 362.438 -1.735 20 0 FAADRP C[NH+](C)CCN1C[C@@H](C(=O)N2CCN(C(=O)C[NH+](C)C)CC2)CC1=O ZINC000468489987 483123353 /nfs/dbraw/zinc/12/33/53/483123353.db2.gz USVKTVBZLDUPDQ-AWEZNQCLSA-N 2 0 353.467 -1.371 20 0 FAADRP C[NH+](C)CCN1C[C@H](C(=O)N2CCN(C(=O)C[NH+](C)C)CC2)CC1=O ZINC000468489988 483123445 /nfs/dbraw/zinc/12/34/45/483123445.db2.gz USVKTVBZLDUPDQ-CQSZACIVSA-N 2 0 353.467 -1.371 20 0 FAADRP C[NH+](C)CCN1C[C@@H](C(=O)NCCC[N@@H+]2CCC[C@H]2C(N)=O)CC1=O ZINC000469114253 483418824 /nfs/dbraw/zinc/41/88/24/483418824.db2.gz RRFYIJLRBIJTJL-KBPBESRZSA-N 2 0 353.467 -1.148 20 0 FAADRP C[NH+](C)CCN1C[C@H](C(=O)NCCC[N@@H+]2CCC[C@H]2C(N)=O)CC1=O ZINC000469114306 483418296 /nfs/dbraw/zinc/41/82/96/483418296.db2.gz RRFYIJLRBIJTJL-KGLIPLIRSA-N 2 0 353.467 -1.148 20 0 FAADRP C[NH+](C)CCN1C[C@@H](C(=O)NCCC[N@@H+]2CCC[C@@H]2C(N)=O)CC1=O ZINC000469114387 483418882 /nfs/dbraw/zinc/41/88/82/483418882.db2.gz RRFYIJLRBIJTJL-UONOGXRCSA-N 2 0 353.467 -1.148 20 0 FAADRP C[NH+](C)CCN1C[C@H](C(=O)NCCC[N@@H+]2CCC[C@@H]2C(N)=O)CC1=O ZINC000469114575 483418318 /nfs/dbraw/zinc/41/83/18/483418318.db2.gz RRFYIJLRBIJTJL-ZIAGYGMSSA-N 2 0 353.467 -1.148 20 0 FAADRP C[C@H](C(=O)NC[C@]1(O)CC[NH+](C)C1)[C@H](C)C(=O)NC[C@@]1(O)CC[N@H+](C)C1 ZINC000480418046 483443643 /nfs/dbraw/zinc/44/36/43/483443643.db2.gz NYFVELYCTUHPTD-DFEHZGFQSA-N 2 0 370.494 -1.376 20 0 FAADRP C[C@H](C(=O)NC[C@]1(O)CC[NH+](C)C1)[C@H](C)C(=O)NC[C@]1(O)CC[N@H+](C)C1 ZINC000480418051 483443923 /nfs/dbraw/zinc/44/39/23/483443923.db2.gz NYFVELYCTUHPTD-LBTBCDHLSA-N 2 0 370.494 -1.376 20 0 FAADRP C[C@@H](C(=O)NC[C@]1(O)CC[N@H+](C)C1)[C@H](C)C(=O)NC[C@]1(O)CC[NH+](C)C1 ZINC000480418053 483443804 /nfs/dbraw/zinc/44/38/04/483443804.db2.gz NYFVELYCTUHPTD-LTCOOKNTSA-N 2 0 370.494 -1.376 20 0 FAADRP C[C@@H](C(=O)NC[C@@]1(O)CC[N@H+](C)C1)[C@H](C)C(=O)NC[C@]1(O)CC[NH+](C)C1 ZINC000480418055 483443716 /nfs/dbraw/zinc/44/37/16/483443716.db2.gz NYFVELYCTUHPTD-PURYLZLUSA-N 2 0 370.494 -1.376 20 0 FAADRP Cc1nc(NC[C@](C)(O)C[NH+](C)C)nc(NC[C@](C)(O)C[NH+](C)C)n1 ZINC000480442627 483444688 /nfs/dbraw/zinc/44/46/88/483444688.db2.gz IVRIPTNKKFOEGX-HOTGVXAUSA-N 2 0 355.487 -1.527 20 0 FAADRP Cc1nc(NC[C@@](C)(O)C[NH+](C)C)nc(NC[C@@](C)(O)C[NH+](C)C)n1 ZINC000480442635 483443974 /nfs/dbraw/zinc/44/39/74/483443974.db2.gz IVRIPTNKKFOEGX-HZPDHXFCSA-N 2 0 355.487 -1.527 20 0 FAADRP Cc1nc(NC[C@@](C)(O)C[NH+](C)C)nc(NC[C@](C)(O)C[NH+](C)C)n1 ZINC000480442637 483444363 /nfs/dbraw/zinc/44/43/63/483444363.db2.gz IVRIPTNKKFOEGX-IYBDPMFKSA-N 2 0 355.487 -1.527 20 0 FAADRP C[C@@]1(O)CC[N@H+](CC(=O)N2CCN(C(=O)C[NH+]3CC[C@](C)(O)C3)CC2)C1 ZINC000483051714 483449553 /nfs/dbraw/zinc/44/95/53/483449553.db2.gz UNYJNXQYUQEQJQ-HDICACEKSA-N 2 0 368.478 -1.429 20 0 FAADRP C[C@@]1(O)CC[NH+](CC(=O)N2CCN(C(=O)C[N@H+]3CC[C@@](C)(O)C3)CC2)C1 ZINC000483051717 483450428 /nfs/dbraw/zinc/45/04/28/483450428.db2.gz UNYJNXQYUQEQJQ-QZTJIDSGSA-N 2 0 368.478 -1.429 20 0 FAADRP C[C@]1(O)CC[NH+](CC(=O)N2CCN(C(=O)C[N@H+]3CC[C@](C)(O)C3)CC2)C1 ZINC000483051720 483449498 /nfs/dbraw/zinc/44/94/98/483449498.db2.gz UNYJNXQYUQEQJQ-ROUUACIJSA-N 2 0 368.478 -1.429 20 0 FAADRP C[NH+](C)CCNC(=O)Cn1cc(NC(=O)[C@@H]2C[N@@H+]3CCN2CCC3)cn1 ZINC000485374725 483456043 /nfs/dbraw/zinc/45/60/43/483456043.db2.gz CXLAJLQOUYRROO-HNNXBMFYSA-N 2 0 363.466 -1.111 20 0 FAADRP C[NH+](C)CCNC(=O)Cn1cc(NC(=O)[C@H]2C[N@@H+]3CCN2CCC3)cn1 ZINC000485374726 272880885 /nfs/dbraw/zinc/88/08/85/272880885.db2.gz CXLAJLQOUYRROO-OAHLLOKOSA-N 2 0 363.466 -1.111 20 0 FAADRP C[N@H+](CCNC(=O)C(=O)N1CCN(C(=O)[C@@H]2CCC[NH+]2C)CC1)C1CC1 ZINC000485541438 483456693 /nfs/dbraw/zinc/45/66/93/483456693.db2.gz YFKHZJJXZHKALZ-HNNXBMFYSA-N 2 0 365.478 -1.038 20 0 FAADRP C[N@H+](CCNC(=O)C(=O)N1CCN(C(=O)[C@H]2CCC[NH+]2C)CC1)C1CC1 ZINC000485541445 483457516 /nfs/dbraw/zinc/45/75/16/483457516.db2.gz YFKHZJJXZHKALZ-OAHLLOKOSA-N 2 0 365.478 -1.038 20 0 FAADRP C[N@H+](CCNC(=O)C(=O)N1CCN(C(=O)C[NH+]2CCCC2)CC1)C1CC1 ZINC000485605983 483457302 /nfs/dbraw/zinc/45/73/02/483457302.db2.gz YILLNDPAUYZGHI-UHFFFAOYSA-N 2 0 365.478 -1.037 20 0 FAADRP NS(=O)(=O)C[C@H]1CCCN1CCC[N@@H+]1CCC[C@@H]1CS(N)(=O)=O ZINC000489661883 483465873 /nfs/dbraw/zinc/46/58/73/483465873.db2.gz ZBSMLXRCZXWQRJ-CHWSQXEVSA-N 2 0 368.525 -1.118 20 0 FAADRP NS(=O)(=O)C[C@@H]1CCCN1CCC[N@@H+]1CCC[C@H]1CS(N)(=O)=O ZINC000489661885 483466482 /nfs/dbraw/zinc/46/64/82/483466482.db2.gz ZBSMLXRCZXWQRJ-STQMWFEESA-N 2 0 368.525 -1.118 20 0 FAADRP C[NH+](C)CCOCCNC(=O)C(=O)NCCN1CC[N@H+](C)C(C)(C)C1 ZINC000496327386 483475263 /nfs/dbraw/zinc/47/52/63/483475263.db2.gz LLCCJHQAWYTBSX-UHFFFAOYSA-N 2 0 357.499 -1.177 20 0 FAADRP CN(CC[N@H+](C)C1CCN(C)CC1)C(=O)CN1C(=O)C(=O)N(C)C1=O ZINC000498438891 483449808 /nfs/dbraw/zinc/44/98/08/483449808.db2.gz JALDOXRARZSXLZ-UHFFFAOYSA-N 2 0 353.423 -1.109 20 0 FAADRP COCCCNC(=O)[C@H](C)N1CC[NH+](CCC(=O)N2CC[NH2+]CC2)CC1 ZINC000508624835 483503733 /nfs/dbraw/zinc/50/37/33/483503733.db2.gz HFYIYUSNKWYSFV-INIZCTEOSA-N 2 0 369.510 -1.033 20 0 FAADRP COCCCNC(=O)[C@@H](C)N1CC[NH+](CCC(=O)N2CC[NH2+]CC2)CC1 ZINC000508624836 483503016 /nfs/dbraw/zinc/50/30/16/483503016.db2.gz HFYIYUSNKWYSFV-MRXNPFEDSA-N 2 0 369.510 -1.033 20 0 FAADRP C[C@@H]1C[NH+](CC(=O)N2CCN(C(=O)C[N@@H+]3C[C@H](O)[C@@H](C)C3)CC2)C[C@@H]1O ZINC000509081817 483505307 /nfs/dbraw/zinc/50/53/07/483505307.db2.gz UQELUMYPGWDEHU-FZKCQIBNSA-N 2 0 368.478 -1.718 20 0 FAADRP C[C@@H]1C[NH+](CC(=O)N2CCN(C(=O)C[N@@H+]3C[C@H](O)[C@@H](C)C3)CC2)C[C@H]1O ZINC000509081818 483504638 /nfs/dbraw/zinc/50/46/38/483504638.db2.gz UQELUMYPGWDEHU-GEEKYZPCSA-N 2 0 368.478 -1.718 20 0 FAADRP C[C@@H]1C[NH+](CC(=O)N2CCN(C(=O)C[N@H+]3C[C@H](C)[C@H](O)C3)CC2)C[C@H]1O ZINC000509081819 483504312 /nfs/dbraw/zinc/50/43/12/483504312.db2.gz UQELUMYPGWDEHU-QKPAOTATSA-N 2 0 368.478 -1.718 20 0 FAADRP C[C@@H]1C[NH+](CC(=O)N2CCN(C(=O)C[N@H+]3C[C@H](C)[C@H](O)C3)CC2)C[C@@H]1O ZINC000509081820 483504772 /nfs/dbraw/zinc/50/47/72/483504772.db2.gz UQELUMYPGWDEHU-SYMSYNOKSA-N 2 0 368.478 -1.718 20 0 FAADRP CNC(=O)[C@H]1CN(C(=O)C(=O)N(CC[NH+](C)C)CC[NH+](C)C)CCO1 ZINC000514658893 483197351 /nfs/dbraw/zinc/19/73/51/483197351.db2.gz LOJSZKADVQZQGO-CYBMUJFWSA-N 2 0 357.455 -2.088 20 0 FAADRP CNC(=O)[C@@H]1CN(C(=O)C(=O)N(CC[NH+](C)C)CC[NH+](C)C)CCO1 ZINC000514658898 483197678 /nfs/dbraw/zinc/19/76/78/483197678.db2.gz LOJSZKADVQZQGO-ZDUSSCGKSA-N 2 0 357.455 -2.088 20 0 FAADRP CC(C)(CNC(=O)C(=O)NCC(=O)N1CC[NH2+]CC1)C[NH+]1CCCC1 ZINC000514925590 483344502 /nfs/dbraw/zinc/34/45/02/483344502.db2.gz GHUODWVKBWHDDY-UHFFFAOYSA-N 2 0 353.467 -1.227 20 0 FAADRP O=C(C[NH+]1CCCC1)N1CCN(C(=O)NCCN2CC[NH2+]CC2)CC1 ZINC000515375565 483346914 /nfs/dbraw/zinc/34/69/14/483346914.db2.gz GOQZCFVUSCILPN-UHFFFAOYSA-N 2 0 352.483 -1.159 20 0 FAADRP C[NH+](C)[C@H]1CN(C(=O)CSCC(=O)N2C[C@H](O)[C@@H]([NH+](C)C)C2)C[C@@H]1O ZINC000516118111 483348645 /nfs/dbraw/zinc/34/86/45/483348645.db2.gz UNFXOLUWBBAAOO-XUXIUFHCSA-N 2 0 374.507 -2.014 20 0 FAADRP O=C(C[NH+]1CCCC1)N1CCN(C(=O)C(=O)N2C[C@H]3C[NH2+]C[C@H]3C2)CC1 ZINC000516562359 483471020 /nfs/dbraw/zinc/47/10/20/483471020.db2.gz QIXFJSRDKCSWRU-GASCZTMLSA-N 2 0 363.462 -1.569 20 0 FAADRP C[C@H](NC(=O)C(=O)N1CCN2C(=O)[C@@H]([NH3+])C[C@H]2C1)C(C)(C)C[NH+](C)C ZINC000516665167 483519146 /nfs/dbraw/zinc/51/91/46/483519146.db2.gz WJFLCAAIWCLUMM-AVGNSLFASA-N 2 0 353.467 -1.151 20 0 FAADRP C[C@H](NC(=O)C(=O)N1CCN2C(=O)[C@H]([NH3+])C[C@H]2C1)C(C)(C)C[NH+](C)C ZINC000516665170 483519590 /nfs/dbraw/zinc/51/95/90/483519590.db2.gz WJFLCAAIWCLUMM-RWMBFGLXSA-N 2 0 353.467 -1.151 20 0 FAADRP C[C@H](NC(=O)C(=O)N1CCN2C(=O)[C@@H]([NH3+])C[C@@H]2C1)C(C)(C)C[NH+](C)C ZINC000516665171 483520010 /nfs/dbraw/zinc/52/00/10/483520010.db2.gz WJFLCAAIWCLUMM-XQQFMLRXSA-N 2 0 353.467 -1.151 20 0 FAADRP C[C@H](NC(=O)C(=O)N1CCN2C(=O)[C@H]([NH3+])C[C@@H]2C1)C(C)(C)C[NH+](C)C ZINC000516665172 483520197 /nfs/dbraw/zinc/52/01/97/483520197.db2.gz WJFLCAAIWCLUMM-YNEHKIRRSA-N 2 0 353.467 -1.151 20 0 FAADRP CC[NH2+]CCCNC(=O)C(=O)N1CCN(C(=O)C[NH+]2CCCC2)CC1 ZINC000516751448 483520126 /nfs/dbraw/zinc/52/01/26/483520126.db2.gz DPYDGDYBIKWMGO-UHFFFAOYSA-N 2 0 353.467 -1.131 20 0 FAADRP C[NH+](C)C1(CNC(=O)C(=O)N2CCN3C(=O)[C@H]([NH3+])C[C@@H]3C2)CCCC1 ZINC000517394765 483523410 /nfs/dbraw/zinc/52/34/10/483523410.db2.gz RPLUYUOCKWSUAM-CHWSQXEVSA-N 2 0 351.451 -1.253 20 0 FAADRP C[NH+](C)C1(CNC(=O)C(=O)N2CCN3C(=O)[C@@H]([NH3+])C[C@@H]3C2)CCCC1 ZINC000517394768 483522541 /nfs/dbraw/zinc/52/25/41/483522541.db2.gz RPLUYUOCKWSUAM-OLZOCXBDSA-N 2 0 351.451 -1.253 20 0 FAADRP C[NH+](C)C1(CNC(=O)C(=O)N2CCN3C(=O)[C@H]([NH3+])C[C@H]3C2)CCCC1 ZINC000517394770 483522712 /nfs/dbraw/zinc/52/27/12/483522712.db2.gz RPLUYUOCKWSUAM-QWHCGFSZSA-N 2 0 351.451 -1.253 20 0 FAADRP C[NH+](C)C1(CNC(=O)C(=O)N2CCN3C(=O)[C@@H]([NH3+])C[C@H]3C2)CCCC1 ZINC000517394771 483522891 /nfs/dbraw/zinc/52/28/91/483522891.db2.gz RPLUYUOCKWSUAM-STQMWFEESA-N 2 0 351.451 -1.253 20 0 FAADRP C[NH+](C)CC1(CNC(=O)C(=O)NCC(=O)N2CC[NH2+]CC2)CCCC1 ZINC000517541609 483523164 /nfs/dbraw/zinc/52/31/64/483523164.db2.gz WNXWBBUKRICBFK-UHFFFAOYSA-N 2 0 353.467 -1.227 20 0 FAADRP Cn1cc(S(=O)(=O)N(CC[NH+](C)C)CC[NH+](C)C)c(=O)n(C)c1=O ZINC000517826649 482621997 /nfs/dbraw/zinc/62/19/97/482621997.db2.gz FPOISDJAKFDKOZ-UHFFFAOYSA-N 2 0 361.468 -1.802 20 0 FAADRP [NH3+][C@@H]1C[C@H]2CN(C(=O)C(=O)NC[C@H]3CCCC[N@@H+]3C3CC3)CCN2C1=O ZINC000517966534 482622048 /nfs/dbraw/zinc/62/20/48/482622048.db2.gz XXDHKWXIROUBKU-QLFBSQMISA-N 2 0 363.462 -1.110 20 0 FAADRP [NH3+][C@@H]1C[C@@H]2CN(C(=O)C(=O)NC[C@H]3CCCC[N@@H+]3C3CC3)CCN2C1=O ZINC000517966535 482621630 /nfs/dbraw/zinc/62/16/30/482621630.db2.gz XXDHKWXIROUBKU-RBSFLKMASA-N 2 0 363.462 -1.110 20 0 FAADRP [NH3+][C@@H]1C[C@@H]2CN(C(=O)C(=O)NC[C@@H]3CCCC[N@@H+]3C3CC3)CCN2C1=O ZINC000517966536 482621895 /nfs/dbraw/zinc/62/18/95/482621895.db2.gz XXDHKWXIROUBKU-RRFJBIMHSA-N 2 0 363.462 -1.110 20 0 FAADRP [NH3+][C@@H]1C[C@H]2CN(C(=O)C(=O)NC[C@@H]3CCCC[N@@H+]3C3CC3)CCN2C1=O ZINC000517966537 482621425 /nfs/dbraw/zinc/62/14/25/482621425.db2.gz XXDHKWXIROUBKU-SOUVJXGZSA-N 2 0 363.462 -1.110 20 0 FAADRP C[NH+](C)CCN1C(=O)C[C@H](N2CCN(C(=O)C[NH+]3CCCC3)CC2)C1=O ZINC000518049559 482622983 /nfs/dbraw/zinc/62/29/83/482622983.db2.gz KBEWOYFSVVLYAV-HNNXBMFYSA-N 2 0 365.478 -1.085 20 0 FAADRP C[NH+](C)CCN1C(=O)C[C@@H](N2CCN(C(=O)C[NH+]3CCCC3)CC2)C1=O ZINC000518049560 482622656 /nfs/dbraw/zinc/62/26/56/482622656.db2.gz KBEWOYFSVVLYAV-OAHLLOKOSA-N 2 0 365.478 -1.085 20 0 FAADRP COC(=O)CN(CCN1CC[NH+](C)CC1)C(=O)[C@@H]1C[N@@H+]2CCN1CCC2 ZINC000519047542 483135981 /nfs/dbraw/zinc/13/59/81/483135981.db2.gz XYWCCEUVMTZQCN-INIZCTEOSA-N 2 0 367.494 -1.375 20 0 FAADRP COC(=O)CN(CCN1CC[NH+](C)CC1)C(=O)[C@H]1C[N@@H+]2CCN1CCC2 ZINC000519047543 483136154 /nfs/dbraw/zinc/13/61/54/483136154.db2.gz XYWCCEUVMTZQCN-MRXNPFEDSA-N 2 0 367.494 -1.375 20 0 FAADRP C[NH+]1CCN(C[C@@H](O)C[NH2+]CCCn2nc3n(c2=O)CCCC3)CC1 ZINC000519141788 483137874 /nfs/dbraw/zinc/13/78/74/483137874.db2.gz QJNGHHBYGLBDCX-HNNXBMFYSA-N 2 0 352.483 -1.031 20 0 FAADRP C[NH+]1CCN(C[C@H](O)C[NH2+]CCCn2nc3n(c2=O)CCCC3)CC1 ZINC000519141791 483137848 /nfs/dbraw/zinc/13/78/48/483137848.db2.gz QJNGHHBYGLBDCX-OAHLLOKOSA-N 2 0 352.483 -1.031 20 0 FAADRP C[NH+](C)C1CCC(NC(=O)C(=O)N2CCN3C(=O)[C@H]([NH3+])C[C@H]3C2)CC1 ZINC000519182854 483137606 /nfs/dbraw/zinc/13/76/06/483137606.db2.gz BRXGCNQFVIGTOQ-CLRIEMFWSA-N 2 0 351.451 -1.254 20 0 FAADRP C[NH+](C)C1CCC(NC(=O)C(=O)N2CCN3C(=O)[C@@H]([NH3+])C[C@H]3C2)CC1 ZINC000519182855 483137091 /nfs/dbraw/zinc/13/70/91/483137091.db2.gz BRXGCNQFVIGTOQ-HOAMVYINSA-N 2 0 351.451 -1.254 20 0 FAADRP C[NH+](C)C1CCC(NC(=O)C(=O)N2CCN3C(=O)[C@H]([NH3+])C[C@@H]3C2)CC1 ZINC000519182856 483137247 /nfs/dbraw/zinc/13/72/47/483137247.db2.gz BRXGCNQFVIGTOQ-NWINJMCUSA-N 2 0 351.451 -1.254 20 0 FAADRP C[NH+](C)C1CCC(NC(=O)C(=O)N2CCN3C(=O)[C@@H]([NH3+])C[C@@H]3C2)CC1 ZINC000519182857 483137542 /nfs/dbraw/zinc/13/75/42/483137542.db2.gz BRXGCNQFVIGTOQ-PQAZSJQKSA-N 2 0 351.451 -1.254 20 0 FAADRP CC[N@H+](CCNC(=O)C(=O)N(C)C[C@H](O)CN1CCOCC1)C1CC1 ZINC000519635527 483142622 /nfs/dbraw/zinc/14/26/22/483142622.db2.gz PTGFHRNGEOKTCM-HNNXBMFYSA-N 2 0 356.467 -1.262 20 0 FAADRP CC[N@H+](CCNC(=O)C(=O)N(C)C[C@@H](O)CN1CCOCC1)C1CC1 ZINC000519635541 483142366 /nfs/dbraw/zinc/14/23/66/483142366.db2.gz PTGFHRNGEOKTCM-OAHLLOKOSA-N 2 0 356.467 -1.262 20 0 FAADRP CNC(=O)[C@H]1CCC[C@@H]1NC(=O)C(=O)N(CC[NH+](C)C)CC[NH+](C)C ZINC000519732028 483143282 /nfs/dbraw/zinc/14/32/82/483143282.db2.gz UTAFMOBZKKYYAB-KBPBESRZSA-N 2 0 355.483 -1.031 20 0 FAADRP CNC(=O)[C@@H]1CCC[C@@H]1NC(=O)C(=O)N(CC[NH+](C)C)CC[NH+](C)C ZINC000519732105 483144332 /nfs/dbraw/zinc/14/43/32/483144332.db2.gz UTAFMOBZKKYYAB-KGLIPLIRSA-N 2 0 355.483 -1.031 20 0 FAADRP CNC(=O)[C@H]1CCC[C@H]1NC(=O)C(=O)N(CC[NH+](C)C)CC[NH+](C)C ZINC000519732109 483144074 /nfs/dbraw/zinc/14/40/74/483144074.db2.gz UTAFMOBZKKYYAB-UONOGXRCSA-N 2 0 355.483 -1.031 20 0 FAADRP CNC(=O)[C@@H]1CCC[C@H]1NC(=O)C(=O)N(CC[NH+](C)C)CC[NH+](C)C ZINC000519732118 483144116 /nfs/dbraw/zinc/14/41/16/483144116.db2.gz UTAFMOBZKKYYAB-ZIAGYGMSSA-N 2 0 355.483 -1.031 20 0 FAADRP C[N@H+](CCNC(=O)C(=O)NCC(=O)N1CC[NH2+]CC1)Cc1ccccc1 ZINC000519814757 483143472 /nfs/dbraw/zinc/14/34/72/483143472.db2.gz ZXVJISCJVXNSAK-UHFFFAOYSA-N 2 0 361.446 -1.217 20 0 FAADRP C[C@@H]1CN(C(=O)C(=O)N(CC[NH+](C)C)CC[NH+](C)C)C[C@H](C)N1CCO ZINC000520529469 483151982 /nfs/dbraw/zinc/15/19/82/483151982.db2.gz LRRDLMVBSKPGRX-IYBDPMFKSA-N 3 0 371.526 -1.148 20 0 FAADRP C[NH+](C)CCN(C[C@@H]1CCCO1)C(=O)C(=O)NCC(=O)N1CC[NH2+]CC1 ZINC000521218186 483526609 /nfs/dbraw/zinc/52/66/09/483526609.db2.gz DRZRPECZCJPVEG-AWEZNQCLSA-N 2 0 369.466 -1.896 20 0 FAADRP C[NH+](C)CCN(C[C@H]1CCCO1)C(=O)C(=O)NCC(=O)N1CC[NH2+]CC1 ZINC000521218187 483526882 /nfs/dbraw/zinc/52/68/82/483526882.db2.gz DRZRPECZCJPVEG-CQSZACIVSA-N 2 0 369.466 -1.896 20 0 FAADRP CC(C)(CNC(=O)C(=O)N1CCN2C(=O)[C@@H]([NH3+])C[C@H]2C1)C[NH+]1CCCC1 ZINC000521464446 483286292 /nfs/dbraw/zinc/28/62/92/483286292.db2.gz WYCIRGSFCVPBBN-KBPBESRZSA-N 2 0 365.478 -1.005 20 0 FAADRP CC(C)(CNC(=O)C(=O)N1CCN2C(=O)[C@@H]([NH3+])C[C@@H]2C1)C[NH+]1CCCC1 ZINC000521464447 483286182 /nfs/dbraw/zinc/28/61/82/483286182.db2.gz WYCIRGSFCVPBBN-KGLIPLIRSA-N 2 0 365.478 -1.005 20 0 FAADRP CC(C)(CNC(=O)C(=O)N1CCN2C(=O)[C@H]([NH3+])C[C@H]2C1)C[NH+]1CCCC1 ZINC000521464448 483287087 /nfs/dbraw/zinc/28/70/87/483287087.db2.gz WYCIRGSFCVPBBN-UONOGXRCSA-N 2 0 365.478 -1.005 20 0 FAADRP CC(C)(CNC(=O)C(=O)N1CCN2C(=O)[C@H]([NH3+])C[C@@H]2C1)C[NH+]1CCCC1 ZINC000521464449 272892934 /nfs/dbraw/zinc/89/29/34/272892934.db2.gz WYCIRGSFCVPBBN-ZIAGYGMSSA-N 2 0 365.478 -1.005 20 0 FAADRP C[C@H](CNC(=O)C(=O)N(CC[NH+](C)C)CC[NH+](C)C)S(N)(=O)=O ZINC000525882381 483129352 /nfs/dbraw/zinc/12/93/52/483129352.db2.gz WAZGMULQXJJABQ-LLVKDONJSA-N 2 0 351.473 -2.269 20 0 FAADRP C[C@@H](CNC(=O)C(=O)N(CC[NH+](C)C)CC[NH+](C)C)S(N)(=O)=O ZINC000525882382 483128652 /nfs/dbraw/zinc/12/86/52/483128652.db2.gz WAZGMULQXJJABQ-NSHDSACASA-N 2 0 351.473 -2.269 20 0 FAADRP Cc1cncn1CC(=O)N1CCN(S(=O)(=O)N2CCN(C)CC2)CC1 ZINC000527900515 483330229 /nfs/dbraw/zinc/33/02/29/483330229.db2.gz WMGJMMJEJDRWAN-UHFFFAOYSA-N 2 0 370.479 -1.172 20 0 FAADRP CN1CC[N@H+](C)C[C@@H]1CNC(=O)N1CCN(C(=O)N2CC[NH2+]CC2)CC1 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FAADRP Cc1nc2n(n1)C[C@@H](NC(=O)C(=O)N(CC[NH+](C)C)CC[NH+](C)C)CC2 ZINC000561126933 482681614 /nfs/dbraw/zinc/68/16/14/482681614.db2.gz HETMVOJOEVKTAS-AWEZNQCLSA-N 2 0 365.482 -1.031 20 0 FAADRP Cc1nc2n(n1)C[C@H](NC(=O)C(=O)N(CC[NH+](C)C)CC[NH+](C)C)CC2 ZINC000561126934 482681216 /nfs/dbraw/zinc/68/12/16/482681216.db2.gz HETMVOJOEVKTAS-CQSZACIVSA-N 2 0 365.482 -1.031 20 0 FAADRP CC(C)C[N@@H+]1CCO[C@@H](CNC(=O)C(=O)NCC(=O)N2CC[NH2+]CC2)C1 ZINC000561227533 482683560 /nfs/dbraw/zinc/68/35/60/482683560.db2.gz CNDOVGOEQKXUGQ-AWEZNQCLSA-N 2 0 369.466 -1.993 20 0 FAADRP CC(C)C[N@@H+]1CCO[C@H](CNC(=O)C(=O)NCC(=O)N2CC[NH2+]CC2)C1 ZINC000561227534 482683034 /nfs/dbraw/zinc/68/30/34/482683034.db2.gz CNDOVGOEQKXUGQ-CQSZACIVSA-N 2 0 369.466 -1.993 20 0 FAADRP CC(C)[C@H](CNC(=O)C(=O)N1CCN(C)C[C@H]1C[NH3+])N1CC[NH+](C)CC1 ZINC000561231255 482682836 /nfs/dbraw/zinc/68/28/36/482682836.db2.gz VHZSFJNSCYIYCP-CVEARBPZSA-N 2 0 368.526 -1.524 20 0 FAADRP CC(C)[C@H](CNC(=O)C(=O)N1CCN(C)C[C@@H]1C[NH3+])N1CC[NH+](C)CC1 ZINC000561231256 482682938 /nfs/dbraw/zinc/68/29/38/482682938.db2.gz VHZSFJNSCYIYCP-HOTGVXAUSA-N 2 0 368.526 -1.524 20 0 FAADRP CC(C)[C@@H](CNC(=O)C(=O)N1CCN(C)C[C@H]1C[NH3+])N1CC[NH+](C)CC1 ZINC000561231257 482683000 /nfs/dbraw/zinc/68/30/00/482683000.db2.gz VHZSFJNSCYIYCP-HZPDHXFCSA-N 2 0 368.526 -1.524 20 0 FAADRP CC(C)[C@@H](CNC(=O)C(=O)N1CCN(C)C[C@@H]1C[NH3+])N1CC[NH+](C)CC1 ZINC000561231258 482683492 /nfs/dbraw/zinc/68/34/92/482683492.db2.gz VHZSFJNSCYIYCP-JKSUJKDBSA-N 2 0 368.526 -1.524 20 0 FAADRP C[NH+](C)CCN(CC[NH+](C)C)C(=O)C(=O)N1CCN(CC(N)=O)C(=O)C1 ZINC000562692116 482699675 /nfs/dbraw/zinc/69/96/75/482699675.db2.gz JOKZLQOUORYCEH-UHFFFAOYSA-N 2 0 370.454 -2.906 20 0 FAADRP CNC(=O)[C@@]1(C)CCN(C(=O)C(=O)N(CC[NH+](C)C)CC[NH+](C)C)C1 ZINC000562692424 482699755 /nfs/dbraw/zinc/69/97/55/482699755.db2.gz BUGAYIIUOYNWOE-KRWDZBQOSA-N 2 0 355.483 -1.077 20 0 FAADRP CNC(=O)[C@]1(C)CCN(C(=O)C(=O)N(CC[NH+](C)C)CC[NH+](C)C)C1 ZINC000562692425 482699734 /nfs/dbraw/zinc/69/97/34/482699734.db2.gz BUGAYIIUOYNWOE-QGZVFWFLSA-N 2 0 355.483 -1.077 20 0 FAADRP O=C(CNC(=O)C(=O)NC[C@@H]1CCCC[N@@H+]1C1CC1)N1CC[NH2+]CC1 ZINC000562825434 482702674 /nfs/dbraw/zinc/70/26/74/482702674.db2.gz HCXPILXWNBVBIX-AWEZNQCLSA-N 2 0 351.451 -1.333 20 0 FAADRP O=C(CNC(=O)C(=O)NC[C@H]1CCCC[N@@H+]1C1CC1)N1CC[NH2+]CC1 ZINC000562825439 482701500 /nfs/dbraw/zinc/70/15/00/482701500.db2.gz HCXPILXWNBVBIX-CQSZACIVSA-N 2 0 351.451 -1.333 20 0 FAADRP O=C(CNC(=O)C(=O)N1CCC[C@H]1C[NH+]1CCCC1)N1CC[NH2+]CC1 ZINC000562831578 482702227 /nfs/dbraw/zinc/70/22/27/482702227.db2.gz AWZPLBYABIFZJN-AWEZNQCLSA-N 2 0 351.451 -1.379 20 0 FAADRP O=C(CNC(=O)C(=O)N1CCC[C@@H]1C[NH+]1CCCC1)N1CC[NH2+]CC1 ZINC000562831579 482701259 /nfs/dbraw/zinc/70/12/59/482701259.db2.gz AWZPLBYABIFZJN-CQSZACIVSA-N 2 0 351.451 -1.379 20 0 FAADRP C[C@@H](CNC(=O)C(=O)NCC(=O)N1CC[NH2+]CC1)[N@@H+]1CCC[C@H](C)C1 ZINC000562831815 482702612 /nfs/dbraw/zinc/70/26/12/482702612.db2.gz YVIAPFLEZCVMFH-KBPBESRZSA-N 2 0 353.467 -1.229 20 0 FAADRP C[C@@H](CNC(=O)C(=O)NCC(=O)N1CC[NH2+]CC1)[N@@H+]1CCC[C@@H](C)C1 ZINC000562831819 482701113 /nfs/dbraw/zinc/70/11/13/482701113.db2.gz YVIAPFLEZCVMFH-KGLIPLIRSA-N 2 0 353.467 -1.229 20 0 FAADRP C[C@H](CNC(=O)C(=O)NCC(=O)N1CC[NH2+]CC1)[N@@H+]1CCC[C@H](C)C1 ZINC000562831821 482701538 /nfs/dbraw/zinc/70/15/38/482701538.db2.gz YVIAPFLEZCVMFH-UONOGXRCSA-N 2 0 353.467 -1.229 20 0 FAADRP C[C@H](CNC(=O)C(=O)NCC(=O)N1CC[NH2+]CC1)[N@@H+]1CCC[C@@H](C)C1 ZINC000562831822 482701463 /nfs/dbraw/zinc/70/14/63/482701463.db2.gz YVIAPFLEZCVMFH-ZIAGYGMSSA-N 2 0 353.467 -1.229 20 0 FAADRP C[NH+]1CCN(C[C@@H](O)C[NH2+]CCN2CCN(c3ncccn3)CC2)CC1 ZINC000562988450 482751042 /nfs/dbraw/zinc/75/10/42/482751042.db2.gz NTWRPAXCGZYTEE-KRWDZBQOSA-N 2 0 363.510 -1.204 20 0 FAADRP C[NH+]1CCN(C[C@H](O)C[NH2+]CCN2CCN(c3ncccn3)CC2)CC1 ZINC000562988451 482751274 /nfs/dbraw/zinc/75/12/74/482751274.db2.gz NTWRPAXCGZYTEE-QGZVFWFLSA-N 2 0 363.510 -1.204 20 0 FAADRP CN1CC[C@H](CNC(=O)C(=O)N(CC[NH+](C)C)CC[NH+](C)C)CC1=O ZINC000563033767 482763895 /nfs/dbraw/zinc/76/38/95/482763895.db2.gz WBYHKRVOWGXMPY-AWEZNQCLSA-N 2 0 355.483 -1.077 20 0 FAADRP CN1CC[C@@H](CNC(=O)C(=O)N(CC[NH+](C)C)CC[NH+](C)C)CC1=O ZINC000563033776 482763511 /nfs/dbraw/zinc/76/35/11/482763511.db2.gz WBYHKRVOWGXMPY-CQSZACIVSA-N 2 0 355.483 -1.077 20 0 FAADRP CN(C)C(=O)CN1CCN(C(=O)C[N@@H+]2CC[C@H](N3CC[NH2+]CC3)C2)CC1 ZINC000563214883 482911546 /nfs/dbraw/zinc/91/15/46/482911546.db2.gz IHZSNZQBYKJTDR-INIZCTEOSA-N 2 0 366.510 -1.802 20 0 FAADRP CN(C)C(=O)CN1CCN(C(=O)C[N@@H+]2CC[C@@H](N3CC[NH2+]CC3)C2)CC1 ZINC000563214888 482911454 /nfs/dbraw/zinc/91/14/54/482911454.db2.gz IHZSNZQBYKJTDR-MRXNPFEDSA-N 2 0 366.510 -1.802 20 0 FAADRP CN1CC[NH2+]C[C@H]1CNC(=O)N1CCN(C(=O)C[NH+]2CCCC2)CC1 ZINC000563522448 482946005 /nfs/dbraw/zinc/94/60/05/482946005.db2.gz CPKXVPYCRPQDOQ-HNNXBMFYSA-N 2 0 352.483 -1.160 20 0 FAADRP CN1CC[NH2+]C[C@@H]1CNC(=O)N1CCN(C(=O)C[NH+]2CCCC2)CC1 ZINC000563522449 482946803 /nfs/dbraw/zinc/94/68/03/482946803.db2.gz CPKXVPYCRPQDOQ-OAHLLOKOSA-N 2 0 352.483 -1.160 20 0 FAADRP CC1CC[NH+](CCNC(=O)C(=O)N2CCN3C(=O)[C@@H]([NH3+])C[C@H]3C2)CC1 ZINC000563548794 482946864 /nfs/dbraw/zinc/94/68/64/482946864.db2.gz MSJAYNVORGMLJC-KBPBESRZSA-N 2 0 351.451 -1.395 20 0 FAADRP CC1CC[NH+](CCNC(=O)C(=O)N2CCN3C(=O)[C@@H]([NH3+])C[C@@H]3C2)CC1 ZINC000563548795 482946227 /nfs/dbraw/zinc/94/62/27/482946227.db2.gz MSJAYNVORGMLJC-KGLIPLIRSA-N 2 0 351.451 -1.395 20 0 FAADRP CC1CC[NH+](CCNC(=O)C(=O)N2CCN3C(=O)[C@H]([NH3+])C[C@H]3C2)CC1 ZINC000563548796 482946029 /nfs/dbraw/zinc/94/60/29/482946029.db2.gz MSJAYNVORGMLJC-UONOGXRCSA-N 2 0 351.451 -1.395 20 0 FAADRP CC1CC[NH+](CCNC(=O)C(=O)N2CCN3C(=O)[C@H]([NH3+])C[C@@H]3C2)CC1 ZINC000563548797 482945816 /nfs/dbraw/zinc/94/58/16/482945816.db2.gz MSJAYNVORGMLJC-ZIAGYGMSSA-N 2 0 351.451 -1.395 20 0 FAADRP C[C@@H](C[N@@H+]1CCC[C@H](C)C1)NC(=O)C(=O)NCC(=O)N1CC[NH2+]CC1 ZINC000564307934 483584547 /nfs/dbraw/zinc/58/45/47/483584547.db2.gz LROHHUPXKSIJER-KBPBESRZSA-N 2 0 353.467 -1.229 20 0 FAADRP C[C@@H](C[N@@H+]1CCC[C@@H](C)C1)NC(=O)C(=O)NCC(=O)N1CC[NH2+]CC1 ZINC000564307948 483584198 /nfs/dbraw/zinc/58/41/98/483584198.db2.gz LROHHUPXKSIJER-KGLIPLIRSA-N 2 0 353.467 -1.229 20 0 FAADRP C[C@H](C[N@@H+]1CCC[C@H](C)C1)NC(=O)C(=O)NCC(=O)N1CC[NH2+]CC1 ZINC000564307949 483583539 /nfs/dbraw/zinc/58/35/39/483583539.db2.gz LROHHUPXKSIJER-UONOGXRCSA-N 2 0 353.467 -1.229 20 0 FAADRP C[C@H](C[N@@H+]1CCC[C@@H](C)C1)NC(=O)C(=O)NCC(=O)N1CC[NH2+]CC1 ZINC000564307950 483583972 /nfs/dbraw/zinc/58/39/72/483583972.db2.gz LROHHUPXKSIJER-ZIAGYGMSSA-N 2 0 353.467 -1.229 20 0 FAADRP CC[NH+]1CCN([C@H]2CCN(C(=O)C(=O)NCCOCC[NH+](C)C)C2)CC1 ZINC000565562432 483637811 /nfs/dbraw/zinc/63/78/11/483637811.db2.gz SXATWRUIFAFDCV-INIZCTEOSA-N 2 0 369.510 -1.081 20 0 FAADRP CC[NH+]1CCN([C@@H]2CCN(C(=O)C(=O)NCCOCC[NH+](C)C)C2)CC1 ZINC000565562433 483637587 /nfs/dbraw/zinc/63/75/87/483637587.db2.gz SXATWRUIFAFDCV-MRXNPFEDSA-N 2 0 369.510 -1.081 20 0 FAADRP C[NH+](C)CCN(CC[NH+](C)C)C(=O)C(=O)N1CC[C@H](N2CC[NH2+]CC2)C1 ZINC000565592602 483639911 /nfs/dbraw/zinc/63/99/11/483639911.db2.gz JPMDFQDLCRCWRH-INIZCTEOSA-N 3 0 368.526 -1.556 20 0 FAADRP C[NH+](C)CCN(CC[NH+](C)C)C(=O)C(=O)N1CC[C@@H](N2CC[NH2+]CC2)C1 ZINC000565592607 483639571 /nfs/dbraw/zinc/63/95/71/483639571.db2.gz JPMDFQDLCRCWRH-MRXNPFEDSA-N 3 0 368.526 -1.556 20 0 FAADRP C[C@H](C[C@H](C)[NH3+])NC(=O)C(=O)N1CCN(C(=O)[C@H]2CCC[N@@H+]2C)CC1 ZINC000565598564 483639800 /nfs/dbraw/zinc/63/98/00/483639800.db2.gz SSBUOZXIEFBPBC-BFHYXJOUSA-N 2 0 353.467 -1.007 20 0 FAADRP C[C@H]([NH3+])C[C@H](C)NC(=O)C(=O)N1CCN(C(=O)[C@@H]2CCC[N@@H+]2C)CC1 ZINC000565598568 483639264 /nfs/dbraw/zinc/63/92/64/483639264.db2.gz SSBUOZXIEFBPBC-IHRRRGAJSA-N 2 0 353.467 -1.007 20 0 FAADRP C[C@H]([NH3+])C[C@H](C)NC(=O)C(=O)N1CCN(C(=O)[C@H]2CCC[N@@H+]2C)CC1 ZINC000565598569 483639285 /nfs/dbraw/zinc/63/92/85/483639285.db2.gz SSBUOZXIEFBPBC-MELADBBJSA-N 2 0 353.467 -1.007 20 0 FAADRP C[C@H](C[C@H](C)[NH3+])NC(=O)C(=O)N1CCN(C(=O)[C@@H]2CCC[N@@H+]2C)CC1 ZINC000565598570 483638934 /nfs/dbraw/zinc/63/89/34/483638934.db2.gz SSBUOZXIEFBPBC-MJBXVCDLSA-N 2 0 353.467 -1.007 20 0 FAADRP CC(=O)NC[C@H]1CN(C(=O)C(=O)N(CC[NH+](C)C)CC[NH+](C)C)CCO1 ZINC000565643121 483639893 /nfs/dbraw/zinc/63/98/93/483639893.db2.gz SHNBGVHKCKBISD-HNNXBMFYSA-N 2 0 371.482 -1.698 20 0 FAADRP CC(=O)NC[C@@H]1CN(C(=O)C(=O)N(CC[NH+](C)C)CC[NH+](C)C)CCO1 ZINC000565643124 483639222 /nfs/dbraw/zinc/63/92/22/483639222.db2.gz SHNBGVHKCKBISD-OAHLLOKOSA-N 2 0 371.482 -1.698 20 0 FAADRP CC(C)C[N@@H+]1CCC[C@@H]1CNC(=O)C(=O)N1CCN2C(=O)[C@@H]([NH3+])C[C@H]2C1 ZINC000565728705 483638954 /nfs/dbraw/zinc/63/89/54/483638954.db2.gz XDJNRCIIJHSLOU-ILXRZTDVSA-N 2 0 365.478 -1.007 20 0 FAADRP CC(C)C[N@@H+]1CCC[C@@H]1CNC(=O)C(=O)N1CCN2C(=O)[C@@H]([NH3+])C[C@@H]2C1 ZINC000565728706 483638994 /nfs/dbraw/zinc/63/89/94/483638994.db2.gz XDJNRCIIJHSLOU-KFWWJZLASA-N 2 0 365.478 -1.007 20 0 FAADRP CC(C)C[N@@H+]1CCC[C@@H]1CNC(=O)C(=O)N1CCN2C(=O)[C@H]([NH3+])C[C@H]2C1 ZINC000565728707 483639494 /nfs/dbraw/zinc/63/94/94/483639494.db2.gz XDJNRCIIJHSLOU-QLFBSQMISA-N 2 0 365.478 -1.007 20 0 FAADRP CC(C)C[N@@H+]1CCC[C@@H]1CNC(=O)C(=O)N1CCN2C(=O)[C@H]([NH3+])C[C@@H]2C1 ZINC000565728708 483639391 /nfs/dbraw/zinc/63/93/91/483639391.db2.gz XDJNRCIIJHSLOU-RBSFLKMASA-N 2 0 365.478 -1.007 20 0 FAADRP C[C@H](CNC(=O)C(=O)N1CCN2C(=O)[C@H]([NH3+])C[C@H]2C1)C[NH+]1CCCC1 ZINC000565844827 483641126 /nfs/dbraw/zinc/64/11/26/483641126.db2.gz BMDWABZOZCYOCY-HZSPNIEDSA-N 2 0 351.451 -1.395 20 0 FAADRP C[C@H](CNC(=O)C(=O)N1CCN2C(=O)[C@@H]([NH3+])C[C@@H]2C1)C[NH+]1CCCC1 ZINC000565844828 483640620 /nfs/dbraw/zinc/64/06/20/483640620.db2.gz BMDWABZOZCYOCY-MCIONIFRSA-N 2 0 351.451 -1.395 20 0 FAADRP C[C@H](CNC(=O)C(=O)N1CCN2C(=O)[C@H]([NH3+])C[C@@H]2C1)C[NH+]1CCCC1 ZINC000565844829 483641352 /nfs/dbraw/zinc/64/13/52/483641352.db2.gz BMDWABZOZCYOCY-MGPQQGTHSA-N 2 0 351.451 -1.395 20 0 FAADRP C[C@H](CNC(=O)C(=O)N1CCN2C(=O)[C@@H]([NH3+])C[C@H]2C1)C[NH+]1CCCC1 ZINC000565844830 483640896 /nfs/dbraw/zinc/64/08/96/483640896.db2.gz BMDWABZOZCYOCY-RDBSUJKOSA-N 2 0 351.451 -1.395 20 0 FAADRP C[C@H]([NH3+])C[C@H](C)NC(=O)C(=O)N1CCN(C(=O)C[NH+]2CCCC2)CC1 ZINC000566237565 483641769 /nfs/dbraw/zinc/64/17/69/483641769.db2.gz QQDCUZBFFREKEU-KBPBESRZSA-N 2 0 353.467 -1.005 20 0 FAADRP C[C@@H]([NH3+])C[C@H](C)NC(=O)C(=O)N1CCN(C(=O)C[NH+]2CCCC2)CC1 ZINC000566237567 483642032 /nfs/dbraw/zinc/64/20/32/483642032.db2.gz QQDCUZBFFREKEU-KGLIPLIRSA-N 2 0 353.467 -1.005 20 0 FAADRP C[C@H](C[C@H](C)[NH3+])NC(=O)C(=O)N1CCN(C(=O)C[NH+]2CCCC2)CC1 ZINC000566237568 483641817 /nfs/dbraw/zinc/64/18/17/483641817.db2.gz QQDCUZBFFREKEU-UONOGXRCSA-N 2 0 353.467 -1.005 20 0 FAADRP C[C@@H]([NH3+])C[C@@H](C)NC(=O)C(=O)N1CCN(C(=O)C[NH+]2CCCC2)CC1 ZINC000566237615 483642203 /nfs/dbraw/zinc/64/22/03/483642203.db2.gz QQDCUZBFFREKEU-ZIAGYGMSSA-N 2 0 353.467 -1.005 20 0 FAADRP [NH3+][C@H]1C[C@@H]2CN(C(=O)C(=O)NC3CC[NH+](CC4CC4)CC3)CCN2C1=O ZINC000566688938 483645528 /nfs/dbraw/zinc/64/55/28/483645528.db2.gz GSSWDTKETNNMCB-CABCVRRESA-N 2 0 363.462 -1.253 20 0 FAADRP [NH3+][C@H]1C[C@H]2CN(C(=O)C(=O)NC3CC[NH+](CC4CC4)CC3)CCN2C1=O ZINC000566688939 483645572 /nfs/dbraw/zinc/64/55/72/483645572.db2.gz GSSWDTKETNNMCB-GJZGRUSLSA-N 2 0 363.462 -1.253 20 0 FAADRP [NH3+][C@@H]1C[C@@H]2CN(C(=O)C(=O)NC3CC[NH+](CC4CC4)CC3)CCN2C1=O ZINC000566688940 483644954 /nfs/dbraw/zinc/64/49/54/483644954.db2.gz GSSWDTKETNNMCB-HUUCEWRRSA-N 2 0 363.462 -1.253 20 0 FAADRP [NH3+][C@@H]1C[C@H]2CN(C(=O)C(=O)NC3CC[NH+](CC4CC4)CC3)CCN2C1=O ZINC000566688942 483645681 /nfs/dbraw/zinc/64/56/81/483645681.db2.gz GSSWDTKETNNMCB-LSDHHAIUSA-N 2 0 363.462 -1.253 20 0 FAADRP COCC(=O)N1CCN(C(=O)C(=O)N(CC[NH+](C)C)CC[NH+](C)C)CC1 ZINC000566724307 483645148 /nfs/dbraw/zinc/64/51/48/483645148.db2.gz PEBKQGMHYJWEPY-UHFFFAOYSA-N 2 0 371.482 -1.745 20 0 FAADRP CC[NH+]1CCN([C@H]2CCN(C(=O)C(=O)NCC[N@H+](C)CCOC)C2)CC1 ZINC000566930958 483646878 /nfs/dbraw/zinc/64/68/78/483646878.db2.gz IYAOTKLUMFOLBU-INIZCTEOSA-N 2 0 369.510 -1.081 20 0 FAADRP CC[NH+]1CCN([C@@H]2CCN(C(=O)C(=O)NCC[N@H+](C)CCOC)C2)CC1 ZINC000566930959 483647037 /nfs/dbraw/zinc/64/70/37/483647037.db2.gz IYAOTKLUMFOLBU-MRXNPFEDSA-N 2 0 369.510 -1.081 20 0 FAADRP COCC[N@H+](C)CCCNC(=O)C(=O)N1CCN2C(=O)[C@H]([NH3+])C[C@@H]2C1 ZINC000567125184 483646370 /nfs/dbraw/zinc/64/63/70/483646370.db2.gz CXBRXQJTJSDUPZ-CHWSQXEVSA-N 2 0 355.439 -2.159 20 0 FAADRP COCC[N@H+](C)CCCNC(=O)C(=O)N1CCN2C(=O)[C@@H]([NH3+])C[C@@H]2C1 ZINC000567125185 483647600 /nfs/dbraw/zinc/64/76/00/483647600.db2.gz CXBRXQJTJSDUPZ-OLZOCXBDSA-N 2 0 355.439 -2.159 20 0 FAADRP COCC[N@H+](C)CCCNC(=O)C(=O)N1CCN2C(=O)[C@H]([NH3+])C[C@H]2C1 ZINC000567125186 483646286 /nfs/dbraw/zinc/64/62/86/483646286.db2.gz CXBRXQJTJSDUPZ-QWHCGFSZSA-N 2 0 355.439 -2.159 20 0 FAADRP COCC[N@H+](C)CCCNC(=O)C(=O)N1CCN2C(=O)[C@@H]([NH3+])C[C@H]2C1 ZINC000567125187 483646159 /nfs/dbraw/zinc/64/61/59/483646159.db2.gz CXBRXQJTJSDUPZ-STQMWFEESA-N 2 0 355.439 -2.159 20 0 FAADRP O=C(CNC(=O)C(=O)N1CC[NH+](C2CCCC2)CC1)N1CC[NH2+]CC1 ZINC000567573876 483650008 /nfs/dbraw/zinc/65/00/08/483650008.db2.gz LMKQWYFINOBLKR-UHFFFAOYSA-N 2 0 351.451 -1.379 20 0 FAADRP CN(C)CC[N@H+](C)CCCN(C)C(=O)C(=O)N1CCN(C)C[C@@H]1C[NH3+] ZINC000567604321 483649924 /nfs/dbraw/zinc/64/99/24/483649924.db2.gz QALKKJDDKUOGOE-HNNXBMFYSA-N 2 0 356.515 -1.570 20 0 FAADRP CN(C)CC[N@H+](C)CCCN(C)C(=O)C(=O)N1CCN(C)C[C@H]1C[NH3+] ZINC000567604322 483649710 /nfs/dbraw/zinc/64/97/10/483649710.db2.gz QALKKJDDKUOGOE-OAHLLOKOSA-N 2 0 356.515 -1.570 20 0 FAADRP C[NH+]1CCN(C[C@@H](O)C[NH2+]CCNS(=O)(=O)c2cccnc2)CC1 ZINC000567687727 483651953 /nfs/dbraw/zinc/65/19/53/483651953.db2.gz AIRDXEBQVNQKJW-AWEZNQCLSA-N 2 0 357.480 -1.442 20 0 FAADRP C[NH+]1CCN(C[C@H](O)C[NH2+]CCNS(=O)(=O)c2cccnc2)CC1 ZINC000567687728 483651167 /nfs/dbraw/zinc/65/11/67/483651167.db2.gz AIRDXEBQVNQKJW-CQSZACIVSA-N 2 0 357.480 -1.442 20 0 FAADRP C[NH+]1CCN(C[C@@H](O)C[NH2+]CCS(=O)(=O)N2CCSCC2)CC1 ZINC000567690820 483651758 /nfs/dbraw/zinc/65/17/58/483651758.db2.gz JUDUNOSGXCWBFQ-AWEZNQCLSA-N 2 0 366.553 -1.437 20 0 FAADRP C[NH+]1CCN(C[C@H](O)C[NH2+]CCS(=O)(=O)N2CCSCC2)CC1 ZINC000567690821 482729603 /nfs/dbraw/zinc/72/96/03/482729603.db2.gz JUDUNOSGXCWBFQ-CQSZACIVSA-N 2 0 366.553 -1.437 20 0 FAADRP CC(C)[C@H]([NH3+])C(=O)NCC(=O)Nc1cccc(S(=O)(=O)NCC[NH3+])c1 ZINC000567883005 483652997 /nfs/dbraw/zinc/65/29/97/483652997.db2.gz IUUJBLNVEFVHOI-AWEZNQCLSA-N 2 0 371.463 -1.038 20 0 FAADRP C[NH+](C)CCN(CC[NH+](C)C)C(=O)C(=O)N1CCN(C2CC2)C(=O)C1 ZINC000568045745 483652870 /nfs/dbraw/zinc/65/28/70/483652870.db2.gz OUUXUYVVLIOMGT-UHFFFAOYSA-N 2 0 353.467 -1.229 20 0 FAADRP [NH3+][C@H]1C[C@H]2CN(C(=O)C(=O)NCc3ccc4c[nH+]cn4c3)CCN2C1=O ZINC000568110089 483654533 /nfs/dbraw/zinc/65/45/33/483654533.db2.gz HLMBXRFPOXEQRZ-KBPBESRZSA-N 2 0 356.386 -1.279 20 0 FAADRP [NH3+][C@H]1C[C@@H]2CN(C(=O)C(=O)NCc3ccc4c[nH+]cn4c3)CCN2C1=O ZINC000568110090 483654193 /nfs/dbraw/zinc/65/41/93/483654193.db2.gz HLMBXRFPOXEQRZ-KGLIPLIRSA-N 2 0 356.386 -1.279 20 0 FAADRP [NH3+][C@@H]1C[C@H]2CN(C(=O)C(=O)NCc3ccc4c[nH+]cn4c3)CCN2C1=O ZINC000568110091 483654308 /nfs/dbraw/zinc/65/43/08/483654308.db2.gz HLMBXRFPOXEQRZ-UONOGXRCSA-N 2 0 356.386 -1.279 20 0 FAADRP [NH3+][C@@H]1C[C@@H]2CN(C(=O)C(=O)NCc3ccc4c[nH+]cn4c3)CCN2C1=O ZINC000568110092 483654282 /nfs/dbraw/zinc/65/42/82/483654282.db2.gz HLMBXRFPOXEQRZ-ZIAGYGMSSA-N 2 0 356.386 -1.279 20 0 FAADRP CC1CC[NH+](CCCNC(=O)C(=O)N2CCN3C(=O)[C@@H]([NH3+])C[C@@H]3C2)CC1 ZINC000568648578 483658996 /nfs/dbraw/zinc/65/89/96/483658996.db2.gz HVDJXUDSBLHEOV-CABCVRRESA-N 2 0 365.478 -1.005 20 0 FAADRP CC1CC[NH+](CCCNC(=O)C(=O)N2CCN3C(=O)[C@@H]([NH3+])C[C@H]3C2)CC1 ZINC000568648580 483659050 /nfs/dbraw/zinc/65/90/50/483659050.db2.gz HVDJXUDSBLHEOV-GJZGRUSLSA-N 2 0 365.478 -1.005 20 0 FAADRP CC1CC[NH+](CCCNC(=O)C(=O)N2CCN3C(=O)[C@H]([NH3+])C[C@@H]3C2)CC1 ZINC000568648581 483659137 /nfs/dbraw/zinc/65/91/37/483659137.db2.gz HVDJXUDSBLHEOV-HUUCEWRRSA-N 2 0 365.478 -1.005 20 0 FAADRP CC1CC[NH+](CCCNC(=O)C(=O)N2CCN3C(=O)[C@H]([NH3+])C[C@H]3C2)CC1 ZINC000568648584 483659096 /nfs/dbraw/zinc/65/90/96/483659096.db2.gz HVDJXUDSBLHEOV-LSDHHAIUSA-N 2 0 365.478 -1.005 20 0 FAADRP CC(C)[NH+]1CCC(NC(=O)C(=O)N2CCN3C(=O)[C@@H]([NH3+])C[C@H]3C2)CC1 ZINC000568783539 483659071 /nfs/dbraw/zinc/65/90/71/483659071.db2.gz WPWLOQBPWSIURI-KBPBESRZSA-N 2 0 351.451 -1.254 20 0 FAADRP CC(C)[NH+]1CCC(NC(=O)C(=O)N2CCN3C(=O)[C@@H]([NH3+])C[C@@H]3C2)CC1 ZINC000568783540 483658791 /nfs/dbraw/zinc/65/87/91/483658791.db2.gz WPWLOQBPWSIURI-KGLIPLIRSA-N 2 0 351.451 -1.254 20 0 FAADRP CC(C)[NH+]1CCC(NC(=O)C(=O)N2CCN3C(=O)[C@H]([NH3+])C[C@H]3C2)CC1 ZINC000568783541 483658108 /nfs/dbraw/zinc/65/81/08/483658108.db2.gz WPWLOQBPWSIURI-UONOGXRCSA-N 2 0 351.451 -1.254 20 0 FAADRP CC(C)[NH+]1CCC(NC(=O)C(=O)N2CCN3C(=O)[C@H]([NH3+])C[C@@H]3C2)CC1 ZINC000568783542 483657939 /nfs/dbraw/zinc/65/79/39/483657939.db2.gz WPWLOQBPWSIURI-ZIAGYGMSSA-N 2 0 351.451 -1.254 20 0 FAADRP C[N@@H+]1CCC[C@H](CCNC(=O)C(=O)N2CCN3C(=O)[C@H]([NH3+])C[C@H]3C2)C1 ZINC000568783555 483658142 /nfs/dbraw/zinc/65/81/42/483658142.db2.gz XLBWBZLQIOOJGC-HZSPNIEDSA-N 2 0 351.451 -1.395 20 0 FAADRP C[N@@H+]1CCC[C@H](CCNC(=O)C(=O)N2CCN3C(=O)[C@@H]([NH3+])C[C@@H]3C2)C1 ZINC000568783556 483658477 /nfs/dbraw/zinc/65/84/77/483658477.db2.gz XLBWBZLQIOOJGC-MCIONIFRSA-N 2 0 351.451 -1.395 20 0 FAADRP C[N@@H+]1CCC[C@H](CCNC(=O)C(=O)N2CCN3C(=O)[C@H]([NH3+])C[C@@H]3C2)C1 ZINC000568783557 483658570 /nfs/dbraw/zinc/65/85/70/483658570.db2.gz XLBWBZLQIOOJGC-MGPQQGTHSA-N 2 0 351.451 -1.395 20 0 FAADRP C[N@@H+]1CCC[C@H](CCNC(=O)C(=O)N2CCN3C(=O)[C@@H]([NH3+])C[C@H]3C2)C1 ZINC000568783558 483658690 /nfs/dbraw/zinc/65/86/90/483658690.db2.gz XLBWBZLQIOOJGC-RDBSUJKOSA-N 2 0 351.451 -1.395 20 0 FAADRP CC(C)[NH+](CCNC(=O)C(=O)N1CCN2C(=O)[C@@H]([NH3+])C[C@H]2C1)C(C)C ZINC000568902640 483660237 /nfs/dbraw/zinc/66/02/37/483660237.db2.gz RXCWXCGHODRNFB-KBPBESRZSA-N 2 0 353.467 -1.008 20 0 FAADRP CC(C)[NH+](CCNC(=O)C(=O)N1CCN2C(=O)[C@@H]([NH3+])C[C@@H]2C1)C(C)C ZINC000568902641 483660139 /nfs/dbraw/zinc/66/01/39/483660139.db2.gz RXCWXCGHODRNFB-KGLIPLIRSA-N 2 0 353.467 -1.008 20 0 FAADRP CC(C)[NH+](CCNC(=O)C(=O)N1CCN2C(=O)[C@H]([NH3+])C[C@H]2C1)C(C)C ZINC000568902642 483659468 /nfs/dbraw/zinc/65/94/68/483659468.db2.gz RXCWXCGHODRNFB-UONOGXRCSA-N 2 0 353.467 -1.008 20 0 FAADRP CC(C)[NH+](CCNC(=O)C(=O)N1CCN2C(=O)[C@H]([NH3+])C[C@@H]2C1)C(C)C ZINC000568902643 483660283 /nfs/dbraw/zinc/66/02/83/483660283.db2.gz RXCWXCGHODRNFB-ZIAGYGMSSA-N 2 0 353.467 -1.008 20 0 FAADRP C[C@@H](CNC(=O)C(=O)NCC(=O)N1CC[NH2+]CC1)[NH+]1CCC(C)CC1 ZINC000568967302 483660436 /nfs/dbraw/zinc/66/04/36/483660436.db2.gz OVOYTEMBCCRADM-AWEZNQCLSA-N 2 0 353.467 -1.229 20 0 FAADRP C[C@H](CNC(=O)C(=O)NCC(=O)N1CC[NH2+]CC1)[NH+]1CCC(C)CC1 ZINC000568967305 483659734 /nfs/dbraw/zinc/65/97/34/483659734.db2.gz OVOYTEMBCCRADM-CQSZACIVSA-N 2 0 353.467 -1.229 20 0 FAADRP [NH3+][C@H]1C[C@@H]2CN(C(=O)C(=O)NC3CC([NH+]4CCCCC4)C3)CCN2C1=O ZINC000569003349 483660099 /nfs/dbraw/zinc/66/00/99/483660099.db2.gz MZHYWPCKKSEOFE-CVSAEHQPSA-N 2 0 363.462 -1.110 20 0 FAADRP [NH3+][C@@H]1C[C@@H]2CN(C(=O)C(=O)NC3CC([NH+]4CCCCC4)C3)CCN2C1=O ZINC000569003351 483659837 /nfs/dbraw/zinc/65/98/37/483659837.db2.gz MZHYWPCKKSEOFE-NEXFUWMNSA-N 2 0 363.462 -1.110 20 0 FAADRP [NH3+][C@@H]1C[C@H]2CN(C(=O)C(=O)NC3CC([NH+]4CCCCC4)C3)CCN2C1=O ZINC000569003353 483660033 /nfs/dbraw/zinc/66/00/33/483660033.db2.gz MZHYWPCKKSEOFE-PFSRBDOWSA-N 2 0 363.462 -1.110 20 0 FAADRP [NH3+][C@H]1C[C@H]2CN(C(=O)C(=O)NC3CC([NH+]4CCCCC4)C3)CCN2C1=O ZINC000569003356 483659708 /nfs/dbraw/zinc/65/97/08/483659708.db2.gz MZHYWPCKKSEOFE-WUCCLRPBSA-N 2 0 363.462 -1.110 20 0 FAADRP C[C@H](O)CN1CCN(C(=O)C(=O)N(CC[NH+](C)C)CC[NH+](C)C)CC1 ZINC000569197725 483660381 /nfs/dbraw/zinc/66/03/81/483660381.db2.gz GIFNCHIRRVFWQW-HNNXBMFYSA-N 2 0 357.499 -1.537 20 0 FAADRP [NH3+][C@@H]1C[C@H]2CN(C(=O)C(=O)N[C@H]3CC[N@@H+](C4CCCC4)C3)CCN2C1=O ZINC000569238105 483661011 /nfs/dbraw/zinc/66/10/11/483661011.db2.gz OWHVATUWWDFCMY-AEGPPILISA-N 2 0 363.462 -1.110 20 0 FAADRP [NH3+][C@@H]1C[C@@H]2CN(C(=O)C(=O)N[C@@H]3CC[N@@H+](C4CCCC4)C3)CCN2C1=O ZINC000569238110 483661325 /nfs/dbraw/zinc/66/13/25/483661325.db2.gz OWHVATUWWDFCMY-BPLDGKMQSA-N 2 0 363.462 -1.110 20 0 FAADRP [NH3+][C@@H]1C[C@@H]2CN(C(=O)C(=O)N[C@H]3CC[N@@H+](C4CCCC4)C3)CCN2C1=O ZINC000569238111 483661529 /nfs/dbraw/zinc/66/15/29/483661529.db2.gz OWHVATUWWDFCMY-NWANDNLSSA-N 2 0 363.462 -1.110 20 0 FAADRP [NH3+][C@@H]1C[C@H]2CN(C(=O)C(=O)N[C@@H]3CC[N@@H+](C4CCCC4)C3)CCN2C1=O ZINC000569238113 483661113 /nfs/dbraw/zinc/66/11/13/483661113.db2.gz OWHVATUWWDFCMY-VHDGCEQUSA-N 2 0 363.462 -1.110 20 0 FAADRP O=C(CNC(=O)N1CCN(C(=O)C[NH+]2CCCC2)CC1)N1CC[NH2+]CC1 ZINC000569334794 482586528 /nfs/dbraw/zinc/58/65/28/482586528.db2.gz FUMDLTYHWSLWFN-UHFFFAOYSA-N 2 0 366.466 -1.632 20 0 FAADRP CN1CC[NH2+]C[C@@H]1CNC(=O)N1CCN(C(=O)[C@@H]2CCC[N@@H+]2C)CC1 ZINC000569335734 482588329 /nfs/dbraw/zinc/58/83/29/482588329.db2.gz OVSHXIALSOGNGF-CABCVRRESA-N 2 0 352.483 -1.162 20 0 FAADRP CN1CC[NH2+]C[C@H]1CNC(=O)N1CCN(C(=O)[C@@H]2CCC[N@@H+]2C)CC1 ZINC000569335735 482587681 /nfs/dbraw/zinc/58/76/81/482587681.db2.gz OVSHXIALSOGNGF-GJZGRUSLSA-N 2 0 352.483 -1.162 20 0 FAADRP CN1CC[NH2+]C[C@@H]1CNC(=O)N1CCN(C(=O)[C@H]2CCC[N@@H+]2C)CC1 ZINC000569335736 482587661 /nfs/dbraw/zinc/58/76/61/482587661.db2.gz OVSHXIALSOGNGF-HUUCEWRRSA-N 2 0 352.483 -1.162 20 0 FAADRP CN1CC[NH2+]C[C@H]1CNC(=O)N1CCN(C(=O)[C@H]2CCC[N@@H+]2C)CC1 ZINC000569335737 482588270 /nfs/dbraw/zinc/58/82/70/482588270.db2.gz OVSHXIALSOGNGF-LSDHHAIUSA-N 2 0 352.483 -1.162 20 0 FAADRP C[C@H](CNC(=O)C(=O)N1CCN2C(=O)[C@@H]([NH3+])C[C@H]2C1)[NH+]1CCC(C)CC1 ZINC000569356937 482626641 /nfs/dbraw/zinc/62/66/41/482626641.db2.gz QRUIOOZEDPSKAY-ILXRZTDVSA-N 2 0 365.478 -1.007 20 0 FAADRP C[C@H](CNC(=O)C(=O)N1CCN2C(=O)[C@@H]([NH3+])C[C@@H]2C1)[NH+]1CCC(C)CC1 ZINC000569356938 482627059 /nfs/dbraw/zinc/62/70/59/482627059.db2.gz QRUIOOZEDPSKAY-KFWWJZLASA-N 2 0 365.478 -1.007 20 0 FAADRP C[C@H](CNC(=O)C(=O)N1CCN2C(=O)[C@H]([NH3+])C[C@H]2C1)[NH+]1CCC(C)CC1 ZINC000569356939 482627109 /nfs/dbraw/zinc/62/71/09/482627109.db2.gz QRUIOOZEDPSKAY-QLFBSQMISA-N 2 0 365.478 -1.007 20 0 FAADRP C[C@H](CNC(=O)C(=O)N1CCN2C(=O)[C@H]([NH3+])C[C@@H]2C1)[NH+]1CCC(C)CC1 ZINC000569356940 482626447 /nfs/dbraw/zinc/62/64/47/482626447.db2.gz QRUIOOZEDPSKAY-RBSFLKMASA-N 2 0 365.478 -1.007 20 0 FAADRP CS(=O)(=O)N1CCN(S(=O)(=O)N(CCC[NH3+])CCC[NH3+])CC1 ZINC000569592175 482646411 /nfs/dbraw/zinc/64/64/11/482646411.db2.gz VDAVJHXFGQQQFD-UHFFFAOYSA-N 2 0 357.502 -2.192 20 0 FAADRP C[N@H+](CCNC(=O)C(=O)N1CCN2C(=O)[C@@H]([NH3+])C[C@H]2C1)C1CCCC1 ZINC000569625275 482685451 /nfs/dbraw/zinc/68/54/51/482685451.db2.gz OSYAQDXOESCWIV-KBPBESRZSA-N 2 0 351.451 -1.253 20 0 FAADRP C[N@H+](CCNC(=O)C(=O)N1CCN2C(=O)[C@@H]([NH3+])C[C@@H]2C1)C1CCCC1 ZINC000569625279 482686596 /nfs/dbraw/zinc/68/65/96/482686596.db2.gz OSYAQDXOESCWIV-KGLIPLIRSA-N 2 0 351.451 -1.253 20 0 FAADRP C[N@H+](CCNC(=O)C(=O)N1CCN2C(=O)[C@H]([NH3+])C[C@H]2C1)C1CCCC1 ZINC000569625280 482686287 /nfs/dbraw/zinc/68/62/87/482686287.db2.gz OSYAQDXOESCWIV-UONOGXRCSA-N 2 0 351.451 -1.253 20 0 FAADRP C[N@H+](CCNC(=O)C(=O)N1CCN2C(=O)[C@H]([NH3+])C[C@@H]2C1)C1CCCC1 ZINC000569625281 482687057 /nfs/dbraw/zinc/68/70/57/482687057.db2.gz OSYAQDXOESCWIV-ZIAGYGMSSA-N 2 0 351.451 -1.253 20 0 FAADRP CN1CCN(C(=O)C(=O)N2CC[NH+](CC3CCOCC3)CC2)[C@@H](C[NH3+])C1 ZINC000570153902 482719063 /nfs/dbraw/zinc/71/90/63/482719063.db2.gz KGTVYEUGNCTYNW-INIZCTEOSA-N 2 0 367.494 -1.342 20 0 FAADRP CN1CCN(C(=O)C(=O)N2CC[NH+](CC3CCOCC3)CC2)[C@H](C[NH3+])C1 ZINC000570153905 482718716 /nfs/dbraw/zinc/71/87/16/482718716.db2.gz KGTVYEUGNCTYNW-MRXNPFEDSA-N 2 0 367.494 -1.342 20 0 FAADRP C[NH+](C[C@@H](O)CN1CCN(C[C@H](O)C[N@@H+](C)C2CC2)CC(O)C1)C1CC1 ZINC000570367081 482720083 /nfs/dbraw/zinc/72/00/83/482720083.db2.gz MCRYDEHJUMMVOZ-QZTJIDSGSA-N 2 0 370.538 -1.125 20 0 FAADRP C[NH+](C[C@H](O)CN1CCN(C[C@H](O)C[N@@H+](C)C2CC2)C[C@@H](O)C1)C1CC1 ZINC000570367082 482720144 /nfs/dbraw/zinc/72/01/44/482720144.db2.gz MCRYDEHJUMMVOZ-REPLKXPHSA-N 2 0 370.538 -1.125 20 0 FAADRP C[NH+](C[C@H](O)CN1CCN(C[C@@H](O)C[N@@H+](C)C2CC2)CC(O)C1)C1CC1 ZINC000570367083 482720504 /nfs/dbraw/zinc/72/05/04/482720504.db2.gz MCRYDEHJUMMVOZ-ROUUACIJSA-N 2 0 370.538 -1.125 20 0 FAADRP C[C@H]1CCC[C@H](C)[NH+]1CCNC(=O)C(=O)NCC(=O)N1CC[NH2+]CC1 ZINC000570429483 482721730 /nfs/dbraw/zinc/72/17/30/482721730.db2.gz KBORIERLJSVWDJ-KBPBESRZSA-N 2 0 353.467 -1.087 20 0 FAADRP C[C@@H]1CCC[C@H](C)[N@H+]1CCNC(=O)C(=O)NCC(=O)N1CC[NH2+]CC1 ZINC000570429486 482721605 /nfs/dbraw/zinc/72/16/05/482721605.db2.gz KBORIERLJSVWDJ-OKILXGFUSA-N 2 0 353.467 -1.087 20 0 FAADRP C[C@@H]1CCC[C@@H](C)[NH+]1CCNC(=O)C(=O)NCC(=O)N1CC[NH2+]CC1 ZINC000570429488 482721898 /nfs/dbraw/zinc/72/18/98/482721898.db2.gz KBORIERLJSVWDJ-ZIAGYGMSSA-N 2 0 353.467 -1.087 20 0 FAADRP [NH3+][C@H]1C[C@H]2CN(C(=O)C(=O)NCCC[NH+]3CCCCC3)CCN2C1=O ZINC000570583812 482723502 /nfs/dbraw/zinc/72/35/02/482723502.db2.gz LMRGFKDQBGOYSL-KBPBESRZSA-N 2 0 351.451 -1.251 20 0 FAADRP [NH3+][C@H]1C[C@@H]2CN(C(=O)C(=O)NCCC[NH+]3CCCCC3)CCN2C1=O ZINC000570583813 482723851 /nfs/dbraw/zinc/72/38/51/482723851.db2.gz LMRGFKDQBGOYSL-KGLIPLIRSA-N 2 0 351.451 -1.251 20 0 FAADRP [NH3+][C@@H]1C[C@H]2CN(C(=O)C(=O)NCCC[NH+]3CCCCC3)CCN2C1=O ZINC000570583814 482723619 /nfs/dbraw/zinc/72/36/19/482723619.db2.gz LMRGFKDQBGOYSL-UONOGXRCSA-N 2 0 351.451 -1.251 20 0 FAADRP [NH3+][C@@H]1C[C@@H]2CN(C(=O)C(=O)NCCC[NH+]3CCCCC3)CCN2C1=O ZINC000570583815 482723665 /nfs/dbraw/zinc/72/36/65/482723665.db2.gz LMRGFKDQBGOYSL-ZIAGYGMSSA-N 2 0 351.451 -1.251 20 0 FAADRP C[N@H+](CCCCNC(=O)C(=O)N1CCN2C(=O)[C@@H]([NH3+])C[C@H]2C1)C1CC1 ZINC000570865869 482729963 /nfs/dbraw/zinc/72/99/63/482729963.db2.gz DCRYHZAQLTYMMK-KBPBESRZSA-N 2 0 351.451 -1.253 20 0 FAADRP C[N@H+](CCCCNC(=O)C(=O)N1CCN2C(=O)[C@@H]([NH3+])C[C@@H]2C1)C1CC1 ZINC000570865871 482729292 /nfs/dbraw/zinc/72/92/92/482729292.db2.gz DCRYHZAQLTYMMK-KGLIPLIRSA-N 2 0 351.451 -1.253 20 0 FAADRP C[N@H+](CCCCNC(=O)C(=O)N1CCN2C(=O)[C@H]([NH3+])C[C@H]2C1)C1CC1 ZINC000570865872 482729729 /nfs/dbraw/zinc/72/97/29/482729729.db2.gz DCRYHZAQLTYMMK-UONOGXRCSA-N 2 0 351.451 -1.253 20 0 FAADRP C[N@H+](CCCCNC(=O)C(=O)N1CCN2C(=O)[C@H]([NH3+])C[C@@H]2C1)C1CC1 ZINC000570865873 482729952 /nfs/dbraw/zinc/72/99/52/482729952.db2.gz DCRYHZAQLTYMMK-ZIAGYGMSSA-N 2 0 351.451 -1.253 20 0 FAADRP CC[NH2+]CCCNC(=O)C(=O)N1CCN(C(=O)[C@@H]2CCC[N@@H+]2C)CC1 ZINC000570912825 482731485 /nfs/dbraw/zinc/73/14/85/482731485.db2.gz HIEVVNPDWAUIEW-AWEZNQCLSA-N 2 0 353.467 -1.133 20 0 FAADRP CC[NH2+]CCCNC(=O)C(=O)N1CCN(C(=O)[C@H]2CCC[N@@H+]2C)CC1 ZINC000570912826 482731250 /nfs/dbraw/zinc/73/12/50/482731250.db2.gz HIEVVNPDWAUIEW-CQSZACIVSA-N 2 0 353.467 -1.133 20 0 FAADRP CN(CCN1CCOCC1)C(=O)C(=O)N(CC[NH+](C)C)CC[NH+](C)C ZINC000570927576 482730532 /nfs/dbraw/zinc/73/05/32/482730532.db2.gz HZEPJBMDBYJIFP-UHFFFAOYSA-N 2 0 357.499 -1.271 20 0 FAADRP [NH3+]C[C@@H]1CCCN1C(=O)C(=O)N1CCN(C(=O)C[NH+]2CCCC2)CC1 ZINC000570954275 482779168 /nfs/dbraw/zinc/77/91/68/482779168.db2.gz RRMOMAJWDZNSFI-AWEZNQCLSA-N 2 0 351.451 -1.297 20 0 FAADRP [NH3+]C[C@H]1CCCN1C(=O)C(=O)N1CCN(C(=O)C[NH+]2CCCC2)CC1 ZINC000570954276 482779885 /nfs/dbraw/zinc/77/98/85/482779885.db2.gz RRMOMAJWDZNSFI-CQSZACIVSA-N 2 0 351.451 -1.297 20 0 FAADRP C[NH+](C)CCN(CC[NH+](C)C)C(=O)C(=O)NCc1cc(C(N)=O)no1 ZINC000571114709 482955307 /nfs/dbraw/zinc/95/53/07/482955307.db2.gz BQOIFCGORIDEKK-UHFFFAOYSA-N 2 0 354.411 -1.659 20 0 FAADRP C[N@@H+]1CCC[C@@H]1C(=O)N1CCN(C(=O)C(=O)N2C[C@H]3C[NH2+]C[C@H]3C2)CC1 ZINC000571395079 482960451 /nfs/dbraw/zinc/96/04/51/482960451.db2.gz WQCFVNLJVQHDIM-QLFBSQMISA-N 2 0 363.462 -1.571 20 0 FAADRP C[N@@H+]1CCC[C@H]1C(=O)N1CCN(C(=O)C(=O)N2C[C@H]3C[NH2+]C[C@H]3C2)CC1 ZINC000571395080 482960396 /nfs/dbraw/zinc/96/03/96/482960396.db2.gz WQCFVNLJVQHDIM-ZNMIVQPWSA-N 2 0 363.462 -1.571 20 0 FAADRP [NH3+]CCNS(=O)(=O)c1cccc(NC(=O)CNC(=O)[C@H]2CCC[NH2+]2)c1 ZINC000571681293 483197823 /nfs/dbraw/zinc/19/78/23/483197823.db2.gz LJTCGOSUZJUWST-CYBMUJFWSA-N 2 0 369.447 -1.270 20 0 FAADRP [NH3+]CCNS(=O)(=O)c1cccc(NC(=O)CNC(=O)[C@@H]2CCC[NH2+]2)c1 ZINC000571681294 483197545 /nfs/dbraw/zinc/19/75/45/483197545.db2.gz LJTCGOSUZJUWST-ZDUSSCGKSA-N 2 0 369.447 -1.270 20 0 FAADRP C[NH+](C)CCN(CC[NH+](C)C)C(=O)C(=O)N1CCN([C@H]2CC[NH2+]C2)CC1 ZINC000572111830 483305678 /nfs/dbraw/zinc/30/56/78/483305678.db2.gz YADUGSAOATUOCD-INIZCTEOSA-N 3 0 368.526 -1.556 20 0 FAADRP C[NH+](C)CCN(CC[NH+](C)C)C(=O)C(=O)N1CCN([C@@H]2CC[NH2+]C2)CC1 ZINC000572111831 483305463 /nfs/dbraw/zinc/30/54/63/483305463.db2.gz YADUGSAOATUOCD-MRXNPFEDSA-N 3 0 368.526 -1.556 20 0 FAADRP CN1CCN(C(=O)C(=O)NCC2([NH+]3CCCC3)CCOCC2)[C@@H](C[NH3+])C1 ZINC000572228106 483306432 /nfs/dbraw/zinc/30/64/32/483306432.db2.gz JCUDFADBOZAOJT-HNNXBMFYSA-N 2 0 367.494 -1.151 20 0 FAADRP CN1CCN(C(=O)C(=O)NCC2([NH+]3CCCC3)CCOCC2)[C@H](C[NH3+])C1 ZINC000572228107 483307043 /nfs/dbraw/zinc/30/70/43/483307043.db2.gz JCUDFADBOZAOJT-OAHLLOKOSA-N 2 0 367.494 -1.151 20 0 FAADRP CN1CCN(C(=O)C(=O)N2CCC[C@@H](C[NH+]3CCOCC3)C2)[C@@H](C[NH3+])C1 ZINC000572272721 483306755 /nfs/dbraw/zinc/30/67/55/483306755.db2.gz TZAFSCMYVCQPFW-HOTGVXAUSA-N 2 0 367.494 -1.342 20 0 FAADRP CN1CCN(C(=O)C(=O)N2CCC[C@@H](C[NH+]3CCOCC3)C2)[C@H](C[NH3+])C1 ZINC000572272722 483307176 /nfs/dbraw/zinc/30/71/76/483307176.db2.gz TZAFSCMYVCQPFW-JKSUJKDBSA-N 2 0 367.494 -1.342 20 0 FAADRP O=C(CNC(=O)[C@H]1CCC[NH2+]1)NC[C@@H](N1CC[NH2+]CC1)C(F)(F)F ZINC000572361897 483309439 /nfs/dbraw/zinc/30/94/39/483309439.db2.gz HXAOMDRLACUSRM-GHMZBOCLSA-N 2 0 351.373 -1.193 20 0 FAADRP O=C(CNC(=O)[C@H]1CCC[NH2+]1)NC[C@H](N1CC[NH2+]CC1)C(F)(F)F ZINC000572361898 483310280 /nfs/dbraw/zinc/31/02/80/483310280.db2.gz HXAOMDRLACUSRM-MNOVXSKESA-N 2 0 351.373 -1.193 20 0 FAADRP O=C(CNC(=O)[C@@H]1CCC[NH2+]1)NC[C@H](N1CC[NH2+]CC1)C(F)(F)F ZINC000572361899 483309284 /nfs/dbraw/zinc/30/92/84/483309284.db2.gz HXAOMDRLACUSRM-QWRGUYRKSA-N 2 0 351.373 -1.193 20 0 FAADRP O=C(CNC(=O)[C@@H]1CCC[NH2+]1)NC[C@@H](N1CC[NH2+]CC1)C(F)(F)F ZINC000572361900 483309780 /nfs/dbraw/zinc/30/97/80/483309780.db2.gz HXAOMDRLACUSRM-WDEREUQCSA-N 2 0 351.373 -1.193 20 0 FAADRP C[N@@H+]1CCC[C@H]1C(=O)N1CCN(C(=O)C(=O)NC[C@@H]2CCC[NH2+]2)CC1 ZINC000572945507 483662462 /nfs/dbraw/zinc/66/24/62/483662462.db2.gz XUNQCKWBAFPLBB-KBPBESRZSA-N 2 0 351.451 -1.380 20 0 FAADRP C[N@@H+]1CCC[C@H]1C(=O)N1CCN(C(=O)C(=O)NC[C@H]2CCC[NH2+]2)CC1 ZINC000572945508 483662129 /nfs/dbraw/zinc/66/21/29/483662129.db2.gz XUNQCKWBAFPLBB-KGLIPLIRSA-N 2 0 351.451 -1.380 20 0 FAADRP C[N@@H+]1CCC[C@@H]1C(=O)N1CCN(C(=O)C(=O)NC[C@@H]2CCC[NH2+]2)CC1 ZINC000572945509 483662386 /nfs/dbraw/zinc/66/23/86/483662386.db2.gz XUNQCKWBAFPLBB-UONOGXRCSA-N 2 0 351.451 -1.380 20 0 FAADRP C[N@@H+]1CCC[C@@H]1C(=O)N1CCN(C(=O)C(=O)NC[C@H]2CCC[NH2+]2)CC1 ZINC000572945510 483662315 /nfs/dbraw/zinc/66/23/15/483662315.db2.gz XUNQCKWBAFPLBB-ZIAGYGMSSA-N 2 0 351.451 -1.380 20 0 FAADRP CN(C(=O)C(=O)N1CCN(C(=O)C[NH+]2CCCC2)CC1)[C@H]1C[NH2+]C[C@@H]1O ZINC000572990637 483662156 /nfs/dbraw/zinc/66/21/56/483662156.db2.gz SPMVUTDAWHFBCN-KBPBESRZSA-N 2 0 367.450 -2.456 20 0 FAADRP CC(C)Nc1nc(NCC2([NH+](C)C)CCOCC2)nc(NCCO)[nH+]1 ZINC000573032867 483662398 /nfs/dbraw/zinc/66/23/98/483662398.db2.gz DZKDFKRDWFOGEL-UHFFFAOYSA-N 2 0 353.471 -1.116 20 0 FAADRP C[N@@H+]1CCN(CCNC(=O)N2CCN3C(=O)[C@@H]([NH3+])C[C@H]3C2)CC1(C)C ZINC000573140939 483662810 /nfs/dbraw/zinc/66/28/10/483662810.db2.gz LGYHQQPWDLUMRI-KBPBESRZSA-N 2 0 352.483 -1.034 20 0 FAADRP C[N@@H+]1CCN(CCNC(=O)N2CCN3C(=O)[C@@H]([NH3+])C[C@@H]3C2)CC1(C)C ZINC000573140940 483662903 /nfs/dbraw/zinc/66/29/03/483662903.db2.gz LGYHQQPWDLUMRI-KGLIPLIRSA-N 2 0 352.483 -1.034 20 0 FAADRP C[N@@H+]1CCN(CCNC(=O)N2CCN3C(=O)[C@H]([NH3+])C[C@H]3C2)CC1(C)C ZINC000573140941 483663195 /nfs/dbraw/zinc/66/31/95/483663195.db2.gz LGYHQQPWDLUMRI-UONOGXRCSA-N 2 0 352.483 -1.034 20 0 FAADRP C[N@@H+]1CCN(CCNC(=O)N2CCN3C(=O)[C@H]([NH3+])C[C@@H]3C2)CC1(C)C ZINC000573140942 483663160 /nfs/dbraw/zinc/66/31/60/483663160.db2.gz LGYHQQPWDLUMRI-ZIAGYGMSSA-N 2 0 352.483 -1.034 20 0 FAADRP COCCN1CCN(C(=O)C(=O)N(CC[NH+](C)C)CC[NH+](C)C)CC1 ZINC000573303114 483662822 /nfs/dbraw/zinc/66/28/22/483662822.db2.gz TYFATAPKLXPNMQ-UHFFFAOYSA-N 2 0 357.499 -1.271 20 0 FAADRP C[NH+](C)C1(CNC(=O)C(=O)NCC(=O)N2CC[NH2+]CC2)CCCCC1 ZINC000573668792 483664575 /nfs/dbraw/zinc/66/45/75/483664575.db2.gz CTMZHZDMJMINBQ-UHFFFAOYSA-N 2 0 353.467 -1.085 20 0 FAADRP COCC[N@@H+]1CC[C@H](NC(=O)C(=O)N2CCN(CC(C)(C)O)CC2)C1 ZINC000573670435 483664672 /nfs/dbraw/zinc/66/46/72/483664672.db2.gz AAEIWINKSFRFRQ-AWEZNQCLSA-N 2 0 356.467 -1.262 20 0 FAADRP COCC[N@@H+]1CC[C@@H](NC(=O)C(=O)N2CCN(CC(C)(C)O)CC2)C1 ZINC000573670436 483664718 /nfs/dbraw/zinc/66/47/18/483664718.db2.gz AAEIWINKSFRFRQ-CQSZACIVSA-N 2 0 356.467 -1.262 20 0 FAADRP CC(C)C[NH+]1CCC(NC(=O)C(=O)N2CCN3C(=O)[C@@H]([NH3+])C[C@@H]3C2)CC1 ZINC000573982709 483665093 /nfs/dbraw/zinc/66/50/93/483665093.db2.gz CUQSBZYXMTWGAS-CABCVRRESA-N 2 0 365.478 -1.007 20 0 FAADRP CC(C)C[NH+]1CCC(NC(=O)C(=O)N2CCN3C(=O)[C@@H]([NH3+])C[C@H]3C2)CC1 ZINC000573982710 483665190 /nfs/dbraw/zinc/66/51/90/483665190.db2.gz CUQSBZYXMTWGAS-GJZGRUSLSA-N 2 0 365.478 -1.007 20 0 FAADRP CC(C)C[NH+]1CCC(NC(=O)C(=O)N2CCN3C(=O)[C@H]([NH3+])C[C@@H]3C2)CC1 ZINC000573982711 483665166 /nfs/dbraw/zinc/66/51/66/483665166.db2.gz CUQSBZYXMTWGAS-HUUCEWRRSA-N 2 0 365.478 -1.007 20 0 FAADRP CC(C)C[NH+]1CCC(NC(=O)C(=O)N2CCN3C(=O)[C@H]([NH3+])C[C@H]3C2)CC1 ZINC000573982712 483665318 /nfs/dbraw/zinc/66/53/18/483665318.db2.gz CUQSBZYXMTWGAS-LSDHHAIUSA-N 2 0 365.478 -1.007 20 0 FAADRP C[N@@H+]1CCCC(C)(C)[C@@H]1CNC(=O)C(=O)N1CCN2C(=O)[C@@H]([NH3+])C[C@H]2C1 ZINC000574340878 483666143 /nfs/dbraw/zinc/66/61/43/483666143.db2.gz ZKTMZUKXBDSDFR-IHRRRGAJSA-N 2 0 365.478 -1.007 20 0 FAADRP C[N@@H+]1CCCC(C)(C)[C@@H]1CNC(=O)C(=O)N1CCN2C(=O)[C@H]([NH3+])C[C@@H]2C1 ZINC000574340879 483665855 /nfs/dbraw/zinc/66/58/55/483665855.db2.gz ZKTMZUKXBDSDFR-MCIONIFRSA-N 2 0 365.478 -1.007 20 0 FAADRP C[N@@H+]1CCCC(C)(C)[C@@H]1CNC(=O)C(=O)N1CCN2C(=O)[C@H]([NH3+])C[C@H]2C1 ZINC000574340880 483665863 /nfs/dbraw/zinc/66/58/63/483665863.db2.gz ZKTMZUKXBDSDFR-MJBXVCDLSA-N 2 0 365.478 -1.007 20 0 FAADRP C[N@@H+]1CCCC(C)(C)[C@@H]1CNC(=O)C(=O)N1CCN2C(=O)[C@@H]([NH3+])C[C@@H]2C1 ZINC000574340881 483665776 /nfs/dbraw/zinc/66/57/76/483665776.db2.gz ZKTMZUKXBDSDFR-RDBSUJKOSA-N 2 0 365.478 -1.007 20 0 FAADRP C[NH+](C)CCN(CC[NH+](C)C)C(=O)C(=O)N1CCO[C@@]2(CCOC2)C1 ZINC000574499002 483666643 /nfs/dbraw/zinc/66/66/43/483666643.db2.gz QTKWPTVZRMELAD-KRWDZBQOSA-N 2 0 356.467 -1.044 20 0 FAADRP C[NH+](C)CCN(CC[NH+](C)C)C(=O)C(=O)N1CCO[C@]2(CCOC2)C1 ZINC000574499003 483666761 /nfs/dbraw/zinc/66/67/61/483666761.db2.gz QTKWPTVZRMELAD-QGZVFWFLSA-N 2 0 356.467 -1.044 20 0 FAADRP C[C@H]1CN(C(=O)C(=O)N2CCN(C(=O)C[NH+]3CCCC3)CC2)C[C@@H]1[NH3+] ZINC000574510986 483666780 /nfs/dbraw/zinc/66/67/80/483666780.db2.gz LCEKUIBLYLNSSZ-KBPBESRZSA-N 2 0 351.451 -1.441 20 0 FAADRP C[C@@H]1CN(C(=O)C(=O)N2CCN(C(=O)C[NH+]3CCCC3)CC2)C[C@@H]1[NH3+] ZINC000574510987 483667007 /nfs/dbraw/zinc/66/70/07/483667007.db2.gz LCEKUIBLYLNSSZ-KGLIPLIRSA-N 2 0 351.451 -1.441 20 0 FAADRP C[C@H]1CN(C(=O)C(=O)N2CCN(C(=O)C[NH+]3CCCC3)CC2)C[C@H]1[NH3+] ZINC000574510988 483666978 /nfs/dbraw/zinc/66/69/78/483666978.db2.gz LCEKUIBLYLNSSZ-UONOGXRCSA-N 2 0 351.451 -1.441 20 0 FAADRP C[C@@H]1CN(C(=O)C(=O)N2CCN(C(=O)C[NH+]3CCCC3)CC2)C[C@H]1[NH3+] ZINC000574510989 483666866 /nfs/dbraw/zinc/66/68/66/483666866.db2.gz LCEKUIBLYLNSSZ-ZIAGYGMSSA-N 2 0 351.451 -1.441 20 0 FAADRP O=C(CNC(=O)[C@@H]1CCC[NH2+]1)N1CCN(C(=O)C[NH+]2CCCC2)CC1 ZINC000574514740 483667016 /nfs/dbraw/zinc/66/70/16/483667016.db2.gz CGFDEKTZNDACCB-AWEZNQCLSA-N 2 0 351.451 -1.379 20 0 FAADRP O=C(CNC(=O)[C@H]1CCC[NH2+]1)N1CCN(C(=O)C[NH+]2CCCC2)CC1 ZINC000574514743 483667045 /nfs/dbraw/zinc/66/70/45/483667045.db2.gz CGFDEKTZNDACCB-CQSZACIVSA-N 2 0 351.451 -1.379 20 0 FAADRP C[NH+](C)CC1(CNC(=O)C(=O)N2CCN3C(=O)[C@@H]([NH3+])C[C@H]3C2)CCCC1 ZINC000574533181 483666561 /nfs/dbraw/zinc/66/65/61/483666561.db2.gz DSJIRAZGJMGZOJ-KBPBESRZSA-N 2 0 365.478 -1.005 20 0 FAADRP C[NH+](C)CC1(CNC(=O)C(=O)N2CCN3C(=O)[C@@H]([NH3+])C[C@@H]3C2)CCCC1 ZINC000574533184 483666597 /nfs/dbraw/zinc/66/65/97/483666597.db2.gz DSJIRAZGJMGZOJ-KGLIPLIRSA-N 2 0 365.478 -1.005 20 0 FAADRP C[NH+](C)CC1(CNC(=O)C(=O)N2CCN3C(=O)[C@H]([NH3+])C[C@H]3C2)CCCC1 ZINC000574533185 483666740 /nfs/dbraw/zinc/66/67/40/483666740.db2.gz DSJIRAZGJMGZOJ-UONOGXRCSA-N 2 0 365.478 -1.005 20 0 FAADRP C[NH+](C)CC1(CNC(=O)C(=O)N2CCN3C(=O)[C@H]([NH3+])C[C@@H]3C2)CCCC1 ZINC000574533186 483666823 /nfs/dbraw/zinc/66/68/23/483666823.db2.gz DSJIRAZGJMGZOJ-ZIAGYGMSSA-N 2 0 365.478 -1.005 20 0 FAADRP C[NH+](C)[C@@H]1CCC[C@H](NC(=O)C(=O)N2CCN3C(=O)[C@@H]([NH3+])C[C@H]3C2)C1 ZINC000574585398 483666774 /nfs/dbraw/zinc/66/67/74/483666774.db2.gz VJJKLMPIBWYURH-CRWXNKLISA-N 2 0 351.451 -1.254 20 0 FAADRP C[NH+](C)[C@@H]1CCC[C@H](NC(=O)C(=O)N2CCN3C(=O)[C@@H]([NH3+])C[C@@H]3C2)C1 ZINC000574585399 483666549 /nfs/dbraw/zinc/66/65/49/483666549.db2.gz VJJKLMPIBWYURH-DGAVXFQQSA-N 2 0 351.451 -1.254 20 0 FAADRP C[NH+](C)[C@@H]1CCC[C@H](NC(=O)C(=O)N2CCN3C(=O)[C@H]([NH3+])C[C@@H]3C2)C1 ZINC000574585400 483667069 /nfs/dbraw/zinc/66/70/69/483667069.db2.gz VJJKLMPIBWYURH-REWJHTLYSA-N 2 0 351.451 -1.254 20 0 FAADRP C[NH+](C)[C@@H]1CCC[C@H](NC(=O)C(=O)N2CCN3C(=O)[C@H]([NH3+])C[C@H]3C2)C1 ZINC000574585401 483666747 /nfs/dbraw/zinc/66/67/47/483666747.db2.gz VJJKLMPIBWYURH-RFQIPJPRSA-N 2 0 351.451 -1.254 20 0 FAADRP C[C@@H](NC(=O)CNC(=O)[C@@H]1CCC[NH2+]1)C(=O)NCC[NH+]1CCCCC1 ZINC000574689492 483667419 /nfs/dbraw/zinc/66/74/19/483667419.db2.gz JUHQTDIHXHDVPJ-KGLIPLIRSA-N 2 0 353.467 -1.039 20 0 FAADRP C[C@@H](NC(=O)CNC(=O)[C@H]1CCC[NH2+]1)C(=O)NCC[NH+]1CCCCC1 ZINC000574689494 483667547 /nfs/dbraw/zinc/66/75/47/483667547.db2.gz JUHQTDIHXHDVPJ-ZIAGYGMSSA-N 2 0 353.467 -1.039 20 0 FAADRP COCC[N@@H+]1CC[C@@H](NC(=O)C(=O)N(C)C[C@H](O)CN2CCOCC2)C1 ZINC000574790912 483667692 /nfs/dbraw/zinc/66/76/92/483667692.db2.gz HPFQRONHEYQJEG-CABCVRRESA-N 2 0 372.466 -2.025 20 0 FAADRP COCC[N@@H+]1CC[C@H](NC(=O)C(=O)N(C)C[C@H](O)CN2CCOCC2)C1 ZINC000574790916 483667390 /nfs/dbraw/zinc/66/73/90/483667390.db2.gz HPFQRONHEYQJEG-GJZGRUSLSA-N 2 0 372.466 -2.025 20 0 FAADRP COCC[N@@H+]1CC[C@@H](NC(=O)C(=O)N(C)C[C@@H](O)CN2CCOCC2)C1 ZINC000574790919 483667329 /nfs/dbraw/zinc/66/73/29/483667329.db2.gz HPFQRONHEYQJEG-HUUCEWRRSA-N 2 0 372.466 -2.025 20 0 FAADRP COCC[N@@H+]1CC[C@H](NC(=O)C(=O)N(C)C[C@@H](O)CN2CCOCC2)C1 ZINC000574790922 483667185 /nfs/dbraw/zinc/66/71/85/483667185.db2.gz HPFQRONHEYQJEG-LSDHHAIUSA-N 2 0 372.466 -2.025 20 0 FAADRP CN(CCN(C)C1CC[NH+](C)CC1)C(=O)C(=O)N1CCN(C)C(=O)C1 ZINC000574856246 483667718 /nfs/dbraw/zinc/66/77/18/483667718.db2.gz SZUDKOHELJYTKQ-UHFFFAOYSA-N 2 0 353.467 -1.229 20 0 FAADRP CN(CCN(C)C1CC[NH+](C)CC1)C(=O)C(=O)N1CCN(C)C[C@@H]1C[NH3+] ZINC000574981598 482781224 /nfs/dbraw/zinc/78/12/24/482781224.db2.gz SSXLSOTUKLHRJF-INIZCTEOSA-N 2 0 368.526 -1.428 20 0 FAADRP CN(CCN(C)C1CC[NH+](C)CC1)C(=O)C(=O)N1CCN(C)C[C@H]1C[NH3+] ZINC000574981602 482781701 /nfs/dbraw/zinc/78/17/01/482781701.db2.gz SSXLSOTUKLHRJF-MRXNPFEDSA-N 2 0 368.526 -1.428 20 0 FAADRP NC(=O)[C@H]1CCC[N@H+](CCCNC(=O)CCNC(=O)[C@@H]2CCC[NH2+]2)C1 ZINC000576034028 483669647 /nfs/dbraw/zinc/66/96/47/483669647.db2.gz JFTSGTXFESDWRN-KBPBESRZSA-N 2 0 353.467 -1.052 20 0 FAADRP NC(=O)[C@@H]1CCC[N@H+](CCCNC(=O)CCNC(=O)[C@@H]2CCC[NH2+]2)C1 ZINC000576034029 483669630 /nfs/dbraw/zinc/66/96/30/483669630.db2.gz JFTSGTXFESDWRN-KGLIPLIRSA-N 2 0 353.467 -1.052 20 0 FAADRP NC(=O)[C@H]1CCC[N@H+](CCCNC(=O)CCNC(=O)[C@H]2CCC[NH2+]2)C1 ZINC000576034030 483669643 /nfs/dbraw/zinc/66/96/43/483669643.db2.gz JFTSGTXFESDWRN-UONOGXRCSA-N 2 0 353.467 -1.052 20 0 FAADRP NC(=O)[C@@H]1CCC[N@H+](CCCNC(=O)CCNC(=O)[C@H]2CCC[NH2+]2)C1 ZINC000576034031 483669751 /nfs/dbraw/zinc/66/97/51/483669751.db2.gz JFTSGTXFESDWRN-ZIAGYGMSSA-N 2 0 353.467 -1.052 20 0 FAADRP CC(C)NS(=O)(=O)NCCNC(=O)N(CC[NH+](C)C)CC[NH+](C)C ZINC000576416221 483670303 /nfs/dbraw/zinc/67/03/03/483670303.db2.gz HEENGKZMQAPFJR-UHFFFAOYSA-N 2 0 366.532 -1.046 20 0 FAADRP CC(C)(CNC(=O)C(=O)NCC(=O)N1CC[NH2+]CC1)[NH+]1CCCCC1 ZINC000576730573 483671223 /nfs/dbraw/zinc/67/12/23/483671223.db2.gz NTWTVTQWGYLRJF-UHFFFAOYSA-N 2 0 353.467 -1.085 20 0 FAADRP C[C@@H](CCNC(=O)C(=O)NCC(=O)N1CC[NH2+]CC1)[NH+]1CCCCC1 ZINC000576732981 483671154 /nfs/dbraw/zinc/67/11/54/483671154.db2.gz XHWRLZWSMLLYTM-AWEZNQCLSA-N 2 0 353.467 -1.085 20 0 FAADRP C[C@H](CCNC(=O)C(=O)NCC(=O)N1CC[NH2+]CC1)[NH+]1CCCCC1 ZINC000576732982 483671211 /nfs/dbraw/zinc/67/12/11/483671211.db2.gz XHWRLZWSMLLYTM-CQSZACIVSA-N 2 0 353.467 -1.085 20 0 FAADRP O=C(CNC(=O)C(=O)N[C@H]1CC[N@H+](Cc2ccccc2)C1)N1CC[NH2+]CC1 ZINC000576928984 483671873 /nfs/dbraw/zinc/67/18/73/483671873.db2.gz NKDWUIZCJMYVOW-INIZCTEOSA-N 2 0 373.457 -1.075 20 0 FAADRP O=C(CNC(=O)C(=O)N[C@@H]1CC[N@H+](Cc2ccccc2)C1)N1CC[NH2+]CC1 ZINC000576928987 483671630 /nfs/dbraw/zinc/67/16/30/483671630.db2.gz NKDWUIZCJMYVOW-MRXNPFEDSA-N 2 0 373.457 -1.075 20 0 FAADRP C[C@@H](C[NH+]1CCC(C)CC1)NC(=O)C(=O)N1CCN2C(=O)[C@@H]([NH3+])C[C@H]2C1 ZINC000577192150 483672392 /nfs/dbraw/zinc/67/23/92/483672392.db2.gz AMOIOJAOKZNQAB-KKUMJFAQSA-N 2 0 365.478 -1.007 20 0 FAADRP C[C@@H](C[NH+]1CCC(C)CC1)NC(=O)C(=O)N1CCN2C(=O)[C@H]([NH3+])C[C@@H]2C1 ZINC000577192152 483672707 /nfs/dbraw/zinc/67/27/07/483672707.db2.gz AMOIOJAOKZNQAB-RRFJBIMHSA-N 2 0 365.478 -1.007 20 0 FAADRP C[C@@H](C[NH+]1CCC(C)CC1)NC(=O)C(=O)N1CCN2C(=O)[C@H]([NH3+])C[C@H]2C1 ZINC000577192154 483672862 /nfs/dbraw/zinc/67/28/62/483672862.db2.gz AMOIOJAOKZNQAB-SOUVJXGZSA-N 2 0 365.478 -1.007 20 0 FAADRP C[C@@H](C[NH+]1CCC(C)CC1)NC(=O)C(=O)N1CCN2C(=O)[C@@H]([NH3+])C[C@@H]2C1 ZINC000577192156 483672440 /nfs/dbraw/zinc/67/24/40/483672440.db2.gz AMOIOJAOKZNQAB-ZNMIVQPWSA-N 2 0 365.478 -1.007 20 0 FAADRP C[NH+](C)CCN1CCC(NC(=O)N2CCN3C(=O)[C@@H]([NH3+])C[C@@H]3C2)CC1 ZINC000577412601 483673521 /nfs/dbraw/zinc/67/35/21/483673521.db2.gz UOZKOPINIWZFFV-CABCVRRESA-N 2 0 352.483 -1.034 20 0 FAADRP C[NH+](C)CCN1CCC(NC(=O)N2CCN3C(=O)[C@@H]([NH3+])C[C@H]3C2)CC1 ZINC000577412611 483673477 /nfs/dbraw/zinc/67/34/77/483673477.db2.gz UOZKOPINIWZFFV-GJZGRUSLSA-N 2 0 352.483 -1.034 20 0 FAADRP C[NH+](C)CCN1CCC(NC(=O)N2CCN3C(=O)[C@H]([NH3+])C[C@@H]3C2)CC1 ZINC000577412613 483673427 /nfs/dbraw/zinc/67/34/27/483673427.db2.gz UOZKOPINIWZFFV-HUUCEWRRSA-N 2 0 352.483 -1.034 20 0 FAADRP C[NH+](C)CCN1CCC(NC(=O)N2CCN3C(=O)[C@H]([NH3+])C[C@H]3C2)CC1 ZINC000577412619 483673329 /nfs/dbraw/zinc/67/33/29/483673329.db2.gz UOZKOPINIWZFFV-LSDHHAIUSA-N 2 0 352.483 -1.034 20 0 FAADRP COCC[N@@H+]1CC[C@H](NC(=O)C(=O)N2CCN3C(=O)[C@@H]([NH3+])C[C@H]3C2)C1 ZINC000577530666 483673561 /nfs/dbraw/zinc/67/35/61/483673561.db2.gz PRXKGICNKHYOSB-AVGNSLFASA-N 2 0 353.423 -2.406 20 0 FAADRP COCC[N@@H+]1CC[C@H](NC(=O)C(=O)N2CCN3C(=O)[C@H]([NH3+])C[C@H]3C2)C1 ZINC000577530667 483673344 /nfs/dbraw/zinc/67/33/44/483673344.db2.gz PRXKGICNKHYOSB-RWMBFGLXSA-N 2 0 353.423 -2.406 20 0 FAADRP 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/nfs/dbraw/zinc/68/49/47/483684947.db2.gz OYKIEWKCTFPFSS-CHWSQXEVSA-N 2 0 355.439 -2.159 20 0 FAADRP COCCC[N@H+](C)CCNC(=O)C(=O)N1CCN2C(=O)[C@@H]([NH3+])C[C@@H]2C1 ZINC000581143437 483685493 /nfs/dbraw/zinc/68/54/93/483685493.db2.gz OYKIEWKCTFPFSS-OLZOCXBDSA-N 2 0 355.439 -2.159 20 0 FAADRP COCCC[N@H+](C)CCNC(=O)C(=O)N1CCN2C(=O)[C@H]([NH3+])C[C@H]2C1 ZINC000581143439 483685210 /nfs/dbraw/zinc/68/52/10/483685210.db2.gz OYKIEWKCTFPFSS-QWHCGFSZSA-N 2 0 355.439 -2.159 20 0 FAADRP COCCC[N@H+](C)CCNC(=O)C(=O)N1CCN2C(=O)[C@@H]([NH3+])C[C@H]2C1 ZINC000581143440 483685145 /nfs/dbraw/zinc/68/51/45/483685145.db2.gz OYKIEWKCTFPFSS-STQMWFEESA-N 2 0 355.439 -2.159 20 0 FAADRP CC1CC[NH+](CCCNC(=O)C(=O)NCC(=O)N2CC[NH2+]CC2)CC1 ZINC000581240842 483685787 /nfs/dbraw/zinc/68/57/87/483685787.db2.gz DJHCIFODBCAVSM-UHFFFAOYSA-N 2 0 353.467 -1.227 20 0 FAADRP CC(C)C[C@H](NC(=O)NCC(=O)N1CC[NH2+]CC1)C(=O)NCC[NH+](C)C ZINC000581240932 483685794 /nfs/dbraw/zinc/68/57/94/483685794.db2.gz OTQPRFFPAWPJCY-AWEZNQCLSA-N 2 0 370.498 -1.190 20 0 FAADRP CNC(=O)N[C@@H]1CCN(C(=O)C(=O)N(CC[NH+](C)C)CC[NH+](C)C)C1 ZINC000581296472 483685814 /nfs/dbraw/zinc/68/58/14/483685814.db2.gz OTLUQVNAPVALMZ-CYBMUJFWSA-N 2 0 356.471 -1.532 20 0 FAADRP CNC(=O)N[C@H]1CCN(C(=O)C(=O)N(CC[NH+](C)C)CC[NH+](C)C)C1 ZINC000581296473 483686004 /nfs/dbraw/zinc/68/60/04/483686004.db2.gz OTLUQVNAPVALMZ-ZDUSSCGKSA-N 2 0 356.471 -1.532 20 0 FAADRP CC[NH+](CC)CC(=O)N1CCN(C(=O)CNC(=O)[C@@H]2CCC[NH2+]2)CC1 ZINC000581367530 483687007 /nfs/dbraw/zinc/68/70/07/483687007.db2.gz CTGWHJKHUUPQHF-AWEZNQCLSA-N 2 0 353.467 -1.133 20 0 FAADRP CC[NH+](CC)CC(=O)N1CCN(C(=O)CNC(=O)[C@H]2CCC[NH2+]2)CC1 ZINC000581367531 483686548 /nfs/dbraw/zinc/68/65/48/483686548.db2.gz CTGWHJKHUUPQHF-CQSZACIVSA-N 2 0 353.467 -1.133 20 0 FAADRP C[C@@H](C[NH+]1CCC(C)CC1)NC(=O)C(=O)NCC(=O)N1CC[NH2+]CC1 ZINC000581559795 483687026 /nfs/dbraw/zinc/68/70/26/483687026.db2.gz LUHRNCDGUXLGFD-AWEZNQCLSA-N 2 0 353.467 -1.229 20 0 FAADRP C[C@H](C[NH+]1CCC(C)CC1)NC(=O)C(=O)NCC(=O)N1CC[NH2+]CC1 ZINC000581559796 483686905 /nfs/dbraw/zinc/68/69/05/483686905.db2.gz LUHRNCDGUXLGFD-CQSZACIVSA-N 2 0 353.467 -1.229 20 0 FAADRP C[C@@H]1CC[NH2+]C[C@@H]1NC(=O)C(=O)N1CCN(C(=O)C[NH+]2CCCC2)CC1 ZINC000581874986 483688253 /nfs/dbraw/zinc/68/82/53/483688253.db2.gz YVTZUUFKZKKDJK-CABCVRRESA-N 2 0 365.478 -1.133 20 0 FAADRP C[C@H]1CC[NH2+]C[C@@H]1NC(=O)C(=O)N1CCN(C(=O)C[NH+]2CCCC2)CC1 ZINC000581874987 483688584 /nfs/dbraw/zinc/68/85/84/483688584.db2.gz YVTZUUFKZKKDJK-GJZGRUSLSA-N 2 0 365.478 -1.133 20 0 FAADRP C[C@@H]1CC[NH2+]C[C@H]1NC(=O)C(=O)N1CCN(C(=O)C[NH+]2CCCC2)CC1 ZINC000581874988 483688340 /nfs/dbraw/zinc/68/83/40/483688340.db2.gz YVTZUUFKZKKDJK-HUUCEWRRSA-N 2 0 365.478 -1.133 20 0 FAADRP C[C@H]1CC[NH2+]C[C@H]1NC(=O)C(=O)N1CCN(C(=O)C[NH+]2CCCC2)CC1 ZINC000581874989 483688536 /nfs/dbraw/zinc/68/85/36/483688536.db2.gz YVTZUUFKZKKDJK-LSDHHAIUSA-N 2 0 365.478 -1.133 20 0 FAADRP C[N@@H+]1CCC[C@H]1C(=O)N1CCN(C(=O)NCC(=O)N2CC[NH2+]CC2)CC1 ZINC000581933496 483689243 /nfs/dbraw/zinc/68/92/43/483689243.db2.gz ASGHCZVCSAQTMI-AWEZNQCLSA-N 2 0 366.466 -1.634 20 0 FAADRP C[N@@H+]1CCC[C@@H]1C(=O)N1CCN(C(=O)NCC(=O)N2CC[NH2+]CC2)CC1 ZINC000581933497 483688728 /nfs/dbraw/zinc/68/87/28/483688728.db2.gz ASGHCZVCSAQTMI-CQSZACIVSA-N 2 0 366.466 -1.634 20 0 FAADRP C[NH2+][C@H]1CCN(C(=O)C(=O)N2CCN(C(=O)C[NH+]3CCCC3)CC2)C1 ZINC000581937771 483688768 /nfs/dbraw/zinc/68/87/68/483688768.db2.gz NVYSIBGUFMZTOP-AWEZNQCLSA-N 2 0 351.451 -1.427 20 0 FAADRP C[NH2+][C@@H]1CCN(C(=O)C(=O)N2CCN(C(=O)C[NH+]3CCCC3)CC2)C1 ZINC000581937772 483689085 /nfs/dbraw/zinc/68/90/85/483689085.db2.gz NVYSIBGUFMZTOP-CQSZACIVSA-N 2 0 351.451 -1.427 20 0 FAADRP C[NH+](C)CCN(CC[NH+](C)C)C(=O)C(=O)N1CCN(CC(C)(C)O)CC1 ZINC000582048460 482773251 /nfs/dbraw/zinc/77/32/51/482773251.db2.gz KJJHCKOFQOWKKA-UHFFFAOYSA-N 2 0 371.526 -1.147 20 0 FAADRP Cc1nn(CC[NH+](C)C)c(C)c1S(=O)(=O)NCC(=O)N1CC[NH2+]CC1 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/nfs/dbraw/zinc/53/05/68/482530568.db2.gz HKCBDTLVRKXLPN-GJZGRUSLSA-N 2 0 365.478 -1.005 20 0 FAADRP CCC[NH+]1CCC(CNC(=O)C(=O)N2CCN3C(=O)[C@H]([NH3+])C[C@@H]3C2)CC1 ZINC000583333853 482531377 /nfs/dbraw/zinc/53/13/77/482531377.db2.gz HKCBDTLVRKXLPN-HUUCEWRRSA-N 2 0 365.478 -1.005 20 0 FAADRP CCC[NH+]1CCC(CNC(=O)C(=O)N2CCN3C(=O)[C@H]([NH3+])C[C@H]3C2)CC1 ZINC000583333854 482530523 /nfs/dbraw/zinc/53/05/23/482530523.db2.gz HKCBDTLVRKXLPN-LSDHHAIUSA-N 2 0 365.478 -1.005 20 0 FAADRP CN(CCC[NH3+])C(=O)C(=O)NCC1(N2CCOCC2)CC[NH+](C)CC1 ZINC000583576150 483134026 /nfs/dbraw/zinc/13/40/26/483134026.db2.gz FTSDXXGEGRPGHG-UHFFFAOYSA-N 2 0 355.483 -1.294 20 0 FAADRP C[NH+]1CCC(CNC(=O)C(=O)N[C@H]2CC[NH2+]C2)(N2CCOCC2)CC1 ZINC000583576476 483133581 /nfs/dbraw/zinc/13/35/81/483133581.db2.gz RISAISGELIUJBE-AWEZNQCLSA-N 2 0 353.467 -1.623 20 0 FAADRP O=C(C[NH+]1CCCC1)N1CCN(C(=O)C(=O)N2CCC[NH2+]CC2)CC1 ZINC000583625133 483145891 /nfs/dbraw/zinc/14/58/91/483145891.db2.gz JSSMAQBOTUEGTA-UHFFFAOYSA-N 2 0 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[NH3+][C@H]1C[C@@H]2CN(C(=O)C(=O)Nc3cnn(-c4cc[nH+]cc4)c3)CCN2C1=O ZINC000595240705 482825269 /nfs/dbraw/zinc/82/52/69/482825269.db2.gz XDUYAECQVQJNFI-KGLIPLIRSA-N 2 0 369.385 -1.024 20 0 FAADRP [NH3+][C@@H]1C[C@H]2CN(C(=O)C(=O)Nc3cnn(-c4cc[nH+]cc4)c3)CCN2C1=O ZINC000595240706 482825845 /nfs/dbraw/zinc/82/58/45/482825845.db2.gz XDUYAECQVQJNFI-UONOGXRCSA-N 2 0 369.385 -1.024 20 0 FAADRP [NH3+][C@@H]1C[C@@H]2CN(C(=O)C(=O)Nc3cnn(-c4cc[nH+]cc4)c3)CCN2C1=O ZINC000595240707 482826258 /nfs/dbraw/zinc/82/62/58/482826258.db2.gz XDUYAECQVQJNFI-ZIAGYGMSSA-N 2 0 369.385 -1.024 20 0 FAADRP [NH3+][C@@H]1C[C@@H]2CN(C(=O)C(=O)Nc3ccn(-c4cc[nH+]cc4)n3)CCN2C1=O ZINC000595242414 483763226 /nfs/dbraw/zinc/76/32/26/483763226.db2.gz ZLGWBRVXQJWJQI-CHWSQXEVSA-N 2 0 369.385 -1.024 20 0 FAADRP [NH3+][C@H]1C[C@@H]2CN(C(=O)C(=O)Nc3ccn(-c4cc[nH+]cc4)n3)CCN2C1=O ZINC000595242421 483763210 /nfs/dbraw/zinc/76/32/10/483763210.db2.gz ZLGWBRVXQJWJQI-OLZOCXBDSA-N 2 0 369.385 -1.024 20 0 FAADRP [NH3+][C@@H]1C[C@H]2CN(C(=O)C(=O)Nc3ccn(-c4cc[nH+]cc4)n3)CCN2C1=O ZINC000595242424 483763548 /nfs/dbraw/zinc/76/35/48/483763548.db2.gz ZLGWBRVXQJWJQI-QWHCGFSZSA-N 2 0 369.385 -1.024 20 0 FAADRP [NH3+][C@H]1C[C@H]2CN(C(=O)C(=O)Nc3ccn(-c4cc[nH+]cc4)n3)CCN2C1=O ZINC000595242426 483763503 /nfs/dbraw/zinc/76/35/03/483763503.db2.gz ZLGWBRVXQJWJQI-STQMWFEESA-N 2 0 369.385 -1.024 20 0 FAADRP CC[C@H](C[NH+]1CCCC1)NC(=O)C(=O)N1CCN2C(=O)[C@H]([NH3+])C[C@H]2C1 ZINC000595277756 482828197 /nfs/dbraw/zinc/82/81/97/482828197.db2.gz QLGIFQJNHHPCDA-HZSPNIEDSA-N 2 0 351.451 -1.253 20 0 FAADRP CC[C@H](C[NH+]1CCCC1)NC(=O)C(=O)N1CCN2C(=O)[C@@H]([NH3+])C[C@@H]2C1 ZINC000595277757 482827919 /nfs/dbraw/zinc/82/79/19/482827919.db2.gz QLGIFQJNHHPCDA-MCIONIFRSA-N 2 0 351.451 -1.253 20 0 FAADRP CC[C@H](C[NH+]1CCCC1)NC(=O)C(=O)N1CCN2C(=O)[C@H]([NH3+])C[C@@H]2C1 ZINC000595277758 482828165 /nfs/dbraw/zinc/82/81/65/482828165.db2.gz QLGIFQJNHHPCDA-MGPQQGTHSA-N 2 0 351.451 -1.253 20 0 FAADRP CC[C@H](C[NH+]1CCCC1)NC(=O)C(=O)N1CCN2C(=O)[C@@H]([NH3+])C[C@H]2C1 ZINC000595277759 482828574 /nfs/dbraw/zinc/82/85/74/482828574.db2.gz QLGIFQJNHHPCDA-RDBSUJKOSA-N 2 0 351.451 -1.253 20 0 FAADRP CC(C)[N@@H+]1CCC[C@H](CNC(=O)C(=O)N2CCN3C(=O)[C@@H]([NH3+])C[C@H]3C2)C1 ZINC000595278430 482828214 /nfs/dbraw/zinc/82/82/14/482828214.db2.gz RNJHEHMAYFXJEP-ILXRZTDVSA-N 2 0 365.478 -1.007 20 0 FAADRP CC(C)[N@@H+]1CCC[C@H](CNC(=O)C(=O)N2CCN3C(=O)[C@@H]([NH3+])C[C@@H]3C2)C1 ZINC000595278431 482827428 /nfs/dbraw/zinc/82/74/28/482827428.db2.gz RNJHEHMAYFXJEP-KFWWJZLASA-N 2 0 365.478 -1.007 20 0 FAADRP CC(C)[N@@H+]1CCC[C@H](CNC(=O)C(=O)N2CCN3C(=O)[C@H]([NH3+])C[C@H]3C2)C1 ZINC000595278432 482827717 /nfs/dbraw/zinc/82/77/17/482827717.db2.gz RNJHEHMAYFXJEP-QLFBSQMISA-N 2 0 365.478 -1.007 20 0 FAADRP CC(C)[N@@H+]1CCC[C@H](CNC(=O)C(=O)N2CCN3C(=O)[C@H]([NH3+])C[C@@H]3C2)C1 ZINC000595278433 482827584 /nfs/dbraw/zinc/82/75/84/482827584.db2.gz RNJHEHMAYFXJEP-RBSFLKMASA-N 2 0 365.478 -1.007 20 0 FAADRP C[NH+](C)CC1CCC(NC(=O)C(=O)N2CCN3C(=O)[C@@H]([NH3+])C[C@@H]3C2)CC1 ZINC000595279299 482828253 /nfs/dbraw/zinc/82/82/53/482828253.db2.gz HSQSXOZJDLGSFF-CVSAEHQPSA-N 2 0 365.478 -1.007 20 0 FAADRP C[NH+](C)CC1CCC(NC(=O)C(=O)N2CCN3C(=O)[C@H]([NH3+])C[C@@H]3C2)CC1 ZINC000595279301 482827789 /nfs/dbraw/zinc/82/77/89/482827789.db2.gz HSQSXOZJDLGSFF-NEXFUWMNSA-N 2 0 365.478 -1.007 20 0 FAADRP C[NH+](C)CC1CCC(NC(=O)C(=O)N2CCN3C(=O)[C@H]([NH3+])C[C@H]3C2)CC1 ZINC000595279303 482828269 /nfs/dbraw/zinc/82/82/69/482828269.db2.gz HSQSXOZJDLGSFF-PFSRBDOWSA-N 2 0 365.478 -1.007 20 0 FAADRP C[NH+](C)CC1CCC(NC(=O)C(=O)N2CCN3C(=O)[C@@H]([NH3+])C[C@H]3C2)CC1 ZINC000595279304 482828523 /nfs/dbraw/zinc/82/85/23/482828523.db2.gz HSQSXOZJDLGSFF-WUCCLRPBSA-N 2 0 365.478 -1.007 20 0 FAADRP C[C@H](NC(=O)C(=O)N1CCN2C(=O)[C@H]([NH3+])C[C@H]2C1)C1CC[NH+](C)CC1 ZINC000595279529 482827464 /nfs/dbraw/zinc/82/74/64/482827464.db2.gz METFFTLBYUERNC-FPMFFAJLSA-N 2 0 351.451 -1.397 20 0 FAADRP C[C@H](NC(=O)C(=O)N1CCN2C(=O)[C@H]([NH3+])C[C@@H]2C1)C1CC[NH+](C)CC1 ZINC000595279530 482828705 /nfs/dbraw/zinc/82/87/05/482828705.db2.gz METFFTLBYUERNC-IACUBPJLSA-N 2 0 351.451 -1.397 20 0 FAADRP C[C@H](NC(=O)C(=O)N1CCN2C(=O)[C@@H]([NH3+])C[C@H]2C1)C1CC[NH+](C)CC1 ZINC000595279531 482827981 /nfs/dbraw/zinc/82/79/81/482827981.db2.gz METFFTLBYUERNC-UBHSHLNASA-N 2 0 351.451 -1.397 20 0 FAADRP C[C@H](NC(=O)C(=O)N1CCN2C(=O)[C@@H]([NH3+])C[C@@H]2C1)C1CC[NH+](C)CC1 ZINC000595279532 482827447 /nfs/dbraw/zinc/82/74/47/482827447.db2.gz METFFTLBYUERNC-YUTCNCBUSA-N 2 0 351.451 -1.397 20 0 FAADRP CC[N@@H+]1CCCC[C@@H]1CNC(=O)C(=O)N1CCN2C(=O)[C@H]([NH3+])C[C@H]2C1 ZINC000595279847 482827209 /nfs/dbraw/zinc/82/72/09/482827209.db2.gz XDEXPOLQBYQVKY-HZSPNIEDSA-N 2 0 351.451 -1.253 20 0 FAADRP CC[N@@H+]1CCCC[C@@H]1CNC(=O)C(=O)N1CCN2C(=O)[C@@H]([NH3+])C[C@@H]2C1 ZINC000595279848 482828286 /nfs/dbraw/zinc/82/82/86/482828286.db2.gz XDEXPOLQBYQVKY-MCIONIFRSA-N 2 0 351.451 -1.253 20 0 FAADRP CC[N@@H+]1CCCC[C@@H]1CNC(=O)C(=O)N1CCN2C(=O)[C@H]([NH3+])C[C@@H]2C1 ZINC000595279849 482827867 /nfs/dbraw/zinc/82/78/67/482827867.db2.gz XDEXPOLQBYQVKY-MGPQQGTHSA-N 2 0 351.451 -1.253 20 0 FAADRP CC[N@@H+]1CCCC[C@@H]1CNC(=O)C(=O)N1CCN2C(=O)[C@@H]([NH3+])C[C@H]2C1 ZINC000595279850 482828035 /nfs/dbraw/zinc/82/80/35/482828035.db2.gz XDEXPOLQBYQVKY-RDBSUJKOSA-N 2 0 351.451 -1.253 20 0 FAADRP [NH3+][C@H]1C[C@@H]2CN(C(=O)C(=O)NCC3CC[NH+](C4CC4)CC3)CCN2C1=O ZINC000595280917 482828776 /nfs/dbraw/zinc/82/87/76/482828776.db2.gz AQWSOOLFEFWBNC-CABCVRRESA-N 2 0 363.462 -1.253 20 0 FAADRP [NH3+][C@H]1C[C@H]2CN(C(=O)C(=O)NCC3CC[NH+](C4CC4)CC3)CCN2C1=O ZINC000595280919 482827185 /nfs/dbraw/zinc/82/71/85/482827185.db2.gz AQWSOOLFEFWBNC-GJZGRUSLSA-N 2 0 363.462 -1.253 20 0 FAADRP [NH3+][C@@H]1C[C@@H]2CN(C(=O)C(=O)NCC3CC[NH+](C4CC4)CC3)CCN2C1=O ZINC000595280921 482827167 /nfs/dbraw/zinc/82/71/67/482827167.db2.gz AQWSOOLFEFWBNC-HUUCEWRRSA-N 2 0 363.462 -1.253 20 0 FAADRP [NH3+][C@@H]1C[C@H]2CN(C(=O)C(=O)NCC3CC[NH+](C4CC4)CC3)CCN2C1=O ZINC000595280922 482830352 /nfs/dbraw/zinc/83/03/52/482830352.db2.gz AQWSOOLFEFWBNC-LSDHHAIUSA-N 2 0 363.462 -1.253 20 0 FAADRP CC(C)C[N@H+](C)CCCNC(=O)C(=O)N1CCN2C(=O)[C@@H]([NH3+])C[C@H]2C1 ZINC000595285062 482829257 /nfs/dbraw/zinc/82/92/57/482829257.db2.gz ZLSSBPNZYOMZJO-KBPBESRZSA-N 2 0 353.467 -1.149 20 0 FAADRP CC(C)C[N@H+](C)CCCNC(=O)C(=O)N1CCN2C(=O)[C@@H]([NH3+])C[C@@H]2C1 ZINC000595285064 482829802 /nfs/dbraw/zinc/82/98/02/482829802.db2.gz ZLSSBPNZYOMZJO-KGLIPLIRSA-N 2 0 353.467 -1.149 20 0 FAADRP CC(C)C[N@H+](C)CCCNC(=O)C(=O)N1CCN2C(=O)[C@H]([NH3+])C[C@H]2C1 ZINC000595285066 482830207 /nfs/dbraw/zinc/83/02/07/482830207.db2.gz ZLSSBPNZYOMZJO-UONOGXRCSA-N 2 0 353.467 -1.149 20 0 FAADRP CC(C)C[N@H+](C)CCCNC(=O)C(=O)N1CCN2C(=O)[C@H]([NH3+])C[C@@H]2C1 ZINC000595285068 482830567 /nfs/dbraw/zinc/83/05/67/482830567.db2.gz ZLSSBPNZYOMZJO-ZIAGYGMSSA-N 2 0 353.467 -1.149 20 0 FAADRP COC(=O)c1cccc(C[N@H+]2C[C@@H](O)[C@@H](O)C2)c1CN1C[C@@H](O)[C@@H](O)C1 ZINC000595338316 482829528 /nfs/dbraw/zinc/82/95/28/482829528.db2.gz QHUBXWQXNWLNPE-WNKDZCFJSA-N 2 0 366.414 -1.452 20 0 FAADRP C[N@@H+]1CC[C@@H]2[C@H](CCCN2C(=O)C(=O)N2CCN3C(=O)[C@@H]([NH3+])C[C@@H]3C2)C1 ZINC000595979433 482835656 /nfs/dbraw/zinc/83/56/56/482835656.db2.gz DSEQCRROQWFFFB-APIJFGDWSA-N 2 0 363.462 -1.301 20 0 FAADRP C[N@@H+]1CC[C@@H]2[C@H](CCCN2C(=O)C(=O)N2CCN3C(=O)[C@@H]([NH3+])C[C@H]3C2)C1 ZINC000595979434 482835159 /nfs/dbraw/zinc/83/51/59/482835159.db2.gz DSEQCRROQWFFFB-CBBWQLFWSA-N 2 0 363.462 -1.301 20 0 FAADRP C[N@@H+]1CC[C@@H]2[C@H](CCCN2C(=O)C(=O)N2CCN3C(=O)[C@H]([NH3+])C[C@@H]3C2)C1 ZINC000595979435 482835004 /nfs/dbraw/zinc/83/50/04/482835004.db2.gz DSEQCRROQWFFFB-KBUPBQIOSA-N 2 0 363.462 -1.301 20 0 FAADRP C[N@@H+]1CC[C@@H]2[C@H](CCCN2C(=O)C(=O)N2CCN3C(=O)[C@H]([NH3+])C[C@H]3C2)C1 ZINC000595979436 482835180 /nfs/dbraw/zinc/83/51/80/482835180.db2.gz DSEQCRROQWFFFB-LXTVHRRPSA-N 2 0 363.462 -1.301 20 0 FAADRP [NH3+][C@@H]1C[C@H]2CN(C(=O)C(=O)N3CCC[C@@H]([NH+]4CCCC4)C3)CCN2C1=O ZINC000595980137 482835820 /nfs/dbraw/zinc/83/58/20/482835820.db2.gz GIVZXPPBTGRAEI-QLFBSQMISA-N 2 0 363.462 -1.156 20 0 FAADRP [NH3+][C@@H]1C[C@@H]2CN(C(=O)C(=O)N3CCC[C@@H]([NH+]4CCCC4)C3)CCN2C1=O ZINC000595980138 482835309 /nfs/dbraw/zinc/83/53/09/482835309.db2.gz GIVZXPPBTGRAEI-RBSFLKMASA-N 2 0 363.462 -1.156 20 0 FAADRP [NH3+][C@@H]1C[C@@H]2CN(C(=O)C(=O)N3CCC[C@H]([NH+]4CCCC4)C3)CCN2C1=O ZINC000595980139 482835925 /nfs/dbraw/zinc/83/59/25/482835925.db2.gz GIVZXPPBTGRAEI-RRFJBIMHSA-N 2 0 363.462 -1.156 20 0 FAADRP [NH3+][C@@H]1C[C@H]2CN(C(=O)C(=O)N3CCC[C@H]([NH+]4CCCC4)C3)CCN2C1=O ZINC000595980140 482835874 /nfs/dbraw/zinc/83/58/74/482835874.db2.gz GIVZXPPBTGRAEI-SOUVJXGZSA-N 2 0 363.462 -1.156 20 0 FAADRP C[NH+]1CCC2(CCCN2C(=O)C(=O)N2CCN3C(=O)[C@@H]([NH3+])C[C@H]3C2)CC1 ZINC000595980531 482835695 /nfs/dbraw/zinc/83/56/95/482835695.db2.gz JHQMVVMIILECKZ-KBPBESRZSA-N 2 0 363.462 -1.156 20 0 FAADRP C[NH+]1CCC2(CCCN2C(=O)C(=O)N2CCN3C(=O)[C@@H]([NH3+])C[C@@H]3C2)CC1 ZINC000595980532 482835731 /nfs/dbraw/zinc/83/57/31/482835731.db2.gz JHQMVVMIILECKZ-KGLIPLIRSA-N 2 0 363.462 -1.156 20 0 FAADRP C[NH+]1CCC2(CCCN2C(=O)C(=O)N2CCN3C(=O)[C@H]([NH3+])C[C@H]3C2)CC1 ZINC000595980533 482835460 /nfs/dbraw/zinc/83/54/60/482835460.db2.gz JHQMVVMIILECKZ-UONOGXRCSA-N 2 0 363.462 -1.156 20 0 FAADRP C[NH+]1CCC2(CCCN2C(=O)C(=O)N2CCN3C(=O)[C@H]([NH3+])C[C@@H]3C2)CC1 ZINC000595980534 482835647 /nfs/dbraw/zinc/83/56/47/482835647.db2.gz JHQMVVMIILECKZ-ZIAGYGMSSA-N 2 0 363.462 -1.156 20 0 FAADRP C[NH+](C)CCC1CCN(C(=O)C(=O)N2CCN3C(=O)[C@@H]([NH3+])C[C@@H]3C2)CC1 ZINC000595980948 482834958 /nfs/dbraw/zinc/83/49/58/482834958.db2.gz LSTYFNIQCXDELQ-CABCVRRESA-N 2 0 365.478 -1.053 20 0 FAADRP C[NH+](C)CCC1CCN(C(=O)C(=O)N2CCN3C(=O)[C@@H]([NH3+])C[C@H]3C2)CC1 ZINC000595980949 482835984 /nfs/dbraw/zinc/83/59/84/482835984.db2.gz LSTYFNIQCXDELQ-GJZGRUSLSA-N 2 0 365.478 -1.053 20 0 FAADRP C[NH+](C)CCC1CCN(C(=O)C(=O)N2CCN3C(=O)[C@H]([NH3+])C[C@@H]3C2)CC1 ZINC000595980950 482835753 /nfs/dbraw/zinc/83/57/53/482835753.db2.gz LSTYFNIQCXDELQ-HUUCEWRRSA-N 2 0 365.478 -1.053 20 0 FAADRP C[NH+](C)CCC1CCN(C(=O)C(=O)N2CCN3C(=O)[C@H]([NH3+])C[C@H]3C2)CC1 ZINC000595980951 482835635 /nfs/dbraw/zinc/83/56/35/482835635.db2.gz LSTYFNIQCXDELQ-LSDHHAIUSA-N 2 0 365.478 -1.053 20 0 FAADRP CC[N@H+](C)C[C@@H]1CCN(C(=O)C(=O)N2CCN3C(=O)[C@H]([NH3+])C[C@@H]3C2)C1 ZINC000595981004 482835037 /nfs/dbraw/zinc/83/50/37/482835037.db2.gz MPIVCINRYRUREX-BFHYXJOUSA-N 2 0 351.451 -1.443 20 0 FAADRP CC[N@H+](C)C[C@@H]1CCN(C(=O)C(=O)N2CCN3C(=O)[C@@H]([NH3+])C[C@H]3C2)C1 ZINC000595981005 482836011 /nfs/dbraw/zinc/83/60/11/482836011.db2.gz MPIVCINRYRUREX-IHRRRGAJSA-N 2 0 351.451 -1.443 20 0 FAADRP CC[N@H+](C)C[C@@H]1CCN(C(=O)C(=O)N2CCN3C(=O)[C@H]([NH3+])C[C@H]3C2)C1 ZINC000595981006 482836093 /nfs/dbraw/zinc/83/60/93/482836093.db2.gz MPIVCINRYRUREX-MELADBBJSA-N 2 0 351.451 -1.443 20 0 FAADRP CC[N@H+](C)C[C@@H]1CCN(C(=O)C(=O)N2CCN3C(=O)[C@@H]([NH3+])C[C@@H]3C2)C1 ZINC000595981007 482835886 /nfs/dbraw/zinc/83/58/86/482835886.db2.gz MPIVCINRYRUREX-MJBXVCDLSA-N 2 0 351.451 -1.443 20 0 FAADRP CCC[N@H+](C)C[C@@H]1CCN(C(=O)C(=O)N2CCN3C(=O)[C@@H]([NH3+])C[C@H]3C2)C1 ZINC000595981014 482835263 /nfs/dbraw/zinc/83/52/63/482835263.db2.gz MTGVHMBSTPSRHT-KKUMJFAQSA-N 2 0 365.478 -1.053 20 0 FAADRP CCC[N@H+](C)C[C@@H]1CCN(C(=O)C(=O)N2CCN3C(=O)[C@H]([NH3+])C[C@@H]3C2)C1 ZINC000595981015 482836058 /nfs/dbraw/zinc/83/60/58/482836058.db2.gz MTGVHMBSTPSRHT-RRFJBIMHSA-N 2 0 365.478 -1.053 20 0 FAADRP CCC[N@H+](C)C[C@@H]1CCN(C(=O)C(=O)N2CCN3C(=O)[C@H]([NH3+])C[C@H]3C2)C1 ZINC000595981016 482835939 /nfs/dbraw/zinc/83/59/39/482835939.db2.gz MTGVHMBSTPSRHT-SOUVJXGZSA-N 2 0 365.478 -1.053 20 0 FAADRP CCC[N@H+](C)C[C@@H]1CCN(C(=O)C(=O)N2CCN3C(=O)[C@@H]([NH3+])C[C@@H]3C2)C1 ZINC000595981017 482836109 /nfs/dbraw/zinc/83/61/09/482836109.db2.gz MTGVHMBSTPSRHT-ZNMIVQPWSA-N 2 0 365.478 -1.053 20 0 FAADRP CCCN(CCC[NH+](C)C)C(=O)C(=O)N1CCN2C(=O)[C@@H]([NH3+])C[C@H]2C1 ZINC000595981050 482835483 /nfs/dbraw/zinc/83/54/83/482835483.db2.gz NMOBHHMHGBOYGE-KBPBESRZSA-N 2 0 353.467 -1.053 20 0 FAADRP CCCN(CCC[NH+](C)C)C(=O)C(=O)N1CCN2C(=O)[C@@H]([NH3+])C[C@@H]2C1 ZINC000595981051 482835721 /nfs/dbraw/zinc/83/57/21/482835721.db2.gz NMOBHHMHGBOYGE-KGLIPLIRSA-N 2 0 353.467 -1.053 20 0 FAADRP CCCN(CCC[NH+](C)C)C(=O)C(=O)N1CCN2C(=O)[C@H]([NH3+])C[C@H]2C1 ZINC000595981052 482834881 /nfs/dbraw/zinc/83/48/81/482834881.db2.gz NMOBHHMHGBOYGE-UONOGXRCSA-N 2 0 353.467 -1.053 20 0 FAADRP CCCN(CCC[NH+](C)C)C(=O)C(=O)N1CCN2C(=O)[C@H]([NH3+])C[C@@H]2C1 ZINC000595981053 482835613 /nfs/dbraw/zinc/83/56/13/482835613.db2.gz NMOBHHMHGBOYGE-ZIAGYGMSSA-N 2 0 353.467 -1.053 20 0 FAADRP C[C@H](C1CC[NH+](C)CC1)N(C)C(=O)C(=O)N1CCN2C(=O)[C@H]([NH3+])C[C@@H]2C1 ZINC000595981157 482835214 /nfs/dbraw/zinc/83/52/14/482835214.db2.gz NQBUSRSEVSOCCI-BPLDGKMQSA-N 2 0 365.478 -1.055 20 0 FAADRP C[C@H](C1CC[NH+](C)CC1)N(C)C(=O)C(=O)N1CCN2C(=O)[C@@H]([NH3+])C[C@H]2C1 ZINC000595981159 482835775 /nfs/dbraw/zinc/83/57/75/482835775.db2.gz NQBUSRSEVSOCCI-SNPRPXQTSA-N 2 0 365.478 -1.055 20 0 FAADRP C[C@H](C1CC[NH+](C)CC1)N(C)C(=O)C(=O)N1CCN2C(=O)[C@H]([NH3+])C[C@H]2C1 ZINC000595981162 482835293 /nfs/dbraw/zinc/83/52/93/482835293.db2.gz NQBUSRSEVSOCCI-VHDGCEQUSA-N 2 0 365.478 -1.055 20 0 FAADRP C[C@H](C1CC[NH+](C)CC1)N(C)C(=O)C(=O)N1CCN2C(=O)[C@@H]([NH3+])C[C@@H]2C1 ZINC000595981164 482835424 /nfs/dbraw/zinc/83/54/24/482835424.db2.gz NQBUSRSEVSOCCI-YUELXQCFSA-N 2 0 365.478 -1.055 20 0 FAADRP CC(C)[N@@H+]1CCCN(C(=O)C(=O)N2CCN3C(=O)[C@@H]([NH3+])C[C@H]3C2)CC1 ZINC000595981765 482837784 /nfs/dbraw/zinc/83/77/84/482837784.db2.gz PEBVZGCUPMGIBR-KBPBESRZSA-N 2 0 351.451 -1.301 20 0 FAADRP CC(C)[N@@H+]1CCCN(C(=O)C(=O)N2CCN3C(=O)[C@@H]([NH3+])C[C@@H]3C2)CC1 ZINC000595981766 482837680 /nfs/dbraw/zinc/83/76/80/482837680.db2.gz PEBVZGCUPMGIBR-KGLIPLIRSA-N 2 0 351.451 -1.301 20 0 FAADRP CC(C)[N@@H+]1CCCN(C(=O)C(=O)N2CCN3C(=O)[C@H]([NH3+])C[C@H]3C2)CC1 ZINC000595981767 482837550 /nfs/dbraw/zinc/83/75/50/482837550.db2.gz PEBVZGCUPMGIBR-UONOGXRCSA-N 2 0 351.451 -1.301 20 0 FAADRP CC(C)[N@@H+]1CCCN(C(=O)C(=O)N2CCN3C(=O)[C@H]([NH3+])C[C@@H]3C2)CC1 ZINC000595981768 482836723 /nfs/dbraw/zinc/83/67/23/482836723.db2.gz PEBVZGCUPMGIBR-ZIAGYGMSSA-N 2 0 351.451 -1.301 20 0 FAADRP [NH3+][C@@H]1C[C@H]2CN(C(=O)C(=O)N3CCC[C@@H]3C[NH+]3CCCC3)CCN2C1=O ZINC000595981912 482836877 /nfs/dbraw/zinc/83/68/77/482836877.db2.gz RDAOBQPUAQYXGE-QLFBSQMISA-N 2 0 363.462 -1.156 20 0 FAADRP [NH3+][C@@H]1C[C@@H]2CN(C(=O)C(=O)N3CCC[C@@H]3C[NH+]3CCCC3)CCN2C1=O ZINC000595981914 482837597 /nfs/dbraw/zinc/83/75/97/482837597.db2.gz RDAOBQPUAQYXGE-RBSFLKMASA-N 2 0 363.462 -1.156 20 0 FAADRP [NH3+][C@@H]1C[C@@H]2CN(C(=O)C(=O)N3CCC[C@H]3C[NH+]3CCCC3)CCN2C1=O ZINC000595981916 482837731 /nfs/dbraw/zinc/83/77/31/482837731.db2.gz RDAOBQPUAQYXGE-RRFJBIMHSA-N 2 0 363.462 -1.156 20 0 FAADRP [NH3+][C@@H]1C[C@H]2CN(C(=O)C(=O)N3CCC[C@H]3C[NH+]3CCCC3)CCN2C1=O ZINC000595982005 482836926 /nfs/dbraw/zinc/83/69/26/482836926.db2.gz RDAOBQPUAQYXGE-SOUVJXGZSA-N 2 0 363.462 -1.156 20 0 FAADRP CC[N@@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)C(=O)N1CCN2C(=O)[C@@H]([NH3+])C[C@@H]2C1 ZINC000595982568 482837575 /nfs/dbraw/zinc/83/75/75/482837575.db2.gz URYTTWSXCIISEW-BARDWOONSA-N 2 0 363.462 -1.158 20 0 FAADRP CC[N@@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)C(=O)N1CCN2C(=O)[C@H]([NH3+])C[C@H]2C1 ZINC000595982569 482837151 /nfs/dbraw/zinc/83/71/51/482837151.db2.gz URYTTWSXCIISEW-CBBWQLFWSA-N 2 0 363.462 -1.158 20 0 FAADRP CC[N@@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)C(=O)N1CCN2C(=O)[C@H]([NH3+])C[C@@H]2C1 ZINC000595982570 482837077 /nfs/dbraw/zinc/83/70/77/482837077.db2.gz URYTTWSXCIISEW-LXTVHRRPSA-N 2 0 363.462 -1.158 20 0 FAADRP CC[N@@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)C(=O)N1CCN2C(=O)[C@@H]([NH3+])C[C@H]2C1 ZINC000595982571 482837637 /nfs/dbraw/zinc/83/76/37/482837637.db2.gz URYTTWSXCIISEW-QPSCCSFWSA-N 2 0 363.462 -1.158 20 0 FAADRP CC[N@@H+]1CC[C@H](N(C)C(=O)C(=O)N2CCN3C(=O)[C@H]([NH3+])C[C@H]3C2)[C@H](C)C1 ZINC000595983370 482837769 /nfs/dbraw/zinc/83/77/69/482837769.db2.gz XTDFEJMRVDTEAK-BARDWOONSA-N 2 0 365.478 -1.055 20 0 FAADRP CC[N@@H+]1CC[C@H](N(C)C(=O)C(=O)N2CCN3C(=O)[C@H]([NH3+])C[C@@H]3C2)[C@H](C)C1 ZINC000595983371 482837400 /nfs/dbraw/zinc/83/74/00/482837400.db2.gz XTDFEJMRVDTEAK-TUVASFSCSA-N 2 0 365.478 -1.055 20 0 FAADRP CC[N@@H+]1CC[C@H](N(C)C(=O)C(=O)N2CCN3C(=O)[C@H]([NH3+])C[C@H]3C2)[C@@H](C)C1 ZINC000595983372 482837256 /nfs/dbraw/zinc/83/72/56/482837256.db2.gz XTDFEJMRVDTEAK-XQLPTFJDSA-N 2 0 365.478 -1.055 20 0 FAADRP CC[N@@H+]1CC[C@H](N(C)C(=O)C(=O)N2CCN3C(=O)[C@H]([NH3+])C[C@@H]3C2)[C@@H](C)C1 ZINC000595983373 482837871 /nfs/dbraw/zinc/83/78/71/482837871.db2.gz XTDFEJMRVDTEAK-YJNKXOJESA-N 2 0 365.478 -1.055 20 0 FAADRP CN(CC[NH+]1CCCCC1)C(=O)C(=O)N1CCN2C(=O)[C@@H]([NH3+])C[C@H]2C1 ZINC000595983478 482837446 /nfs/dbraw/zinc/83/74/46/482837446.db2.gz PAGSVNDKLHMITC-KBPBESRZSA-N 2 0 351.451 -1.299 20 0 FAADRP CN(CC[NH+]1CCCCC1)C(=O)C(=O)N1CCN2C(=O)[C@@H]([NH3+])C[C@@H]2C1 ZINC000595983479 482836535 /nfs/dbraw/zinc/83/65/35/482836535.db2.gz PAGSVNDKLHMITC-KGLIPLIRSA-N 2 0 351.451 -1.299 20 0 FAADRP CN(CC[NH+]1CCCCC1)C(=O)C(=O)N1CCN2C(=O)[C@H]([NH3+])C[C@H]2C1 ZINC000595983480 482837046 /nfs/dbraw/zinc/83/70/46/482837046.db2.gz PAGSVNDKLHMITC-UONOGXRCSA-N 2 0 351.451 -1.299 20 0 FAADRP CN(CC[NH+]1CCCCC1)C(=O)C(=O)N1CCN2C(=O)[C@H]([NH3+])C[C@@H]2C1 ZINC000595983482 482837181 /nfs/dbraw/zinc/83/71/81/482837181.db2.gz PAGSVNDKLHMITC-ZIAGYGMSSA-N 2 0 351.451 -1.299 20 0 FAADRP [NH3+][C@H]1C[C@@H]2CN(C(=O)C(=O)N3CCN(c4cc[nH+]cc4)CC3)CCN2C1=O ZINC000595984943 482838720 /nfs/dbraw/zinc/83/87/20/482838720.db2.gz FNHDLOCJQVRRKH-CABCVRRESA-N 2 0 372.429 -1.499 20 0 FAADRP [NH3+][C@H]1C[C@H]2CN(C(=O)C(=O)N3CCN(c4cc[nH+]cc4)CC3)CCN2C1=O ZINC000595985022 482839612 /nfs/dbraw/zinc/83/96/12/482839612.db2.gz FNHDLOCJQVRRKH-GJZGRUSLSA-N 2 0 372.429 -1.499 20 0 FAADRP [NH3+][C@@H]1C[C@@H]2CN(C(=O)C(=O)N3CCN(c4cc[nH+]cc4)CC3)CCN2C1=O ZINC000595985027 482839807 /nfs/dbraw/zinc/83/98/07/482839807.db2.gz FNHDLOCJQVRRKH-HUUCEWRRSA-N 2 0 372.429 -1.499 20 0 FAADRP [NH3+][C@@H]1C[C@H]2CN(C(=O)C(=O)N3CCN(c4cc[nH+]cc4)CC3)CCN2C1=O ZINC000595985037 482839168 /nfs/dbraw/zinc/83/91/68/482839168.db2.gz FNHDLOCJQVRRKH-LSDHHAIUSA-N 2 0 372.429 -1.499 20 0 FAADRP C[NH+](C)CCN(CC[NH+](C)C)C(=O)C(=O)N1CCN2C(=O)[C@@H]([NH3+])C[C@H]2C1 ZINC000595986255 482838553 /nfs/dbraw/zinc/83/85/53/482838553.db2.gz GQWLZXSCIYMLHH-KBPBESRZSA-N 3 0 368.482 -2.291 20 0 FAADRP C[NH+](C)CCN(CC[NH+](C)C)C(=O)C(=O)N1CCN2C(=O)[C@@H]([NH3+])C[C@@H]2C1 ZINC000595986256 482838511 /nfs/dbraw/zinc/83/85/11/482838511.db2.gz GQWLZXSCIYMLHH-KGLIPLIRSA-N 3 0 368.482 -2.291 20 0 FAADRP C[NH+](C)CCN(CC[NH+](C)C)C(=O)C(=O)N1CCN2C(=O)[C@H]([NH3+])C[C@H]2C1 ZINC000595986257 482839596 /nfs/dbraw/zinc/83/95/96/482839596.db2.gz GQWLZXSCIYMLHH-UONOGXRCSA-N 3 0 368.482 -2.291 20 0 FAADRP C[NH+](C)CCN(CC[NH+](C)C)C(=O)C(=O)N1CCN2C(=O)[C@H]([NH3+])C[C@@H]2C1 ZINC000595986258 482839852 /nfs/dbraw/zinc/83/98/52/482839852.db2.gz GQWLZXSCIYMLHH-ZIAGYGMSSA-N 3 0 368.482 -2.291 20 0 FAADRP CC[NH+](CC)[C@@H]1CCN(C(=O)C(=O)N2CCN3C(=O)[C@H]([NH3+])C[C@H]3C2)C1 ZINC000595986552 482839086 /nfs/dbraw/zinc/83/90/86/482839086.db2.gz HUVPVUHLHMISQE-HZSPNIEDSA-N 2 0 351.451 -1.301 20 0 FAADRP CC[NH+](CC)[C@@H]1CCN(C(=O)C(=O)N2CCN3C(=O)[C@@H]([NH3+])C[C@@H]3C2)C1 ZINC000595986553 482839367 /nfs/dbraw/zinc/83/93/67/482839367.db2.gz HUVPVUHLHMISQE-MCIONIFRSA-N 2 0 351.451 -1.301 20 0 FAADRP CC[NH+](CC)[C@@H]1CCN(C(=O)C(=O)N2CCN3C(=O)[C@H]([NH3+])C[C@@H]3C2)C1 ZINC000595986554 482839770 /nfs/dbraw/zinc/83/97/70/482839770.db2.gz HUVPVUHLHMISQE-MGPQQGTHSA-N 2 0 351.451 -1.301 20 0 FAADRP CC[NH+](CC)[C@@H]1CCN(C(=O)C(=O)N2CCN3C(=O)[C@@H]([NH3+])C[C@H]3C2)C1 ZINC000595986556 482839045 /nfs/dbraw/zinc/83/90/45/482839045.db2.gz HUVPVUHLHMISQE-RDBSUJKOSA-N 2 0 351.451 -1.301 20 0 FAADRP [NH3+][C@H]1C[C@@H]2CN(C(=O)C(=O)N3CC[NH+](C4CCCC4)CC3)CCN2C1=O ZINC000595986671 482839552 /nfs/dbraw/zinc/83/95/52/482839552.db2.gz JNBHDPXBOHFLKN-CABCVRRESA-N 2 0 363.462 -1.156 20 0 FAADRP [NH3+][C@H]1C[C@H]2CN(C(=O)C(=O)N3CC[NH+](C4CCCC4)CC3)CCN2C1=O ZINC000595986672 482839241 /nfs/dbraw/zinc/83/92/41/482839241.db2.gz JNBHDPXBOHFLKN-GJZGRUSLSA-N 2 0 363.462 -1.156 20 0 FAADRP [NH3+][C@@H]1C[C@@H]2CN(C(=O)C(=O)N3CC[NH+](C4CCCC4)CC3)CCN2C1=O ZINC000595986673 482839437 /nfs/dbraw/zinc/83/94/37/482839437.db2.gz JNBHDPXBOHFLKN-HUUCEWRRSA-N 2 0 363.462 -1.156 20 0 FAADRP [NH3+][C@@H]1C[C@H]2CN(C(=O)C(=O)N3CC[NH+](C4CCCC4)CC3)CCN2C1=O ZINC000595986674 482839224 /nfs/dbraw/zinc/83/92/24/482839224.db2.gz JNBHDPXBOHFLKN-LSDHHAIUSA-N 2 0 363.462 -1.156 20 0 FAADRP [NH3+][C@@H]1C[C@H]2CN(C(=O)C(=O)N3CC[C@H](C[NH+]4CCCC4)C3)CCN2C1=O ZINC000595986852 482839884 /nfs/dbraw/zinc/83/98/84/482839884.db2.gz IANPHZJONKZAES-QLFBSQMISA-N 2 0 363.462 -1.299 20 0 FAADRP [NH3+][C@@H]1C[C@@H]2CN(C(=O)C(=O)N3CC[C@H](C[NH+]4CCCC4)C3)CCN2C1=O ZINC000595986853 482838870 /nfs/dbraw/zinc/83/88/70/482838870.db2.gz IANPHZJONKZAES-RBSFLKMASA-N 2 0 363.462 -1.299 20 0 FAADRP [NH3+][C@@H]1C[C@@H]2CN(C(=O)C(=O)N3CC[C@@H](C[NH+]4CCCC4)C3)CCN2C1=O ZINC000595986854 482839681 /nfs/dbraw/zinc/83/96/81/482839681.db2.gz IANPHZJONKZAES-RRFJBIMHSA-N 2 0 363.462 -1.299 20 0 FAADRP [NH3+][C@@H]1C[C@H]2CN(C(=O)C(=O)N3CC[C@@H](C[NH+]4CCCC4)C3)CCN2C1=O ZINC000595986855 482839279 /nfs/dbraw/zinc/83/92/79/482839279.db2.gz IANPHZJONKZAES-SOUVJXGZSA-N 2 0 363.462 -1.299 20 0 FAADRP COCCN(CC[NH+](C)C)C(=O)C(=O)N1CCN2C(=O)[C@H]([NH3+])C[C@@H]2C1 ZINC000595986860 482839132 /nfs/dbraw/zinc/83/91/32/482839132.db2.gz ICKLAMPTZILZAT-CHWSQXEVSA-N 2 0 355.439 -2.207 20 0 FAADRP COCCN(CC[NH+](C)C)C(=O)C(=O)N1CCN2C(=O)[C@@H]([NH3+])C[C@@H]2C1 ZINC000595986861 482839708 /nfs/dbraw/zinc/83/97/08/482839708.db2.gz ICKLAMPTZILZAT-OLZOCXBDSA-N 2 0 355.439 -2.207 20 0 FAADRP COCCN(CC[NH+](C)C)C(=O)C(=O)N1CCN2C(=O)[C@H]([NH3+])C[C@H]2C1 ZINC000595986862 482838663 /nfs/dbraw/zinc/83/86/63/482838663.db2.gz ICKLAMPTZILZAT-QWHCGFSZSA-N 2 0 355.439 -2.207 20 0 FAADRP COCCN(CC[NH+](C)C)C(=O)C(=O)N1CCN2C(=O)[C@@H]([NH3+])C[C@H]2C1 ZINC000595986863 482839976 /nfs/dbraw/zinc/83/99/76/482839976.db2.gz ICKLAMPTZILZAT-STQMWFEESA-N 2 0 355.439 -2.207 20 0 FAADRP CN(CC1CC[NH+](C)CC1)C(=O)C(=O)N1CCN2C(=O)[C@@H]([NH3+])C[C@H]2C1 ZINC000595986896 482839324 /nfs/dbraw/zinc/83/93/24/482839324.db2.gz IRPNXXRAGXUDPQ-KBPBESRZSA-N 2 0 351.451 -1.443 20 0 FAADRP CN(CC1CC[NH+](C)CC1)C(=O)C(=O)N1CCN2C(=O)[C@@H]([NH3+])C[C@@H]2C1 ZINC000595986897 482839407 /nfs/dbraw/zinc/83/94/07/482839407.db2.gz IRPNXXRAGXUDPQ-KGLIPLIRSA-N 2 0 351.451 -1.443 20 0 FAADRP CN(CC1CC[NH+](C)CC1)C(=O)C(=O)N1CCN2C(=O)[C@H]([NH3+])C[C@H]2C1 ZINC000595986898 482839920 /nfs/dbraw/zinc/83/99/20/482839920.db2.gz IRPNXXRAGXUDPQ-UONOGXRCSA-N 2 0 351.451 -1.443 20 0 FAADRP CN(CC1CC[NH+](C)CC1)C(=O)C(=O)N1CCN2C(=O)[C@H]([NH3+])C[C@@H]2C1 ZINC000595986899 482839094 /nfs/dbraw/zinc/83/90/94/482839094.db2.gz IRPNXXRAGXUDPQ-ZIAGYGMSSA-N 2 0 351.451 -1.443 20 0 FAADRP CN(C[C@H]1CCC[N@H+](C)C1)C(=O)C(=O)N1CCN2C(=O)[C@H]([NH3+])C[C@@H]2C1 ZINC000595987162 482838887 /nfs/dbraw/zinc/83/88/87/482838887.db2.gz JXEIYALFQHISQL-BFHYXJOUSA-N 2 0 351.451 -1.443 20 0 FAADRP CN(C[C@H]1CCC[N@H+](C)C1)C(=O)C(=O)N1CCN2C(=O)[C@@H]([NH3+])C[C@H]2C1 ZINC000595987164 482838471 /nfs/dbraw/zinc/83/84/71/482838471.db2.gz JXEIYALFQHISQL-IHRRRGAJSA-N 2 0 351.451 -1.443 20 0 FAADRP CN(C[C@H]1CCC[N@H+](C)C1)C(=O)C(=O)N1CCN2C(=O)[C@H]([NH3+])C[C@H]2C1 ZINC000595987167 482838525 /nfs/dbraw/zinc/83/85/25/482838525.db2.gz JXEIYALFQHISQL-MELADBBJSA-N 2 0 351.451 -1.443 20 0 FAADRP CN(C[C@H]1CCC[N@H+](C)C1)C(=O)C(=O)N1CCN2C(=O)[C@@H]([NH3+])C[C@@H]2C1 ZINC000595987169 482839148 /nfs/dbraw/zinc/83/91/48/482839148.db2.gz JXEIYALFQHISQL-MJBXVCDLSA-N 2 0 351.451 -1.443 20 0 FAADRP CC(C)CN(CC[NH+](C)C)C(=O)C(=O)N1CCN2C(=O)[C@@H]([NH3+])C[C@H]2C1 ZINC000595988565 482840595 /nfs/dbraw/zinc/84/05/95/482840595.db2.gz PHTRLRIEBNKJFS-KBPBESRZSA-N 2 0 353.467 -1.197 20 0 FAADRP CC(C)CN(CC[NH+](C)C)C(=O)C(=O)N1CCN2C(=O)[C@@H]([NH3+])C[C@@H]2C1 ZINC000595988569 482840554 /nfs/dbraw/zinc/84/05/54/482840554.db2.gz PHTRLRIEBNKJFS-KGLIPLIRSA-N 2 0 353.467 -1.197 20 0 FAADRP CC(C)CN(CC[NH+](C)C)C(=O)C(=O)N1CCN2C(=O)[C@H]([NH3+])C[C@H]2C1 ZINC000595988571 482841446 /nfs/dbraw/zinc/84/14/46/482841446.db2.gz PHTRLRIEBNKJFS-UONOGXRCSA-N 2 0 353.467 -1.197 20 0 FAADRP CC(C)CN(CC[NH+](C)C)C(=O)C(=O)N1CCN2C(=O)[C@H]([NH3+])C[C@@H]2C1 ZINC000595988573 482840836 /nfs/dbraw/zinc/84/08/36/482840836.db2.gz PHTRLRIEBNKJFS-ZIAGYGMSSA-N 2 0 353.467 -1.197 20 0 FAADRP CN(CC1([NH+](C)C)CCC1)C(=O)C(=O)N1CCN2C(=O)[C@H]([NH3+])C[C@@H]2C1 ZINC000595990360 482840848 /nfs/dbraw/zinc/84/08/48/482840848.db2.gz QEMKOMSOSNJOQA-CHWSQXEVSA-N 2 0 351.451 -1.301 20 0 FAADRP CN(CC1([NH+](C)C)CCC1)C(=O)C(=O)N1CCN2C(=O)[C@@H]([NH3+])C[C@@H]2C1 ZINC000595990361 482841870 /nfs/dbraw/zinc/84/18/70/482841870.db2.gz QEMKOMSOSNJOQA-OLZOCXBDSA-N 2 0 351.451 -1.301 20 0 FAADRP CN(CC1([NH+](C)C)CCC1)C(=O)C(=O)N1CCN2C(=O)[C@H]([NH3+])C[C@H]2C1 ZINC000595990362 482840994 /nfs/dbraw/zinc/84/09/94/482840994.db2.gz QEMKOMSOSNJOQA-QWHCGFSZSA-N 2 0 351.451 -1.301 20 0 FAADRP CN(CC1([NH+](C)C)CCC1)C(=O)C(=O)N1CCN2C(=O)[C@@H]([NH3+])C[C@H]2C1 ZINC000595990364 482841608 /nfs/dbraw/zinc/84/16/08/482841608.db2.gz QEMKOMSOSNJOQA-STQMWFEESA-N 2 0 351.451 -1.301 20 0 FAADRP CC(C)[NH2+][C@@H]1CCCN(C(=O)C(=O)N2CCN3C(=O)[C@H]([NH3+])C[C@H]3C2)C1 ZINC000595991321 482840524 /nfs/dbraw/zinc/84/05/24/482840524.db2.gz RXZAVFABZFRTBO-HZSPNIEDSA-N 2 0 351.451 -1.254 20 0 FAADRP CC(C)[NH2+][C@@H]1CCCN(C(=O)C(=O)N2CCN3C(=O)[C@@H]([NH3+])C[C@@H]3C2)C1 ZINC000595991322 482840954 /nfs/dbraw/zinc/84/09/54/482840954.db2.gz RXZAVFABZFRTBO-MCIONIFRSA-N 2 0 351.451 -1.254 20 0 FAADRP CC(C)[NH2+][C@@H]1CCCN(C(=O)C(=O)N2CCN3C(=O)[C@H]([NH3+])C[C@@H]3C2)C1 ZINC000595991323 482841011 /nfs/dbraw/zinc/84/10/11/482841011.db2.gz RXZAVFABZFRTBO-MGPQQGTHSA-N 2 0 351.451 -1.254 20 0 FAADRP CC(C)[NH2+][C@@H]1CCCN(C(=O)C(=O)N2CCN3C(=O)[C@@H]([NH3+])C[C@H]3C2)C1 ZINC000595991324 482840615 /nfs/dbraw/zinc/84/06/15/482840615.db2.gz RXZAVFABZFRTBO-RDBSUJKOSA-N 2 0 351.451 -1.254 20 0 FAADRP [NH3+][C@@H]1C[C@H]2CN(C(=O)C(=O)N3CC[C@@H]([NH+]4CCCCC4)C3)CCN2C1=O ZINC000595991483 482840789 /nfs/dbraw/zinc/84/07/89/482840789.db2.gz NCRWCARYFFGUMR-QLFBSQMISA-N 2 0 363.462 -1.156 20 0 FAADRP [NH3+][C@@H]1C[C@@H]2CN(C(=O)C(=O)N3CC[C@@H]([NH+]4CCCCC4)C3)CCN2C1=O ZINC000595991484 482840913 /nfs/dbraw/zinc/84/09/13/482840913.db2.gz NCRWCARYFFGUMR-RBSFLKMASA-N 2 0 363.462 -1.156 20 0 FAADRP [NH3+][C@@H]1C[C@@H]2CN(C(=O)C(=O)N3CC[C@H]([NH+]4CCCCC4)C3)CCN2C1=O ZINC000595991485 482841156 /nfs/dbraw/zinc/84/11/56/482841156.db2.gz NCRWCARYFFGUMR-RRFJBIMHSA-N 2 0 363.462 -1.156 20 0 FAADRP [NH3+][C@@H]1C[C@H]2CN(C(=O)C(=O)N3CC[C@H]([NH+]4CCCCC4)C3)CCN2C1=O ZINC000595991486 482840627 /nfs/dbraw/zinc/84/06/27/482840627.db2.gz NCRWCARYFFGUMR-SOUVJXGZSA-N 2 0 363.462 -1.156 20 0 FAADRP CC[C@@H]1C[N@@H+]2CCC[C@@H]2CN1C(=O)C(=O)N1CCN2C(=O)[C@H]([NH3+])C[C@H]2C1 ZINC000595992058 482843993 /nfs/dbraw/zinc/84/39/93/482843993.db2.gz PSUAXPACYWYTDX-APIJFGDWSA-N 2 0 363.462 -1.158 20 0 FAADRP CC[C@@H]1C[N@@H+]2CCC[C@@H]2CN1C(=O)C(=O)N1CCN2C(=O)[C@H]([NH3+])C[C@@H]2C1 ZINC000595992060 482843223 /nfs/dbraw/zinc/84/32/23/482843223.db2.gz PSUAXPACYWYTDX-KBUPBQIOSA-N 2 0 363.462 -1.158 20 0 FAADRP CC[C@@H]1C[N@@H+]2CCC[C@@H]2CN1C(=O)C(=O)N1CCN2C(=O)[C@@H]([NH3+])C[C@H]2C1 ZINC000595992062 482843319 /nfs/dbraw/zinc/84/33/19/482843319.db2.gz PSUAXPACYWYTDX-KBXIAJHMSA-N 2 0 363.462 -1.158 20 0 FAADRP CC[C@@H]1C[N@@H+]2CCC[C@@H]2CN1C(=O)C(=O)N1CCN2C(=O)[C@@H]([NH3+])C[C@@H]2C1 ZINC000595992063 482843363 /nfs/dbraw/zinc/84/33/63/482843363.db2.gz PSUAXPACYWYTDX-TUVASFSCSA-N 2 0 363.462 -1.158 20 0 FAADRP CN(CCC[NH+]1CCCC1)C(=O)C(=O)N1CCN2C(=O)[C@@H]([NH3+])C[C@H]2C1 ZINC000595993704 482843957 /nfs/dbraw/zinc/84/39/57/482843957.db2.gz UAMQRVTYCOSMCB-KBPBESRZSA-N 2 0 351.451 -1.299 20 0 FAADRP CN(CCC[NH+]1CCCC1)C(=O)C(=O)N1CCN2C(=O)[C@@H]([NH3+])C[C@@H]2C1 ZINC000595993705 482843433 /nfs/dbraw/zinc/84/34/33/482843433.db2.gz UAMQRVTYCOSMCB-KGLIPLIRSA-N 2 0 351.451 -1.299 20 0 FAADRP CN(CCC[NH+]1CCCC1)C(=O)C(=O)N1CCN2C(=O)[C@H]([NH3+])C[C@H]2C1 ZINC000595993706 482843514 /nfs/dbraw/zinc/84/35/14/482843514.db2.gz UAMQRVTYCOSMCB-UONOGXRCSA-N 2 0 351.451 -1.299 20 0 FAADRP CN(CCC[NH+]1CCCC1)C(=O)C(=O)N1CCN2C(=O)[C@H]([NH3+])C[C@@H]2C1 ZINC000595993708 482842825 /nfs/dbraw/zinc/84/28/25/482842825.db2.gz UAMQRVTYCOSMCB-ZIAGYGMSSA-N 2 0 351.451 -1.299 20 0 FAADRP C[NH+](C)C[C@@H]1CN(C(=O)C(=O)N2CCN3C(=O)[C@H]([NH3+])C[C@@H]3C2)CCO1 ZINC000595995786 482843388 /nfs/dbraw/zinc/84/33/88/482843388.db2.gz XCLQOJPSFLHUKS-JHJVBQTASA-N 2 0 353.423 -2.454 20 0 FAADRP C[NH+](C)C[C@@H]1CN(C(=O)C(=O)N2CCN3C(=O)[C@@H]([NH3+])C[C@@H]3C2)CCO1 ZINC000595995787 482842988 /nfs/dbraw/zinc/84/29/88/482842988.db2.gz XCLQOJPSFLHUKS-UPJWGTAASA-N 2 0 353.423 -2.454 20 0 FAADRP C[NH+](C)C[C@@H]1CN(C(=O)C(=O)N2CCN3C(=O)[C@@H]([NH3+])C[C@H]3C2)CCO1 ZINC000595995788 482843124 /nfs/dbraw/zinc/84/31/24/482843124.db2.gz XCLQOJPSFLHUKS-XQQFMLRXSA-N 2 0 353.423 -2.454 20 0 FAADRP C[NH+](C)C[C@@H]1CN(C(=O)C(=O)N2CCN3C(=O)[C@H]([NH3+])C[C@H]3C2)CCO1 ZINC000595995789 482843257 /nfs/dbraw/zinc/84/32/57/482843257.db2.gz XCLQOJPSFLHUKS-YNEHKIRRSA-N 2 0 353.423 -2.454 20 0 FAADRP CO[C@H]1C[C@@H](CN(C)C(=O)C(=O)N2CCN3C(=O)[C@@H]([NH3+])C[C@@H]3C2)[N@H+](C)C1 ZINC000595999194 482843100 /nfs/dbraw/zinc/84/31/00/482843100.db2.gz MVEGWDJNXONJLG-CRWXNKLISA-N 2 0 367.450 -2.066 20 0 FAADRP CO[C@H]1C[C@@H](CN(C)C(=O)C(=O)N2CCN3C(=O)[C@H]([NH3+])C[C@@H]3C2)[N@H+](C)C1 ZINC000595999195 482843146 /nfs/dbraw/zinc/84/31/46/482843146.db2.gz MVEGWDJNXONJLG-RFQIPJPRSA-N 2 0 367.450 -2.066 20 0 FAADRP CO[C@H]1C[C@@H](CN(C)C(=O)C(=O)N2CCN3C(=O)[C@H]([NH3+])C[C@H]3C2)[N@H+](C)C1 ZINC000595999196 482843873 /nfs/dbraw/zinc/84/38/73/482843873.db2.gz MVEGWDJNXONJLG-XDQVBPFNSA-N 2 0 367.450 -2.066 20 0 FAADRP CO[C@H]1C[C@@H](CN(C)C(=O)C(=O)N2CCN3C(=O)[C@@H]([NH3+])C[C@H]3C2)[N@H+](C)C1 ZINC000595999197 482843444 /nfs/dbraw/zinc/84/34/44/482843444.db2.gz MVEGWDJNXONJLG-XUXIUFHCSA-N 2 0 367.450 -2.066 20 0 FAADRP C[N@@H+]1CCC[C@]2(CCN(C(=O)C(=O)N3CCN4C(=O)[C@@H]([NH3+])C[C@H]4C3)C2)C1 ZINC000596000691 482834271 /nfs/dbraw/zinc/83/42/71/482834271.db2.gz NMHAXVFZEVHROF-DEYYWGMASA-N 2 0 363.462 -1.299 20 0 FAADRP C[N@@H+]1CCC[C@]2(CCN(C(=O)C(=O)N3CCN4C(=O)[C@@H]([NH3+])C[C@@H]4C3)C2)C1 ZINC000596000693 482833725 /nfs/dbraw/zinc/83/37/25/482833725.db2.gz NMHAXVFZEVHROF-GLJUWKHASA-N 2 0 363.462 -1.299 20 0 FAADRP C[N@@H+]1CCC[C@]2(CCN(C(=O)C(=O)N3CCN4C(=O)[C@H]([NH3+])C[C@H]4C3)C2)C1 ZINC000596000694 482834348 /nfs/dbraw/zinc/83/43/48/482834348.db2.gz NMHAXVFZEVHROF-IYOUNJFTSA-N 2 0 363.462 -1.299 20 0 FAADRP C[N@@H+]1CCC[C@]2(CCN(C(=O)C(=O)N3CCN4C(=O)[C@H]([NH3+])C[C@@H]4C3)C2)C1 ZINC000596000695 482833857 /nfs/dbraw/zinc/83/38/57/482833857.db2.gz NMHAXVFZEVHROF-LBTNJELSSA-N 2 0 363.462 -1.299 20 0 FAADRP C[NH+](C)CC1CCN(C(=O)C(=O)N2CCN3C(=O)[C@@H]([NH3+])C[C@H]3C2)CC1 ZINC000596005151 482833845 /nfs/dbraw/zinc/83/38/45/482833845.db2.gz VBDMEBXSQKVMGS-KBPBESRZSA-N 2 0 351.451 -1.443 20 0 FAADRP C[NH+](C)CC1CCN(C(=O)C(=O)N2CCN3C(=O)[C@@H]([NH3+])C[C@@H]3C2)CC1 ZINC000596005153 482834296 /nfs/dbraw/zinc/83/42/96/482834296.db2.gz VBDMEBXSQKVMGS-KGLIPLIRSA-N 2 0 351.451 -1.443 20 0 FAADRP C[NH+](C)CC1CCN(C(=O)C(=O)N2CCN3C(=O)[C@H]([NH3+])C[C@H]3C2)CC1 ZINC000596005154 482834387 /nfs/dbraw/zinc/83/43/87/482834387.db2.gz VBDMEBXSQKVMGS-UONOGXRCSA-N 2 0 351.451 -1.443 20 0 FAADRP C[NH+](C)CC1CCN(C(=O)C(=O)N2CCN3C(=O)[C@H]([NH3+])C[C@@H]3C2)CC1 ZINC000596005155 482833545 /nfs/dbraw/zinc/83/35/45/482833545.db2.gz VBDMEBXSQKVMGS-ZIAGYGMSSA-N 2 0 351.451 -1.443 20 0 FAADRP CN(C(=O)C1(C(N)=O)CC1)C1CCN(CC(=O)N2CCN(C)CC2)CC1 ZINC000597779738 482853257 /nfs/dbraw/zinc/85/32/57/482853257.db2.gz CTTWDUBEWCNARJ-UHFFFAOYSA-N 2 0 365.478 -1.051 20 0 FAADRP CC[NH+]1CCN([C@H]2CCN(C(=O)C(=O)N(C)CCOCC[NH2+]C)C2)CC1 ZINC000600798813 482649523 /nfs/dbraw/zinc/64/95/23/482649523.db2.gz WICUBUHWWWIJNI-INIZCTEOSA-N 2 0 369.510 -1.081 20 0 FAADRP CC[NH+]1CCN([C@@H]2CCN(C(=O)C(=O)N(C)CCOCC[NH2+]C)C2)CC1 ZINC000600798814 482649646 /nfs/dbraw/zinc/64/96/46/482649646.db2.gz WICUBUHWWWIJNI-MRXNPFEDSA-N 2 0 369.510 -1.081 20 0 FAADRP COC(=O)CN(CCN1CC[NH+](C)CC1)S(=O)(=O)CCC[NH+](C)C ZINC000601409124 482783528 /nfs/dbraw/zinc/78/35/28/482783528.db2.gz JPMCDBVFRUUSDI-UHFFFAOYSA-N 2 0 364.512 -1.010 20 0 FAADRP C[S@@](=O)C1(C(=O)N2CCN(C(=O)N3CC[NH2+]CC3)CC2)CC[NH2+]CC1 ZINC000602530016 482881853 /nfs/dbraw/zinc/88/18/53/482881853.db2.gz RDCBTQBDQNTBIZ-RUZDIDTESA-N 2 0 371.507 -1.344 20 0 FAADRP C[S@](=O)C1(C(=O)N2CCN(C(=O)N3CC[NH2+]CC3)CC2)CC[NH2+]CC1 ZINC000602530131 482881356 /nfs/dbraw/zinc/88/13/56/482881356.db2.gz RDCBTQBDQNTBIZ-VWLOTQADSA-N 2 0 371.507 -1.344 20 0 FAADRP O=C(C[NH+]1CCC[C@@H](O)C1)N1CCN(C(=O)C[N@H+]2CCC[C@@H](O)C2)CC1 ZINC000612096333 483329112 /nfs/dbraw/zinc/32/91/12/483329112.db2.gz GWKFUEOHKIYJOK-HZPDHXFCSA-N 2 0 368.478 -1.429 20 0 FAADRP CCC[N@@H+]1CC[C@H](NC(=O)C(=O)N2CCN(CC[NH+](C)C)C(=O)C2)C1 ZINC000612543349 483339444 /nfs/dbraw/zinc/33/94/44/483339444.db2.gz PAYVWHYIVKIJIG-AWEZNQCLSA-N 2 0 353.467 -1.181 20 0 FAADRP CCC[N@@H+]1CC[C@@H](NC(=O)C(=O)N2CCN(CC[NH+](C)C)C(=O)C2)C1 ZINC000612543350 483339273 /nfs/dbraw/zinc/33/92/73/483339273.db2.gz PAYVWHYIVKIJIG-CQSZACIVSA-N 2 0 353.467 -1.181 20 0 FAADRP CC1[C@H](C(=O)NC[C@@](C)(O)C[NH+](C)C)[C@H]1C(=O)NC[C@@](C)(O)C[NH+](C)C ZINC000612870876 483341742 /nfs/dbraw/zinc/34/17/42/483341742.db2.gz IWNGCFMXPMXUEK-LBTBCDHLSA-N 2 0 372.510 -1.274 20 0 FAADRP C[C@@H]1[C@H](C(=O)NC[C@@](C)(O)C[NH+](C)C)[C@H]1C(=O)NC[C@](C)(O)C[NH+](C)C ZINC000612870881 483342046 /nfs/dbraw/zinc/34/20/46/483342046.db2.gz IWNGCFMXPMXUEK-TZUPDSNESA-N 2 0 372.510 -1.274 20 0 FAADRP CC1[C@H](C(=O)NC[C@](C)(O)C[NH+](C)C)[C@H]1C(=O)NC[C@](C)(O)C[NH+](C)C ZINC000612870882 483341771 /nfs/dbraw/zinc/34/17/71/483341771.db2.gz IWNGCFMXPMXUEK-USJZOSNVSA-N 2 0 372.510 -1.274 20 0 FAADRP CC1[C@H](C(=O)NC[C@]2(O)CC[NH+](C)C2)[C@H]1C(=O)NC[C@]1(O)CC[N@H+](C)C1 ZINC000613522985 483538252 /nfs/dbraw/zinc/53/82/52/483538252.db2.gz PVHKJVOAJHVXLM-LBTBCDHLSA-N 2 0 368.478 -1.766 20 0 FAADRP C[C@H]1[C@H](C(=O)NC[C@]2(O)CC[NH+](C)C2)[C@H]1C(=O)NC[C@@]1(O)CC[N@H+](C)C1 ZINC000613522986 483537877 /nfs/dbraw/zinc/53/78/77/483537877.db2.gz PVHKJVOAJHVXLM-PUMWCKSCSA-N 2 0 368.478 -1.766 20 0 FAADRP CC1[C@H](C(=O)NC[C@@]2(O)CC[NH+](C)C2)[C@H]1C(=O)NC[C@@]1(O)CC[N@H+](C)C1 ZINC000613522987 483538204 /nfs/dbraw/zinc/53/82/04/483538204.db2.gz PVHKJVOAJHVXLM-USJZOSNVSA-N 2 0 368.478 -1.766 20 0 FAADRP C[NH+](C)C[C@H](CO)NC(=O)c1ccc(C(=O)N[C@H](CO)C[NH+](C)C)o1 ZINC000614845352 483558591 /nfs/dbraw/zinc/55/85/91/483558591.db2.gz CJSDJAVUQIJALT-TXEJJXNPSA-N 2 0 356.423 -1.416 20 0 FAADRP C[NH+](C)C[C@@H](CO)NC(=O)c1ccc(C(=O)N[C@H](CO)C[NH+](C)C)nc1 ZINC000614845728 483558366 /nfs/dbraw/zinc/55/83/66/483558366.db2.gz DTBJLNKERAYANX-KBPBESRZSA-N 2 0 367.450 -1.614 20 0 FAADRP C[NH+](C)C[C@H](CO)NC(=O)c1ccc(C(=O)N[C@H](CO)C[NH+](C)C)nc1 ZINC000614845733 483559567 /nfs/dbraw/zinc/55/95/67/483559567.db2.gz DTBJLNKERAYANX-KGLIPLIRSA-N 2 0 367.450 -1.614 20 0 FAADRP C[NH+](C)C[C@H](CO)NC(=O)c1ccc(C(=O)N[C@H](CO)C[NH+](C)C)cn1 ZINC000614845735 483560095 /nfs/dbraw/zinc/56/00/95/483560095.db2.gz DTBJLNKERAYANX-UONOGXRCSA-N 2 0 367.450 -1.614 20 0 FAADRP C[NH+](C)C[C@H](CO)NC(=O)c1ccc(C(=O)N[C@@H](CO)C[NH+](C)C)nc1 ZINC000614845737 483560477 /nfs/dbraw/zinc/56/04/77/483560477.db2.gz DTBJLNKERAYANX-ZIAGYGMSSA-N 2 0 367.450 -1.614 20 0 FAADRP C[NH+](C)C[C@@H](CO)NC(=O)c1cccc(C(=O)N[C@H](CO)C[NH+](C)C)c1 ZINC000614846188 483559616 /nfs/dbraw/zinc/55/96/16/483559616.db2.gz GRMHSNZOELJRLF-HOTGVXAUSA-N 2 0 366.462 -1.009 20 0 FAADRP C[NH+](C)C[C@H](CO)NC(=O)c1cccc(C(=O)N[C@@H](CO)C[NH+](C)C)c1 ZINC000614846189 483559951 /nfs/dbraw/zinc/55/99/51/483559951.db2.gz GRMHSNZOELJRLF-HZPDHXFCSA-N 2 0 366.462 -1.009 20 0 FAADRP C[NH+](C)C[C@H](CO)NC(=O)c1cccc(C(=O)N[C@H](CO)C[NH+](C)C)c1 ZINC000614846191 483560443 /nfs/dbraw/zinc/56/04/43/483560443.db2.gz GRMHSNZOELJRLF-IYBDPMFKSA-N 2 0 366.462 -1.009 20 0 FAADRP C[NH+](C)C[C@H](CO)NC(=O)c1cncc(C(=O)N[C@H](CO)C[NH+](C)C)c1 ZINC000614847447 483559689 /nfs/dbraw/zinc/55/96/89/483559689.db2.gz LPUVYEXMDKIYHE-GASCZTMLSA-N 2 0 367.450 -1.614 20 0 FAADRP C[NH+](C)C[C@@H](CO)NC(=O)c1cncc(C(=O)N[C@H](CO)C[NH+](C)C)c1 ZINC000614847449 483559513 /nfs/dbraw/zinc/55/95/13/483559513.db2.gz LPUVYEXMDKIYHE-GJZGRUSLSA-N 2 0 367.450 -1.614 20 0 FAADRP C[NH+](C)C[C@H](CO)NC(=O)c1cncc(C(=O)N[C@@H](CO)C[NH+](C)C)c1 ZINC000614847451 483560215 /nfs/dbraw/zinc/56/02/15/483560215.db2.gz LPUVYEXMDKIYHE-HUUCEWRRSA-N 2 0 367.450 -1.614 20 0 FAADRP C[C@@H]1C[C@@H](C(=O)N[C@@H](CO)C[NH+](C)C)[C@@H](C(=O)N[C@H](CO)C[NH+](C)C)C1 ZINC000614850675 483559770 /nfs/dbraw/zinc/55/97/70/483559770.db2.gz AXLXRIUZZBMBID-JGPUMOJJSA-N 2 0 372.510 -1.274 20 0 FAADRP C[C@@H]1C[C@H](C(=O)N[C@@H](CO)C[NH+](C)C)[C@@H](C(=O)N[C@H](CO)C[NH+](C)C)C1 ZINC000614850676 483559450 /nfs/dbraw/zinc/55/94/50/483559450.db2.gz AXLXRIUZZBMBID-QMHWVQJVSA-N 2 0 372.510 -1.274 20 0 FAADRP C[C@@H]1C[C@@H](C(=O)N[C@H](CO)C[NH+](C)C)[C@@H](C(=O)N[C@H](CO)C[NH+](C)C)C1 ZINC000614850677 483560201 /nfs/dbraw/zinc/56/02/01/483560201.db2.gz AXLXRIUZZBMBID-UVPYHEFZSA-N 2 0 372.510 -1.274 20 0 FAADRP CC1C[C@H](C(=O)N[C@H](CO)C[NH+](C)C)[C@@H](C(=O)N[C@H](CO)C[NH+](C)C)C1 ZINC000614850678 483559347 /nfs/dbraw/zinc/55/93/47/483559347.db2.gz AXLXRIUZZBMBID-VGWMRTNUSA-N 2 0 372.510 -1.274 20 0 FAADRP C[NH+](C)C[C@H](CO)NC(=O)[C@H]1CC[C@H](C(=O)N[C@@H](CO)C[NH+](C)C)CC1 ZINC000614851030 483559972 /nfs/dbraw/zinc/55/99/72/483559972.db2.gz DXFXCLLELKXMTC-KLHDSHLOSA-N 2 0 372.510 -1.130 20 0 FAADRP C[NH+](C)C[C@@H](CO)NC(=O)[C@H]1CC[C@H](C(=O)N[C@H](CO)C[NH+](C)C)CC1 ZINC000614851031 483561876 /nfs/dbraw/zinc/56/18/76/483561876.db2.gz DXFXCLLELKXMTC-VGWMRTNUSA-N 2 0 372.510 -1.130 20 0 FAADRP C[NH+](C)C[C@H](CO)NC(=O)[C@@H]1CC[C@@H](C(=O)N[C@H](CO)C[NH+](C)C)CC1 ZINC000614851032 483561765 /nfs/dbraw/zinc/56/17/65/483561765.db2.gz DXFXCLLELKXMTC-ZNNBLSDJSA-N 2 0 372.510 -1.130 20 0 FAADRP C[NH+](C)C[C@H](CO)NC(=O)c1cc(C(=O)N[C@@H](CO)C[NH+](C)C)[nH]n1 ZINC000614857710 483561424 /nfs/dbraw/zinc/56/14/24/483561424.db2.gz CYOOHJZUNZNQOU-GHMZBOCLSA-N 2 0 356.427 -2.286 20 0 FAADRP C[NH+](C)C[C@H](CO)NC(=O)c1cc(C(=O)N[C@H](CO)C[NH+](C)C)[nH]n1 ZINC000614857726 483561211 /nfs/dbraw/zinc/56/12/11/483561211.db2.gz CYOOHJZUNZNQOU-PHIMTYICSA-N 2 0 356.427 -2.286 20 0 FAADRP C[NH+](C)C[C@@H](CO)NC(=O)c1cc(C(=O)N[C@H](CO)C[NH+](C)C)[nH]n1 ZINC000614857728 483561487 /nfs/dbraw/zinc/56/14/87/483561487.db2.gz CYOOHJZUNZNQOU-QWRGUYRKSA-N 2 0 356.427 -2.286 20 0 FAADRP C[NH+](C)C[C@H](CO)NC(=O)[C@H]1CC[C@@H](C(=O)N[C@H](CO)C[NH+](C)C)O1 ZINC000614859158 483561794 /nfs/dbraw/zinc/56/17/94/483561794.db2.gz PIBVTBWMMUOZEP-KPWCQOOUSA-N 2 0 360.455 -2.389 20 0 FAADRP C[NH+](C)C[C@H](CO)NC(=O)[C@@H]1CC[C@H](C(=O)N[C@H](CO)C[NH+](C)C)O1 ZINC000614859159 483561317 /nfs/dbraw/zinc/56/13/17/483561317.db2.gz PIBVTBWMMUOZEP-LVEBTZEWSA-N 2 0 360.455 -2.389 20 0 FAADRP C[NH+](C)C[C@H](CO)NC(=O)[C@H]1CC[C@@H](C(=O)N[C@@H](CO)C[NH+](C)C)O1 ZINC000614859160 483561933 /nfs/dbraw/zinc/56/19/33/483561933.db2.gz PIBVTBWMMUOZEP-SYQHCUMBSA-N 2 0 360.455 -2.389 20 0 FAADRP C[NH+](C)C[C@@H](CO)NC(=O)[C@H]1CC[C@@H](C(=O)N[C@H](CO)C[NH+](C)C)O1 ZINC000614859161 483561131 /nfs/dbraw/zinc/56/11/31/483561131.db2.gz PIBVTBWMMUOZEP-XDQVBPFNSA-N 2 0 360.455 -2.389 20 0 FAADRP CC1[C@H](C(=O)N2C[C@H](O)[C@@H]([NH+](C)C)C2)[C@H]1C(=O)N1C[C@H](O)[C@@H]([NH+](C)C)C1 ZINC000615078611 483588916 /nfs/dbraw/zinc/58/89/16/483588916.db2.gz JZKQMRXAAWERDX-QNILMXGZSA-N 2 0 368.478 -1.865 20 0 FAADRP CN(C)C(=O)CN(CC[NH+](C)C)C(=O)[C@H]1CC(=O)N(CC[NH+](C)C)C1 ZINC000618306056 482703937 /nfs/dbraw/zinc/70/39/37/482703937.db2.gz RPJXTKPNQJNDRH-AWEZNQCLSA-N 2 0 355.483 -1.125 20 0 FAADRP CN(C)C(=O)CN(CC[NH+](C)C)C(=O)[C@@H]1CC(=O)N(CC[NH+](C)C)C1 ZINC000618306057 482703454 /nfs/dbraw/zinc/70/34/54/482703454.db2.gz RPJXTKPNQJNDRH-CQSZACIVSA-N 2 0 355.483 -1.125 20 0 FAADRP COc1nc(NCC[NH+]2CC[C@@H](O)C2)nc(NCC[N@@H+]2CC[C@@H](O)C2)n1 ZINC000624677318 482539668 /nfs/dbraw/zinc/53/96/68/482539668.db2.gz FBBWHXHFCHKVTG-CHWSQXEVSA-N 2 0 367.454 -2.319 20 0 FAADRP CNc1nc(NCC[NH+]2CC[C@@H](O)C2)nc(NCC[N@@H+]2CC[C@@H](O)C2)n1 ZINC000624677949 482538237 /nfs/dbraw/zinc/53/82/37/482538237.db2.gz BKFYFZQJONHWNE-CHWSQXEVSA-N 2 0 366.470 -2.864 20 0 FAADRP Cc1cnc(NCC[N@@H+]2CC[C@@H](O)C2)nc1NCC[NH+]1CC[C@@H](O)C1 ZINC000624677958 482538405 /nfs/dbraw/zinc/53/84/05/482538405.db2.gz LXRVXGJVSLERMN-HUUCEWRRSA-N 2 0 350.467 -1.414 20 0 FAADRP COc1cnc(NCC[N@@H+]2CC[C@@H](O)C2)nc1NCC[NH+]1CC[C@@H](O)C1 ZINC000624678774 482539417 /nfs/dbraw/zinc/53/94/17/482539417.db2.gz FKEUGZSQNVALCA-ZIAGYGMSSA-N 2 0 366.466 -1.714 20 0 FAADRP Cc1nc(NCC[N@@H+]2CC[C@@H](O)C2)nc(NCC[NH+]2CC[C@@H](O)C2)c1F ZINC000624681267 482538522 /nfs/dbraw/zinc/53/85/22/482538522.db2.gz OORJWPUEBMJOEW-ZIAGYGMSSA-N 2 0 368.457 -1.275 20 0 FAADRP CNc1nc(NCC[NH+]2CC[C@H](O)C2)nc(NCC[N@@H+]2CC[C@H](O)C2)n1 ZINC000624772652 482538661 /nfs/dbraw/zinc/53/86/61/482538661.db2.gz BKFYFZQJONHWNE-STQMWFEESA-N 2 0 366.470 -2.864 20 0 FAADRP COc1nc(NCC[NH+]2CC[C@H](O)C2)nc(NCC[N@@H+]2CC[C@H](O)C2)n1 ZINC000624772739 482539986 /nfs/dbraw/zinc/53/99/86/482539986.db2.gz FBBWHXHFCHKVTG-STQMWFEESA-N 2 0 367.454 -2.319 20 0 FAADRP COc1cnc(NCC[N@@H+]2CC[C@H](O)C2)nc1NCC[NH+]1CC[C@H](O)C1 ZINC000624773223 482539059 /nfs/dbraw/zinc/53/90/59/482539059.db2.gz FKEUGZSQNVALCA-KBPBESRZSA-N 2 0 366.466 -1.714 20 0 FAADRP Cc1cnc(NCC[N@@H+]2CC[C@H](O)C2)nc1NCC[NH+]1CC[C@H](O)C1 ZINC000624773983 482538725 /nfs/dbraw/zinc/53/87/25/482538725.db2.gz LXRVXGJVSLERMN-GJZGRUSLSA-N 2 0 350.467 -1.414 20 0 FAADRP Cc1nc(NCC[N@@H+]2CC[C@H](O)C2)nc(NCC[NH+]2CC[C@H](O)C2)c1F ZINC000624774477 482540091 /nfs/dbraw/zinc/54/00/91/482540091.db2.gz OORJWPUEBMJOEW-KBPBESRZSA-N 2 0 368.457 -1.275 20 0 FAADRP C[NH+](C)CCN(CC[NH+](C)C)C(=O)C(=O)N1CCO[C@H](CC(N)=O)C1 ZINC000625466284 482594446 /nfs/dbraw/zinc/59/44/46/482594446.db2.gz QJKKCHQOQTWHSA-CYBMUJFWSA-N 2 0 357.455 -1.959 20 0 FAADRP C[NH+](C)CCN(CC[NH+](C)C)C(=O)C(=O)N1CCO[C@@H](CC(N)=O)C1 ZINC000625466288 482594332 /nfs/dbraw/zinc/59/43/32/482594332.db2.gz QJKKCHQOQTWHSA-ZDUSSCGKSA-N 2 0 357.455 -1.959 20 0 FAADRP COCC[N@H+](C)CCNC(=O)N1CCN(C(=O)N2CC[NH2+]CC2)CC1 ZINC000626966208 483518532 /nfs/dbraw/zinc/51/85/32/483518532.db2.gz SGLIRBMRGVENOL-UHFFFAOYSA-N 2 0 356.471 -1.083 20 0 FAADRP C[NH+](C)CCOCCNC(=O)N1CCN(C(=O)N2CC[NH2+]CC2)CC1 ZINC000627019308 483525059 /nfs/dbraw/zinc/52/50/59/483525059.db2.gz XXSWKKITNCQSDV-UHFFFAOYSA-N 2 0 356.471 -1.083 20 0 FAADRP [NH3+]C1(CNC(=O)N2CCN(C(=O)N3CC[NH2+]CC3)CC2)CCOCC1 ZINC000627147149 483535322 /nfs/dbraw/zinc/53/53/22/483535322.db2.gz HVZNHKUDMNLAGU-UHFFFAOYSA-N 2 0 354.455 -1.153 20 0 FAADRP C[NH+]1CCC(NC(=O)C(=O)N2CCN(C(=O)N3CC[NH2+]CC3)CC2)CC1 ZINC000627291027 483696283 /nfs/dbraw/zinc/69/62/83/483696283.db2.gz IVXPHEHHIXKIHN-UHFFFAOYSA-N 2 0 366.466 -1.634 20 0 FAADRP C[NH+](C)CCOc1cc(CNC(=O)C(=O)NC[C@H]2COCC[NH2+]2)ccn1 ZINC000627306012 483704777 /nfs/dbraw/zinc/70/47/77/483704777.db2.gz NSSGGFBLOSDAGJ-AWEZNQCLSA-N 2 0 365.434 -1.257 20 0 FAADRP C[NH+](C)CCOc1cc(CNC(=O)C(=O)NC[C@@H]2COCC[NH2+]2)ccn1 ZINC000627306013 483704494 /nfs/dbraw/zinc/70/44/94/483704494.db2.gz NSSGGFBLOSDAGJ-CQSZACIVSA-N 2 0 365.434 -1.257 20 0 FAADRP O=C(NC[C@@H]1COCC[NH2+]1)C(=O)NC1CC[NH+]([C@@H]2CCCC[C@H]2O)CC1 ZINC000627306407 483704751 /nfs/dbraw/zinc/70/47/51/483704751.db2.gz YRPNEYSMEDZQFC-BZUAXINKSA-N 2 0 368.478 -1.025 20 0 FAADRP O=C(NC[C@@H]1COCC[NH2+]1)C(=O)NC1CC[NH+]([C@@H]2CCCC[C@@H]2O)CC1 ZINC000627306408 483704290 /nfs/dbraw/zinc/70/42/90/483704290.db2.gz YRPNEYSMEDZQFC-OAGGEKHMSA-N 2 0 368.478 -1.025 20 0 FAADRP O=C(NC[C@@H]1COCC[NH2+]1)C(=O)NC1CC[NH+]([C@H]2CCCC[C@H]2O)CC1 ZINC000627306409 483704770 /nfs/dbraw/zinc/70/47/70/483704770.db2.gz YRPNEYSMEDZQFC-OWCLPIDISA-N 2 0 368.478 -1.025 20 0 FAADRP O=C(NC[C@@H]1COCC[NH2+]1)C(=O)NC1CC[NH+]([C@H]2CCCC[C@@H]2O)CC1 ZINC000627306410 483704333 /nfs/dbraw/zinc/70/43/33/483704333.db2.gz YRPNEYSMEDZQFC-PMPSAXMXSA-N 2 0 368.478 -1.025 20 0 FAADRP C[NH+]1CCC(N2CC[C@H](NC(=O)C(=O)NC[C@H]3COCC[NH2+]3)C2)CC1 ZINC000627313399 483706862 /nfs/dbraw/zinc/70/68/62/483706862.db2.gz DMAPXFXLGHMDCE-KBPBESRZSA-N 2 0 353.467 -1.624 20 0 FAADRP C[NH+]1CCC(N2CC[C@@H](NC(=O)C(=O)NC[C@H]3COCC[NH2+]3)C2)CC1 ZINC000627313400 483707135 /nfs/dbraw/zinc/70/71/35/483707135.db2.gz DMAPXFXLGHMDCE-KGLIPLIRSA-N 2 0 353.467 -1.624 20 0 FAADRP C[NH+]1CCC(N2CC[C@H](NC(=O)C(=O)NC[C@@H]3COCC[NH2+]3)C2)CC1 ZINC000627313401 483707293 /nfs/dbraw/zinc/70/72/93/483707293.db2.gz DMAPXFXLGHMDCE-UONOGXRCSA-N 2 0 353.467 -1.624 20 0 FAADRP C[NH+]1CCC(N2CC[C@@H](NC(=O)C(=O)NC[C@@H]3COCC[NH2+]3)C2)CC1 ZINC000627313402 483707323 /nfs/dbraw/zinc/70/73/23/483707323.db2.gz DMAPXFXLGHMDCE-ZIAGYGMSSA-N 2 0 353.467 -1.624 20 0 FAADRP CN(CCOCC[NH3+])C(=O)C(=O)N[C@H]1CCN(C2CC[NH+](C)CC2)C1 ZINC000627313577 483707396 /nfs/dbraw/zinc/70/73/96/483707396.db2.gz ISTAFOCXJUDNTI-AWEZNQCLSA-N 2 0 355.483 -1.295 20 0 FAADRP CN(CCOCC[NH3+])C(=O)C(=O)N[C@@H]1CCN(C2CC[NH+](C)CC2)C1 ZINC000627313578 483706731 /nfs/dbraw/zinc/70/67/31/483706731.db2.gz ISTAFOCXJUDNTI-CQSZACIVSA-N 2 0 355.483 -1.295 20 0 FAADRP CCN(CC[NH3+])C(=O)C(=O)NCC1(N2CCOCC2)CC[NH+](C)CC1 ZINC000627315426 483706854 /nfs/dbraw/zinc/70/68/54/483706854.db2.gz FRRLSBBBNMQDMJ-UHFFFAOYSA-N 2 0 355.483 -1.294 20 0 FAADRP C[C@@H]1[NH2+]CC[C@H]1NC(=O)C(=O)NCC1(N2CCOCC2)CC[NH+](C)CC1 ZINC000627315542 483707439 /nfs/dbraw/zinc/70/74/39/483707439.db2.gz JGFKOFBUKXCNMO-LSDHHAIUSA-N 2 0 367.494 -1.234 20 0 FAADRP C[NH+]1CCC(CNC(=O)C(=O)N[C@@H]2CC[NH2+]C2)(N2CCOCC2)CC1 ZINC000627315819 483706792 /nfs/dbraw/zinc/70/67/92/483706792.db2.gz RISAISGELIUJBE-CQSZACIVSA-N 2 0 353.467 -1.623 20 0 FAADRP C[N@H+](CCNC(=O)C(=O)N1CCN(C(=O)N2CC[NH2+]CC2)CC1)C1CC1 ZINC000627319528 483707867 /nfs/dbraw/zinc/70/78/67/483707867.db2.gz WEISISBUCNFLOZ-UHFFFAOYSA-N 2 0 366.466 -1.634 20 0 FAADRP CC(C)[C@H](CNC(=O)C(=O)N(C)CCOCC[NH3+])N1CC[NH+](C)CC1 ZINC000627324535 483707799 /nfs/dbraw/zinc/70/77/99/483707799.db2.gz DRAQSGZQRYPPBC-HNNXBMFYSA-N 2 0 357.499 -1.192 20 0 FAADRP CC(C)[C@@H](CNC(=O)C(=O)N(C)CCOCC[NH3+])N1CC[NH+](C)CC1 ZINC000627324536 483708002 /nfs/dbraw/zinc/70/80/02/483708002.db2.gz DRAQSGZQRYPPBC-OAHLLOKOSA-N 2 0 357.499 -1.192 20 0 FAADRP C[C@@H](CC[NH+](C)C)NC(=O)C(=O)N1CCN(C(=O)N2CC[NH2+]CC2)CC1 ZINC000627325714 483708125 /nfs/dbraw/zinc/70/81/25/483708125.db2.gz RYYCWVNLKHEYCF-AWEZNQCLSA-N 2 0 368.482 -1.388 20 0 FAADRP C[C@H](CC[NH+](C)C)NC(=O)C(=O)N1CCN(C(=O)N2CC[NH2+]CC2)CC1 ZINC000627325715 483707737 /nfs/dbraw/zinc/70/77/37/483707737.db2.gz RYYCWVNLKHEYCF-CQSZACIVSA-N 2 0 368.482 -1.388 20 0 FAADRP C[NH2+]CCOCCN(C)C(=O)C(=O)NCCN1CC[N@H+](C)C(C)(C)C1 ZINC000627334335 483709633 /nfs/dbraw/zinc/70/96/33/483709633.db2.gz NJCODGFVDGINSE-UHFFFAOYSA-N 2 0 357.499 -1.177 20 0 FAADRP CC[C@@H]1[NH2+]CC[C@H]1NC(=O)C(=O)NCCC[N@@H+]1CCC[C@@H](C(N)=O)C1 ZINC000627351719 658834528 /nfs/dbraw/zinc/83/45/28/658834528.db2.gz AUNFQZRHIJZAHO-HZSPNIEDSA-N 2 0 353.467 -1.053 20 0 FAADRP CC[C@@H]1[NH2+]CC[C@H]1NC(=O)C(=O)NCCC[N@@H+]1CCC[C@H](C(N)=O)C1 ZINC000627351720 658834842 /nfs/dbraw/zinc/83/48/42/658834842.db2.gz AUNFQZRHIJZAHO-MELADBBJSA-N 2 0 353.467 -1.053 20 0 FAADRP C[C@@H]1CC[C@@H](NC(=O)C(=O)NCCC[N@@H+]2CCC[C@H](C(N)=O)C2)C[NH2+]1 ZINC000627351831 658834798 /nfs/dbraw/zinc/83/47/98/658834798.db2.gz DOGOJYCOHQYJHY-HZSPNIEDSA-N 2 0 353.467 -1.053 20 0 FAADRP C[C@@H]1CC[C@H](NC(=O)C(=O)NCCC[N@@H+]2CCC[C@@H](C(N)=O)C2)C[NH2+]1 ZINC000627351832 658834680 /nfs/dbraw/zinc/83/46/80/658834680.db2.gz DOGOJYCOHQYJHY-MCIONIFRSA-N 2 0 353.467 -1.053 20 0 FAADRP C[C@@H]1CC[C@@H](NC(=O)C(=O)NCCC[N@@H+]2CCC[C@@H](C(N)=O)C2)C[NH2+]1 ZINC000627351833 658834405 /nfs/dbraw/zinc/83/44/05/658834405.db2.gz DOGOJYCOHQYJHY-MGPQQGTHSA-N 2 0 353.467 -1.053 20 0 FAADRP C[C@@H]1CC[C@H](NC(=O)C(=O)NCCC[N@@H+]2CCC[C@H](C(N)=O)C2)C[NH2+]1 ZINC000627351834 658383353 /nfs/dbraw/zinc/38/33/53/658383353.db2.gz DOGOJYCOHQYJHY-RDBSUJKOSA-N 2 0 353.467 -1.053 20 0 FAADRP C[C@@H]1[NH2+]CC[C@H]1NC(=O)C(=O)NCCC[N@@H+]1CCC[C@@H]1C(=O)N(C)C ZINC000627366314 483716629 /nfs/dbraw/zinc/71/66/29/483716629.db2.gz OTCMYENUXQWYGF-BFHYXJOUSA-N 2 0 353.467 -1.088 20 0 FAADRP C[C@@H]1[NH2+]CC[C@H]1NC(=O)C(=O)NCCC[N@@H+]1CCC[C@H]1C(=O)N(C)C ZINC000627366315 483716582 /nfs/dbraw/zinc/71/65/82/483716582.db2.gz OTCMYENUXQWYGF-MJBXVCDLSA-N 2 0 353.467 -1.088 20 0 FAADRP CN(C)C(=O)[C@@H]1CCC[N@@H+]1CCCNC(=O)C(=O)NC[C@H]1COCC[NH2+]1 ZINC000627366514 483716743 /nfs/dbraw/zinc/71/67/43/483716743.db2.gz TXQQKZIJKCDEJR-KBPBESRZSA-N 2 0 369.466 -1.850 20 0 FAADRP CN(C)C(=O)[C@@H]1CCC[N@@H+]1CCCNC(=O)C(=O)NC[C@@H]1COCC[NH2+]1 ZINC000627366515 483716858 /nfs/dbraw/zinc/71/68/58/483716858.db2.gz TXQQKZIJKCDEJR-KGLIPLIRSA-N 2 0 369.466 -1.850 20 0 FAADRP CN(C)C(=O)[C@H]1CCC[N@@H+]1CCCNC(=O)C(=O)NC[C@H]1COCC[NH2+]1 ZINC000627366516 483716644 /nfs/dbraw/zinc/71/66/44/483716644.db2.gz TXQQKZIJKCDEJR-UONOGXRCSA-N 2 0 369.466 -1.850 20 0 FAADRP CN(C)C(=O)[C@H]1CCC[N@@H+]1CCCNC(=O)C(=O)NC[C@@H]1COCC[NH2+]1 ZINC000627366517 483716546 /nfs/dbraw/zinc/71/65/46/483716546.db2.gz TXQQKZIJKCDEJR-ZIAGYGMSSA-N 2 0 369.466 -1.850 20 0 FAADRP O=C(NC[C@H]1COCC[NH2+]1)C(=O)NCC1([NH+]2CCCC2)CCOCC1 ZINC000627385401 483716790 /nfs/dbraw/zinc/71/67/90/483716790.db2.gz JMSIPIHWSODLGO-AWEZNQCLSA-N 2 0 354.451 -1.148 20 0 FAADRP O=C(NC[C@@H]1COCC[NH2+]1)C(=O)NCC1([NH+]2CCCC2)CCOCC1 ZINC000627385402 483717079 /nfs/dbraw/zinc/71/70/79/483717079.db2.gz JMSIPIHWSODLGO-CQSZACIVSA-N 2 0 354.451 -1.148 20 0 FAADRP CC[NH+](CC)CCNC(=O)C(=O)N1CCN(C(=O)N2CC[NH2+]CC2)CC1 ZINC000627389820 483716524 /nfs/dbraw/zinc/71/65/24/483716524.db2.gz RFCNKVCOMGBXMP-UHFFFAOYSA-N 2 0 368.482 -1.386 20 0 FAADRP CC1([NH+]2CCOCC2)CCN(C(=O)C(=O)NCCN2CC[NH2+]CC2)CC1 ZINC000627402130 483717330 /nfs/dbraw/zinc/71/73/30/483717330.db2.gz WBYQUFHJQMTHQV-UHFFFAOYSA-N 2 0 367.494 -1.279 20 0 FAADRP CC1([NH+]2CCOCC2)CCN(C(=O)C(=O)NC[C@@H]2C[NH2+]CCO2)CC1 ZINC000627420929 483718031 /nfs/dbraw/zinc/71/80/31/483718031.db2.gz WMRDNRFUDYNMEQ-AWEZNQCLSA-N 2 0 354.451 -1.196 20 0 FAADRP CC1([NH+]2CCOCC2)CCN(C(=O)C(=O)NC[C@H]2C[NH2+]CCO2)CC1 ZINC000627420930 483718109 /nfs/dbraw/zinc/71/81/09/483718109.db2.gz WMRDNRFUDYNMEQ-CQSZACIVSA-N 2 0 354.451 -1.196 20 0 FAADRP C[N@@H+]1CCC[C@H](N2CCN(C(=O)C(=O)NCC3([NH3+])CCOCC3)CC2)C1 ZINC000627455028 483718728 /nfs/dbraw/zinc/71/87/28/483718728.db2.gz IICVJTFYKJGNLR-HNNXBMFYSA-N 2 0 367.494 -1.151 20 0 FAADRP C[N@@H+]1CCC[C@@H](N2CCN(C(=O)C(=O)NCC3([NH3+])CCOCC3)CC2)C1 ZINC000627455029 483718789 /nfs/dbraw/zinc/71/87/89/483718789.db2.gz IICVJTFYKJGNLR-OAHLLOKOSA-N 2 0 367.494 -1.151 20 0 FAADRP C[NH2+]CCOCCNC(=O)C(=O)N(C)[C@H]1CCN(C2CC[NH+](C)CC2)C1 ZINC000627461267 483718847 /nfs/dbraw/zinc/71/88/47/483718847.db2.gz KLRMXWTWPWVJMA-INIZCTEOSA-N 2 0 369.510 -1.035 20 0 FAADRP C[NH2+]CCOCCNC(=O)C(=O)N(C)[C@@H]1CCN(C2CC[NH+](C)CC2)C1 ZINC000627461268 483718801 /nfs/dbraw/zinc/71/88/01/483718801.db2.gz KLRMXWTWPWVJMA-MRXNPFEDSA-N 2 0 369.510 -1.035 20 0 FAADRP C[NH2+]CCOCCNC(=O)C(=O)N1CCC[C@H](C[NH+]2CCOCC2)C1 ZINC000627461868 483718714 /nfs/dbraw/zinc/71/87/14/483718714.db2.gz BFOVLTHSQSZIQL-OAHLLOKOSA-N 2 0 356.467 -1.091 20 0 FAADRP C[NH2+]CCOCCNC(=O)C(=O)N1CCN(C(=O)[C@@H]2CCC[N@@H+]2C)CC1 ZINC000627462880 483718570 /nfs/dbraw/zinc/71/85/70/483718570.db2.gz HJKGRDHCWMKEKA-AWEZNQCLSA-N 2 0 369.466 -1.896 20 0 FAADRP C[NH2+]CCOCCNC(=O)C(=O)N1CCN(C(=O)[C@H]2CCC[N@@H+]2C)CC1 ZINC000627462881 483718530 /nfs/dbraw/zinc/71/85/30/483718530.db2.gz HJKGRDHCWMKEKA-CQSZACIVSA-N 2 0 369.466 -1.896 20 0 FAADRP C[NH2+]CCOCCNC(=O)C(=O)N1CC[NH+](CC2CCOCC2)CC1 ZINC000627463404 483718695 /nfs/dbraw/zinc/71/86/95/483718695.db2.gz WLGDMHWSXLTRLX-UHFFFAOYSA-N 2 0 356.467 -1.091 20 0 FAADRP C[NH2+]CCOCCNC(=O)C(=O)N1CCN(C(=O)C[NH+]2CCCC2)CC1 ZINC000627463445 483718671 /nfs/dbraw/zinc/71/86/71/483718671.db2.gz XXWLVJBUBAHRTN-UHFFFAOYSA-N 2 0 369.466 -1.895 20 0 FAADRP C[NH2+]CCOCCNC(=O)C(=O)N1CCC(C[NH+]2CCOCC2)CC1 ZINC000627463507 483718809 /nfs/dbraw/zinc/71/88/09/483718809.db2.gz ZLIZAQOXOWFSJR-UHFFFAOYSA-N 2 0 356.467 -1.091 20 0 FAADRP C[NH2+]CCOCCNC(=O)C(=O)N1CCC[C@@H](C[NH+]2CCOCC2)C1 ZINC000627463568 483345937 /nfs/dbraw/zinc/34/59/37/483345937.db2.gz BFOVLTHSQSZIQL-HNNXBMFYSA-N 2 0 356.467 -1.091 20 0 FAADRP C[NH2+]CCOCCNC(=O)C(=O)N1CCN([C@H]2CCC[N@H+](C)C2)CC1 ZINC000627464015 483718815 /nfs/dbraw/zinc/71/88/15/483718815.db2.gz OWFNIAOAANHFBL-HNNXBMFYSA-N 2 0 355.483 -1.423 20 0 FAADRP C[NH2+]CCOCCNC(=O)C(=O)N1CCN([C@@H]2CCC[N@H+](C)C2)CC1 ZINC000627464016 483718785 /nfs/dbraw/zinc/71/87/85/483718785.db2.gz OWFNIAOAANHFBL-OAHLLOKOSA-N 2 0 355.483 -1.423 20 0 FAADRP C[NH2+]CCOCCNC(=O)C(=O)N1CCN(C[C@@H]2CCCC[N@@H+]2C)CC1 ZINC000627464409 483719497 /nfs/dbraw/zinc/71/94/97/483719497.db2.gz AIFLTCZIDYQJOL-INIZCTEOSA-N 2 0 369.510 -1.033 20 0 FAADRP C[NH2+]CCOCCNC(=O)C(=O)N1CCN(C[C@H]2CCCC[N@@H+]2C)CC1 ZINC000627464410 483719086 /nfs/dbraw/zinc/71/90/86/483719086.db2.gz AIFLTCZIDYQJOL-MRXNPFEDSA-N 2 0 369.510 -1.033 20 0 FAADRP C[N@@H+]1CCCC[C@H]1CN1CCN(C(=O)C(=O)NC[C@@H]2COCC[NH2+]2)CC1 ZINC000627469106 483719275 /nfs/dbraw/zinc/71/92/75/483719275.db2.gz LXHAHWMIXKICRI-CVEARBPZSA-N 2 0 367.494 -1.281 20 0 FAADRP C[N@@H+]1CCCC[C@H]1CN1CCN(C(=O)C(=O)NC[C@H]2COCC[NH2+]2)CC1 ZINC000627469107 483719379 /nfs/dbraw/zinc/71/93/79/483719379.db2.gz LXHAHWMIXKICRI-HOTGVXAUSA-N 2 0 367.494 -1.281 20 0 FAADRP C[N@@H+]1CCCC[C@@H]1CN1CCN(C(=O)C(=O)NC[C@@H]2COCC[NH2+]2)CC1 ZINC000627469108 483719652 /nfs/dbraw/zinc/71/96/52/483719652.db2.gz LXHAHWMIXKICRI-HZPDHXFCSA-N 2 0 367.494 -1.281 20 0 FAADRP C[N@@H+]1CCCC[C@@H]1CN1CCN(C(=O)C(=O)NC[C@H]2COCC[NH2+]2)CC1 ZINC000627469109 483719554 /nfs/dbraw/zinc/71/95/54/483719554.db2.gz LXHAHWMIXKICRI-JKSUJKDBSA-N 2 0 367.494 -1.281 20 0 FAADRP C[C@H]1C[N@@H+](C2CCOCC2)CCN1C(=O)C(=O)NC[C@H]1COCC[NH2+]1 ZINC000627470118 483719501 /nfs/dbraw/zinc/71/95/01/483719501.db2.gz LRISTLNVKCPIJM-KBPBESRZSA-N 2 0 354.451 -1.197 20 0 FAADRP C[C@@H]1C[N@@H+](C2CCOCC2)CCN1C(=O)C(=O)NC[C@H]1COCC[NH2+]1 ZINC000627470119 483719460 /nfs/dbraw/zinc/71/94/60/483719460.db2.gz LRISTLNVKCPIJM-KGLIPLIRSA-N 2 0 354.451 -1.197 20 0 FAADRP C[C@H]1C[N@@H+](C2CCOCC2)CCN1C(=O)C(=O)NC[C@@H]1COCC[NH2+]1 ZINC000627470120 483719515 /nfs/dbraw/zinc/71/95/15/483719515.db2.gz LRISTLNVKCPIJM-UONOGXRCSA-N 2 0 354.451 -1.197 20 0 FAADRP C[C@@H]1C[N@@H+](C2CCOCC2)CCN1C(=O)C(=O)NC[C@@H]1COCC[NH2+]1 ZINC000627470121 483719614 /nfs/dbraw/zinc/71/96/14/483719614.db2.gz LRISTLNVKCPIJM-ZIAGYGMSSA-N 2 0 354.451 -1.197 20 0 FAADRP C[N@@H+]1CCC[C@H](N2CCN(C(=O)C(=O)NC[C@@H]3COCC[NH2+]3)CC2)C1 ZINC000627470664 483719112 /nfs/dbraw/zinc/71/91/12/483719112.db2.gz WWEFRKLSXVCOMA-CABCVRRESA-N 2 0 353.467 -1.671 20 0 FAADRP C[N@@H+]1CCC[C@H](N2CCN(C(=O)C(=O)NC[C@H]3COCC[NH2+]3)CC2)C1 ZINC000627470665 483719764 /nfs/dbraw/zinc/71/97/64/483719764.db2.gz WWEFRKLSXVCOMA-GJZGRUSLSA-N 2 0 353.467 -1.671 20 0 FAADRP C[N@@H+]1CCC[C@@H](N2CCN(C(=O)C(=O)NC[C@@H]3COCC[NH2+]3)CC2)C1 ZINC000627470666 483719623 /nfs/dbraw/zinc/71/96/23/483719623.db2.gz WWEFRKLSXVCOMA-HUUCEWRRSA-N 2 0 353.467 -1.671 20 0 FAADRP C[N@@H+]1CCC[C@@H](N2CCN(C(=O)C(=O)NC[C@H]3COCC[NH2+]3)CC2)C1 ZINC000627470667 483719608 /nfs/dbraw/zinc/71/96/08/483719608.db2.gz WWEFRKLSXVCOMA-LSDHHAIUSA-N 2 0 353.467 -1.671 20 0 FAADRP 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QICXFHZTWQBTSN-UHFFFAOYSA-N 2 0 368.482 -1.434 20 0 FAADRP CN(CCOCC[NH3+])C(=O)C(=O)N1CCC(C[NH+]2CCOCC2)CC1 ZINC000629788604 483390865 /nfs/dbraw/zinc/39/08/65/483390865.db2.gz IAIYGVNDTANJBO-UHFFFAOYSA-N 2 0 356.467 -1.009 20 0 FAADRP CN(CC[NH+](C)C)C(=O)C(=O)N1CCN(C(=O)N2CC[NH2+]CC2)CC1 ZINC000629789395 483390715 /nfs/dbraw/zinc/39/07/15/483390715.db2.gz SPKUKZBXTNPIRL-UHFFFAOYSA-N 2 0 354.455 -1.824 20 0 FAADRP CN(CCOCC[NH3+])C(=O)C(=O)N(C)CCN(C)C1CC[NH+](C)CC1 ZINC000629791885 483391927 /nfs/dbraw/zinc/39/19/27/483391927.db2.gz RWRQELIAQCXLFX-UHFFFAOYSA-N 2 0 357.499 -1.096 20 0 FAADRP CN(CCOCC[NH3+])C(=O)C(=O)N1CCN([C@H]2CCC[N@H+](C)C2)CC1 ZINC000629795343 483391688 /nfs/dbraw/zinc/39/16/88/483391688.db2.gz BXPUHZXWWVWJSK-HNNXBMFYSA-N 2 0 355.483 -1.342 20 0 FAADRP CN(CCOCC[NH3+])C(=O)C(=O)N1CCN([C@@H]2CCC[N@H+](C)C2)CC1 ZINC000629795347 483391449 /nfs/dbraw/zinc/39/14/49/483391449.db2.gz BXPUHZXWWVWJSK-OAHLLOKOSA-N 2 0 355.483 -1.342 20 0 FAADRP CN(CCOCC[NH3+])C(=O)C(=O)N1CCN(C(=O)C[NH+]2CCCC2)CC1 ZINC000629796821 483392312 /nfs/dbraw/zinc/39/23/12/483392312.db2.gz SYOOTZNPBUUIOY-UHFFFAOYSA-N 2 0 369.466 -1.813 20 0 FAADRP CC[NH+](CC)CC(=O)N1CCN(C(=O)C(=O)N(C)CCOCC[NH3+])CC1 ZINC000629797105 483392667 /nfs/dbraw/zinc/39/26/67/483392667.db2.gz WHQIEKPZSJFLHA-UHFFFAOYSA-N 2 0 371.482 -1.567 20 0 FAADRP C[NH2+]CCOCCN(C)C(=O)C(=O)N1CCN([C@H]2CCC[N@H+](C)C2)CC1 ZINC000629798464 483391739 /nfs/dbraw/zinc/39/17/39/483391739.db2.gz WUHBVNDQNKODKS-INIZCTEOSA-N 2 0 369.510 -1.081 20 0 FAADRP C[NH2+]CCOCCN(C)C(=O)C(=O)N1CCN([C@@H]2CCC[N@H+](C)C2)CC1 ZINC000629798467 483391547 /nfs/dbraw/zinc/39/15/47/483391547.db2.gz WUHBVNDQNKODKS-MRXNPFEDSA-N 2 0 369.510 -1.081 20 0 FAADRP CN(CCOCC[NH3+])C(=O)C(=O)N1CC[NH+](CC2CCOCC2)CC1 ZINC000629798515 483391820 /nfs/dbraw/zinc/39/18/20/483391820.db2.gz XYQPHTRLOALELC-UHFFFAOYSA-N 2 0 356.467 -1.009 20 0 FAADRP CN(CCOCC[NH3+])C(=O)C(=O)N1CCC[C@H](C[NH+]2CCOCC2)C1 ZINC000629799838 483392618 /nfs/dbraw/zinc/39/26/18/483392618.db2.gz VGBSGRWJQKZKKK-OAHLLOKOSA-N 2 0 356.467 -1.009 20 0 FAADRP CN(CCOCC[NH3+])C(=O)C(=O)N1CCN(C(=O)[C@@H]2CCC[N@@H+]2C)CC1 ZINC000629802156 483392778 /nfs/dbraw/zinc/39/27/78/483392778.db2.gz RTMDYYMYGJYINP-AWEZNQCLSA-N 2 0 369.466 -1.815 20 0 FAADRP CN(CCOCC[NH3+])C(=O)C(=O)N1CCN(C(=O)[C@H]2CCC[N@@H+]2C)CC1 ZINC000629802158 483392608 /nfs/dbraw/zinc/39/26/08/483392608.db2.gz RTMDYYMYGJYINP-CQSZACIVSA-N 2 0 369.466 -1.815 20 0 FAADRP CN(CCOCC[NH3+])C(=O)C(=O)N1CCC[C@@H](C[NH+]2CCOCC2)C1 ZINC000629804525 483393286 /nfs/dbraw/zinc/39/32/86/483393286.db2.gz VGBSGRWJQKZKKK-HNNXBMFYSA-N 2 0 356.467 -1.009 20 0 FAADRP CN(Cc1c[nH]cn1)C(=O)C(=O)N1CCN(C(=O)N2CC[NH2+]CC2)CC1 ZINC000629810034 483394197 /nfs/dbraw/zinc/39/41/97/483394197.db2.gz OGAOGQGMXDWZSA-UHFFFAOYSA-N 2 0 363.422 -1.463 20 0 FAADRP CC1([NH+]2CCOCC2)CCN(C(=O)C(=O)N2CCO[C@@H](C[NH3+])C2)CC1 ZINC000629816349 483394890 /nfs/dbraw/zinc/39/48/90/483394890.db2.gz GDXAGOCRUWASMO-AWEZNQCLSA-N 2 0 354.451 -1.114 20 0 FAADRP CC1([NH+]2CCOCC2)CCN(C(=O)C(=O)N2CCO[C@H](C[NH3+])C2)CC1 ZINC000629816352 483395151 /nfs/dbraw/zinc/39/51/51/483395151.db2.gz GDXAGOCRUWASMO-CQSZACIVSA-N 2 0 354.451 -1.114 20 0 FAADRP O=C(NCC[NH+]1CC[C@H](O)C1)C1(C(=O)NCC[N@H+]2CC[C@H](O)C2)CCC1 ZINC000629914287 483395925 /nfs/dbraw/zinc/39/59/25/483395925.db2.gz MXFBZSUBTPUZHM-GJZGRUSLSA-N 2 0 368.478 -1.478 20 0 FAADRP CC(CC(=O)NCC[NH+]1CC[C@H](O)C1)CC(=O)NCC[N@@H+]1CC[C@H](O)C1 ZINC000629915915 483397555 /nfs/dbraw/zinc/39/75/55/483397555.db2.gz DWMPPFRXNAGUSW-HOTGVXAUSA-N 2 0 370.494 -1.232 20 0 FAADRP C[C@@H](C(=O)NCC[N@@H+]1CC[C@H](O)C1)[C@H](C)C(=O)NCC[NH+]1CC[C@H](O)C1 ZINC000629916353 483397473 /nfs/dbraw/zinc/39/74/73/483397473.db2.gz RBDCBDTUEPLZGX-FZKCQIBNSA-N 2 0 370.494 -1.376 20 0 FAADRP C[C@H](C(=O)NCC[NH+]1CC[C@H](O)C1)[C@H](C)C(=O)NCC[N@@H+]1CC[C@H](O)C1 ZINC000629916354 483397458 /nfs/dbraw/zinc/39/74/58/483397458.db2.gz RBDCBDTUEPLZGX-VGWMRTNUSA-N 2 0 370.494 -1.376 20 0 FAADRP C[C@@H](C(=O)NCC[NH+]1CC[C@H](O)C1)[C@@H](C)C(=O)NCC[N@@H+]1CC[C@H](O)C1 ZINC000629916355 483396845 /nfs/dbraw/zinc/39/68/45/483396845.db2.gz RBDCBDTUEPLZGX-WCVJEAGWSA-N 2 0 370.494 -1.376 20 0 FAADRP CC1[C@H](C(=O)NCC[NH+]2CC[C@H](O)C2)[C@H]1C(=O)NCC[N@@H+]1CC[C@H](O)C1 ZINC000629917519 483396982 /nfs/dbraw/zinc/39/69/82/483396982.db2.gz DSOHTRMCWQYEDC-VGWMRTNUSA-N 2 0 368.478 -1.766 20 0 FAADRP CN(CC(=O)N1CC[NH2+]CC1)S(=O)(=O)CCCN1CC[NH+](C)CC1 ZINC000631901451 483725403 /nfs/dbraw/zinc/72/54/03/483725403.db2.gz CWYRVMHSHVBFRT-UHFFFAOYSA-N 2 0 361.512 -1.683 20 0 FAADRP O=C([C@H]1CCCN(S(=O)(=O)C[C@@H]2C[NH2+]CCO2)C1)N1CC[NH2+]CC1 ZINC000631901675 483724961 /nfs/dbraw/zinc/72/49/61/483724961.db2.gz LBNNJMLIPJICCF-KBPBESRZSA-N 2 0 360.480 -1.552 20 0 FAADRP O=C([C@@H]1CCCN(S(=O)(=O)C[C@@H]2C[NH2+]CCO2)C1)N1CC[NH2+]CC1 ZINC000631901676 483725130 /nfs/dbraw/zinc/72/51/30/483725130.db2.gz LBNNJMLIPJICCF-KGLIPLIRSA-N 2 0 360.480 -1.552 20 0 FAADRP O=C([C@H]1CCCN(S(=O)(=O)C[C@H]2C[NH2+]CCO2)C1)N1CC[NH2+]CC1 ZINC000631901677 483725386 /nfs/dbraw/zinc/72/53/86/483725386.db2.gz LBNNJMLIPJICCF-UONOGXRCSA-N 2 0 360.480 -1.552 20 0 FAADRP O=C([C@@H]1CCCN(S(=O)(=O)C[C@H]2C[NH2+]CCO2)C1)N1CC[NH2+]CC1 ZINC000631901678 483725258 /nfs/dbraw/zinc/72/52/58/483725258.db2.gz LBNNJMLIPJICCF-ZIAGYGMSSA-N 2 0 360.480 -1.552 20 0 FAADRP O=C(NC[C@@H]1CCCN(S(=O)(=O)C[C@@H]2C[NH2+]CCO2)C1)[C@@H]1CCC[NH2+]1 ZINC000631908835 483724815 /nfs/dbraw/zinc/72/48/15/483724815.db2.gz CDRFDDHPTZENCX-KKUMJFAQSA-N 2 0 374.507 -1.115 20 0 FAADRP O=C(NC[C@@H]1CCCN(S(=O)(=O)C[C@H]2C[NH2+]CCO2)C1)[C@H]1CCC[NH2+]1 ZINC000631908836 483724891 /nfs/dbraw/zinc/72/48/91/483724891.db2.gz CDRFDDHPTZENCX-RRFJBIMHSA-N 2 0 374.507 -1.115 20 0 FAADRP O=C(NC[C@@H]1CCCN(S(=O)(=O)C[C@@H]2C[NH2+]CCO2)C1)[C@H]1CCC[NH2+]1 ZINC000631908837 483724971 /nfs/dbraw/zinc/72/49/71/483724971.db2.gz CDRFDDHPTZENCX-SOUVJXGZSA-N 2 0 374.507 -1.115 20 0 FAADRP O=C(NC[C@@H]1CCCN(S(=O)(=O)C[C@H]2C[NH2+]CCO2)C1)[C@@H]1CCC[NH2+]1 ZINC000631908838 483725843 /nfs/dbraw/zinc/72/58/43/483725843.db2.gz CDRFDDHPTZENCX-ZNMIVQPWSA-N 2 0 374.507 -1.115 20 0 FAADRP O=C(C[NH+]1CCCC1)N1CCN(S(=O)(=O)C[C@@H]2C[NH2+]CCO2)CC1 ZINC000631917268 483726174 /nfs/dbraw/zinc/72/61/74/483726174.db2.gz HWICEDGHPHXQCA-AWEZNQCLSA-N 2 0 360.480 -1.455 20 0 FAADRP O=C(C[NH+]1CCCC1)N1CCN(S(=O)(=O)C[C@H]2C[NH2+]CCO2)CC1 ZINC000631917269 483726105 /nfs/dbraw/zinc/72/61/05/483726105.db2.gz HWICEDGHPHXQCA-CQSZACIVSA-N 2 0 360.480 -1.455 20 0 FAADRP CC[NH+](CC)CC(=O)N1CCN(S(=O)(=O)C[C@@H]2C[NH2+]CCO2)CC1 ZINC000631917685 483725821 /nfs/dbraw/zinc/72/58/21/483725821.db2.gz ODIAIPIQDWUTSG-AWEZNQCLSA-N 2 0 362.496 -1.209 20 0 FAADRP CC[NH+](CC)CC(=O)N1CCN(S(=O)(=O)C[C@H]2C[NH2+]CCO2)CC1 ZINC000631917686 483725651 /nfs/dbraw/zinc/72/56/51/483725651.db2.gz ODIAIPIQDWUTSG-CQSZACIVSA-N 2 0 362.496 -1.209 20 0 FAADRP O=S(=O)(C[C@H]1C[NH2+]CCO1)NC[C@@H](N1CC[NH2+]CC1)C(F)(F)F ZINC000631935266 483726091 /nfs/dbraw/zinc/72/60/91/483726091.db2.gz GREXVPUMFBJCFN-GHMZBOCLSA-N 2 0 360.402 -1.270 20 0 FAADRP O=S(=O)(C[C@H]1C[NH2+]CCO1)NC[C@H](N1CC[NH2+]CC1)C(F)(F)F ZINC000631935277 483725759 /nfs/dbraw/zinc/72/57/59/483725759.db2.gz GREXVPUMFBJCFN-MNOVXSKESA-N 2 0 360.402 -1.270 20 0 FAADRP O=S(=O)(C[C@@H]1C[NH2+]CCO1)NC[C@H](N1CC[NH2+]CC1)C(F)(F)F ZINC000631935278 483726088 /nfs/dbraw/zinc/72/60/88/483726088.db2.gz GREXVPUMFBJCFN-QWRGUYRKSA-N 2 0 360.402 -1.270 20 0 FAADRP O=S(=O)(C[C@@H]1C[NH2+]CCO1)NC[C@@H](N1CC[NH2+]CC1)C(F)(F)F ZINC000631935279 483726136 /nfs/dbraw/zinc/72/61/36/483726136.db2.gz GREXVPUMFBJCFN-WDEREUQCSA-N 2 0 360.402 -1.270 20 0 FAADRP C[NH+]1CCN(CCCS(=O)(=O)N2CC[C@H](N3CC[NH2+]CC3)C2)CC1 ZINC000631936691 483726157 /nfs/dbraw/zinc/72/61/57/483726157.db2.gz JDUYQUGPQKEOCC-INIZCTEOSA-N 2 0 359.540 -1.067 20 0 FAADRP C[NH+]1CCN(CCCS(=O)(=O)N2CC[C@@H](N3CC[NH2+]CC3)C2)CC1 ZINC000631936692 483726133 /nfs/dbraw/zinc/72/61/33/483726133.db2.gz JDUYQUGPQKEOCC-MRXNPFEDSA-N 2 0 359.540 -1.067 20 0 FAADRP C[NH+]1CCN(CCCS(=O)(=O)N2CCN([C@H]3CC[NH2+]C3)CC2)CC1 ZINC000631937664 483726081 /nfs/dbraw/zinc/72/60/81/483726081.db2.gz JTHGBYLHTHEVLS-INIZCTEOSA-N 2 0 359.540 -1.067 20 0 FAADRP C[NH+]1CCN(CCCS(=O)(=O)N2CCN([C@@H]3CC[NH2+]C3)CC2)CC1 ZINC000631937665 483725662 /nfs/dbraw/zinc/72/56/62/483725662.db2.gz JTHGBYLHTHEVLS-MRXNPFEDSA-N 2 0 359.540 -1.067 20 0 FAADRP CN(C1CC[NH2+]CC1)S(=O)(=O)N1CCN(C(=O)N2CC[NH2+]CC2)CC1 ZINC000631953724 483512191 /nfs/dbraw/zinc/51/21/91/483512191.db2.gz RBBWBTFUJUTHMT-UHFFFAOYSA-N 2 0 374.511 -1.442 20 0 FAADRP O=C(N1CC[NH2+]CC1)N1CCN(S(=O)(=O)C[C@H]2C[NH2+]CCO2)CC1 ZINC000631953844 483726021 /nfs/dbraw/zinc/72/60/21/483726021.db2.gz UFYVKSSVBXGUMW-CYBMUJFWSA-N 2 0 361.468 -2.053 20 0 FAADRP O=C(N1CC[NH2+]CC1)N1CCN(S(=O)(=O)C[C@@H]2C[NH2+]CCO2)CC1 ZINC000631953845 483725717 /nfs/dbraw/zinc/72/57/17/483725717.db2.gz UFYVKSSVBXGUMW-ZDUSSCGKSA-N 2 0 361.468 -2.053 20 0 FAADRP O=S(=O)(C[C@@H]1C[NH2+]CCO1)N1CCN(CCc2cnccn2)CC1 ZINC000631982295 483726444 /nfs/dbraw/zinc/72/64/44/483726444.db2.gz UAHBEFXUGXBFPY-HNNXBMFYSA-N 2 0 355.464 -1.045 20 0 FAADRP O=S(=O)(C[C@H]1C[NH2+]CCO1)N1CCN(CCc2cnccn2)CC1 ZINC000631982296 483726491 /nfs/dbraw/zinc/72/64/91/483726491.db2.gz UAHBEFXUGXBFPY-OAHLLOKOSA-N 2 0 355.464 -1.045 20 0 FAADRP O=C(C[NH+]1CCCC1)N1CCN(C(=O)C(=O)N2C[C@H]3CC[C@@H](C2)[NH2+]3)CC1 ZINC000633086845 483730951 /nfs/dbraw/zinc/73/09/51/483730951.db2.gz AKFHYMONUQXRNP-GASCZTMLSA-N 2 0 363.462 -1.284 20 0 FAADRP CC[NH+](CC)CC(=O)N1CCN(C(=O)C(=O)N2C[C@H]3CC[C@@H](C2)[NH2+]3)CC1 ZINC000633086972 483730757 /nfs/dbraw/zinc/73/07/57/483730757.db2.gz CRCFNNRNXCCRIA-GASCZTMLSA-N 2 0 365.478 -1.038 20 0 FAADRP CC[NH+](CC)CC(=O)N1CCN(C(=O)C(=O)N2C[C@@H]3C[C@H]2C[NH2+]3)CC1 ZINC000633086994 483730981 /nfs/dbraw/zinc/73/09/81/483730981.db2.gz DJFRWVGPSHQHHB-KBPBESRZSA-N 2 0 351.451 -1.428 20 0 FAADRP C[C@@H]1CN(C(=O)C(=O)N2CCN(C(=O)C[NH+]3CCCC3)CC2)C[C@H]1C[NH3+] ZINC000633087460 483730897 /nfs/dbraw/zinc/73/08/97/483730897.db2.gz KYJYVKPYKCJFTL-HUUCEWRRSA-N 2 0 365.478 -1.194 20 0 FAADRP C[C@@H]1CN(C(=O)C(=O)N2CCN(C(=O)[C@@H]3CCC[N@@H+]3C)CC2)C[C@H]1C[NH3+] ZINC000633102331 483731051 /nfs/dbraw/zinc/73/10/51/483731051.db2.gz SEAYCROVZCXRMU-KFWWJZLASA-N 2 0 365.478 -1.195 20 0 FAADRP C[C@@H]1CN(C(=O)C(=O)N2CCN(C(=O)[C@H]3CCC[N@@H+]3C)CC2)C[C@H]1C[NH3+] ZINC000633102339 483731003 /nfs/dbraw/zinc/73/10/03/483731003.db2.gz SEAYCROVZCXRMU-RBSFLKMASA-N 2 0 365.478 -1.195 20 0 FAADRP C[N@@H+]1CCC[C@@H]1C(=O)N1CCN(C(=O)C(=O)N2C[C@H]3CC[C@@H](C2)[NH2+]3)CC1 ZINC000633102380 483731107 /nfs/dbraw/zinc/73/11/07/483731107.db2.gz SJIDMFPAKXGYRZ-QLFBSQMISA-N 2 0 363.462 -1.286 20 0 FAADRP C[N@@H+]1CCC[C@H]1C(=O)N1CCN(C(=O)C(=O)N2C[C@H]3CC[C@@H](C2)[NH2+]3)CC1 ZINC000633102382 483730651 /nfs/dbraw/zinc/73/06/51/483730651.db2.gz SJIDMFPAKXGYRZ-ZNMIVQPWSA-N 2 0 363.462 -1.286 20 0 FAADRP C[C@H]1C[C@H]([NH3+])CN1C(=O)C(=O)N1CCN(C(=O)C[NH+]2CCCC2)CC1 ZINC000633116707 483731103 /nfs/dbraw/zinc/73/11/03/483731103.db2.gz WLTAKAHODRDDEW-KBPBESRZSA-N 2 0 351.451 -1.299 20 0 FAADRP C[C@@H]1C[C@H]([NH3+])CN1C(=O)C(=O)N1CCN(C(=O)C[NH+]2CCCC2)CC1 ZINC000633116708 483730854 /nfs/dbraw/zinc/73/08/54/483730854.db2.gz WLTAKAHODRDDEW-KGLIPLIRSA-N 2 0 351.451 -1.299 20 0 FAADRP C[C@H]1C[C@@H]([NH3+])CN1C(=O)C(=O)N1CCN(C(=O)C[NH+]2CCCC2)CC1 ZINC000633116709 483730745 /nfs/dbraw/zinc/73/07/45/483730745.db2.gz WLTAKAHODRDDEW-UONOGXRCSA-N 2 0 351.451 -1.299 20 0 FAADRP C[C@@H]1C[C@@H]([NH3+])CN1C(=O)C(=O)N1CCN(C(=O)C[NH+]2CCCC2)CC1 ZINC000633116710 483731009 /nfs/dbraw/zinc/73/10/09/483731009.db2.gz WLTAKAHODRDDEW-ZIAGYGMSSA-N 2 0 351.451 -1.299 20 0 FAADRP CC[NH+](CC)CC(=O)N1CCN(C(=O)C(=O)N2C[C@@H]([NH3+])C[C@@H]2C)CC1 ZINC000633116752 483730802 /nfs/dbraw/zinc/73/08/02/483730802.db2.gz XDYBOJZHCJUAJI-KBPBESRZSA-N 2 0 353.467 -1.053 20 0 FAADRP CC[NH+](CC)CC(=O)N1CCN(C(=O)C(=O)N2C[C@@H]([NH3+])C[C@H]2C)CC1 ZINC000633116753 483731565 /nfs/dbraw/zinc/73/15/65/483731565.db2.gz XDYBOJZHCJUAJI-KGLIPLIRSA-N 2 0 353.467 -1.053 20 0 FAADRP CC[NH+](CC)CC(=O)N1CCN(C(=O)C(=O)N2C[C@H]([NH3+])C[C@@H]2C)CC1 ZINC000633116754 483731615 /nfs/dbraw/zinc/73/16/15/483731615.db2.gz XDYBOJZHCJUAJI-UONOGXRCSA-N 2 0 353.467 -1.053 20 0 FAADRP CC[NH+](CC)CC(=O)N1CCN(C(=O)C(=O)N2C[C@H]([NH3+])C[C@H]2C)CC1 ZINC000633116755 483731281 /nfs/dbraw/zinc/73/12/81/483731281.db2.gz XDYBOJZHCJUAJI-ZIAGYGMSSA-N 2 0 353.467 -1.053 20 0 FAADRP C[C@@H]1C[C@H]([NH3+])CN1C(=O)C(=O)N1CCN(C(=O)[C@H]2CCC[N@@H+]2C)CC1 ZINC000633146948 483731505 /nfs/dbraw/zinc/73/15/05/483731505.db2.gz PWECSDANHTUYPU-HZSPNIEDSA-N 2 0 351.451 -1.301 20 0 FAADRP C[C@@H]1C[C@@H]([NH3+])CN1C(=O)C(=O)N1CCN(C(=O)[C@@H]2CCC[N@@H+]2C)CC1 ZINC000633146949 483731545 /nfs/dbraw/zinc/73/15/45/483731545.db2.gz PWECSDANHTUYPU-MCIONIFRSA-N 2 0 351.451 -1.301 20 0 FAADRP C[C@@H]1C[C@@H]([NH3+])CN1C(=O)C(=O)N1CCN(C(=O)[C@H]2CCC[N@@H+]2C)CC1 ZINC000633146950 483731272 /nfs/dbraw/zinc/73/12/72/483731272.db2.gz PWECSDANHTUYPU-MGPQQGTHSA-N 2 0 351.451 -1.301 20 0 FAADRP C[C@@H]1C[C@H]([NH3+])CN1C(=O)C(=O)N1CCN(C(=O)[C@@H]2CCC[N@@H+]2C)CC1 ZINC000633146951 483731420 /nfs/dbraw/zinc/73/14/20/483731420.db2.gz PWECSDANHTUYPU-RDBSUJKOSA-N 2 0 351.451 -1.301 20 0 FAADRP C[NH+](C)[C@H]1CN(C(=O)[C@@H]2CC[C@@H]2C(=O)N2C[C@H](O)[C@@H]([NH+](C)C)C2)C[C@@H]1O ZINC000633150451 483731519 /nfs/dbraw/zinc/73/15/19/483731519.db2.gz GRJYBPNGKWVISS-KARBZBNUSA-N 2 0 368.478 -1.721 20 0 FAADRP C[NH+](C)[C@H]1CN(C(=O)[C@@H]2CC[C@H]2C(=O)N2C[C@H](O)[C@@H]([NH+](C)C)C2)C[C@@H]1O ZINC000633150452 483731640 /nfs/dbraw/zinc/73/16/40/483731640.db2.gz GRJYBPNGKWVISS-LGFJLYTPSA-N 2 0 368.478 -1.721 20 0 FAADRP C[NH+](C)[C@H]1CN(C(=O)[C@H]2CC[C@@H]2C(=O)N2C[C@H](O)[C@@H]([NH+](C)C)C2)C[C@@H]1O ZINC000633150453 483731249 /nfs/dbraw/zinc/73/12/49/483731249.db2.gz GRJYBPNGKWVISS-QNILMXGZSA-N 2 0 368.478 -1.721 20 0 FAADRP O=C(CNC(=O)NCC(=O)N1CC[NH2+]CC1)NCC[NH+]1CCCCCC1 ZINC000634249780 483731994 /nfs/dbraw/zinc/73/19/94/483731994.db2.gz IVDJZXPDVKWUFR-UHFFFAOYSA-N 2 0 368.482 -1.290 20 0 FAADRP O=C(NCC[N@H+]1CC[C@H](O)C1)N[C@@H]1CC[NH+](CCN2CCOCC2)C1 ZINC000636797896 482883870 /nfs/dbraw/zinc/88/38/70/482883870.db2.gz VSVLNMGXOMSNPU-CVEARBPZSA-N 2 0 355.483 -1.241 20 0 FAADRP O=C(NCC[N@H+]1CC[C@H](O)C1)N[C@H]1CC[NH+](CCN2CCOCC2)C1 ZINC000636797897 482884018 /nfs/dbraw/zinc/88/40/18/482884018.db2.gz VSVLNMGXOMSNPU-HOTGVXAUSA-N 2 0 355.483 -1.241 20 0 FAADRP O=C(NCC[N@H+]1CC[C@@H](O)C1)N[C@@H]1CC[NH+](CCN2CCOCC2)C1 ZINC000636797898 482883528 /nfs/dbraw/zinc/88/35/28/482883528.db2.gz VSVLNMGXOMSNPU-HZPDHXFCSA-N 2 0 355.483 -1.241 20 0 FAADRP O=C(NCC[N@H+]1CC[C@@H](O)C1)N[C@H]1CC[NH+](CCN2CCOCC2)C1 ZINC000636797899 482884088 /nfs/dbraw/zinc/88/40/88/482884088.db2.gz VSVLNMGXOMSNPU-JKSUJKDBSA-N 2 0 355.483 -1.241 20 0 FAADRP CN(CCC[NH+](C)C)CCNC(=O)NC1CN(S(=O)(=O)N(C)C)C1 ZINC000637539703 482913366 /nfs/dbraw/zinc/91/33/66/482913366.db2.gz VQIKFJCIFURAOE-UHFFFAOYSA-N 2 0 364.516 -1.340 20 0 FAADRP C[C@@H](C(=O)N1CCN(C(=O)N2CC[NH2+]CC2)CC1)N1CCN(C)CC1 ZINC000638479621 483079623 /nfs/dbraw/zinc/07/96/23/483079623.db2.gz ATFNMECVMYNOPN-HNNXBMFYSA-N 2 0 352.483 -1.208 20 0 FAADRP C[C@H](C(=O)N1CCN(C(=O)N2CC[NH2+]CC2)CC1)N1CCN(C)CC1 ZINC000638479622 483078591 /nfs/dbraw/zinc/07/85/91/483078591.db2.gz ATFNMECVMYNOPN-OAHLLOKOSA-N 2 0 352.483 -1.208 20 0 FAADRP CC(C)NC(=O)CN(C)CC(=O)N1CCN(C(=O)N2CC[NH2+]CC2)CC1 ZINC000638480363 483079080 /nfs/dbraw/zinc/07/90/80/483079080.db2.gz MUAXOFSGXJUPDD-UHFFFAOYSA-N 2 0 368.482 -1.388 20 0 FAADRP O=C(CCNC(=O)[C@@H]1CCC[NH2+]1)N1CCN(C(=O)N2CC[NH2+]CC2)CC1 ZINC000638480514 483079116 /nfs/dbraw/zinc/07/91/16/483079116.db2.gz SCWYEOWTWDTALP-AWEZNQCLSA-N 2 0 366.466 -1.586 20 0 FAADRP O=C(CCNC(=O)[C@H]1CCC[NH2+]1)N1CCN(C(=O)N2CC[NH2+]CC2)CC1 ZINC000638480515 483079501 /nfs/dbraw/zinc/07/95/01/483079501.db2.gz SCWYEOWTWDTALP-CQSZACIVSA-N 2 0 366.466 -1.586 20 0 FAADRP O=C(CNC(=O)[C@H]1CCC[NH2+]1)N1CCN(C(=O)N2CC[NH2+]CC2)CC1 ZINC000638480637 483079309 /nfs/dbraw/zinc/07/93/09/483079309.db2.gz XCPZZNOGTKXDMH-CYBMUJFWSA-N 2 0 352.439 -1.976 20 0 FAADRP O=C(CNC(=O)[C@@H]1CCC[NH2+]1)N1CCN(C(=O)N2CC[NH2+]CC2)CC1 ZINC000638480641 483079697 /nfs/dbraw/zinc/07/96/97/483079697.db2.gz XCPZZNOGTKXDMH-ZDUSSCGKSA-N 2 0 352.439 -1.976 20 0 FAADRP C[C@H](C(=O)N1CCN(C(=O)N2CC[NH2+]CC2)CC1)N1CCNCC1=O ZINC000638485281 483079132 /nfs/dbraw/zinc/07/91/32/483079132.db2.gz JNGZMFXQZAYRGX-CYBMUJFWSA-N 2 0 352.439 -2.024 20 0 FAADRP C[C@@H](C(=O)N1CCN(C(=O)N2CC[NH2+]CC2)CC1)N1CCNCC1=O ZINC000638485282 483079455 /nfs/dbraw/zinc/07/94/55/483079455.db2.gz JNGZMFXQZAYRGX-ZDUSSCGKSA-N 2 0 352.439 -2.024 20 0 FAADRP C[NH2+]CCOCCN(C)C(=O)[C@H]1CC(=O)N(CCN2CCOCC2)C1 ZINC000638590990 483084037 /nfs/dbraw/zinc/08/40/37/483084037.db2.gz YPHMOBSJVLOWAM-HNNXBMFYSA-N 2 0 356.467 -1.139 20 0 FAADRP C[NH2+]CCOCCN(C)C(=O)[C@@H]1CC(=O)N(CCN2CCOCC2)C1 ZINC000638590991 483084232 /nfs/dbraw/zinc/08/42/32/483084232.db2.gz YPHMOBSJVLOWAM-OAHLLOKOSA-N 2 0 356.467 -1.139 20 0 FAADRP O=C(C[NH+]1C[C@@H]2C[C@]2(O)C1)N1CCN(C(=O)C[N@H+]2C[C@@H]3C[C@]3(O)C2)CC1 ZINC000640474757 483383191 /nfs/dbraw/zinc/38/31/91/483383191.db2.gz BCJJXZMQZWCALO-USJZOSNVSA-N 2 0 364.446 -2.210 20 0 FAADRP C[C@@H]1C[N@H+](CCCNC(=O)C(=O)N2CCN(C)C[C@@H]2C[NH3+])CCCO1 ZINC000642190905 483479888 /nfs/dbraw/zinc/47/98/88/483479888.db2.gz DPZSKDLTTHHHGG-CABCVRRESA-N 2 0 355.483 -1.295 20 0 FAADRP C[C@H]1C[N@H+](CCCNC(=O)C(=O)N2CCN(C)C[C@@H]2C[NH3+])CCCO1 ZINC000642190906 483480013 /nfs/dbraw/zinc/48/00/13/483480013.db2.gz DPZSKDLTTHHHGG-GJZGRUSLSA-N 2 0 355.483 -1.295 20 0 FAADRP C[C@@H]1C[N@H+](CCCNC(=O)C(=O)N2CCN(C)C[C@H]2C[NH3+])CCCO1 ZINC000642190907 483479854 /nfs/dbraw/zinc/47/98/54/483479854.db2.gz DPZSKDLTTHHHGG-HUUCEWRRSA-N 2 0 355.483 -1.295 20 0 FAADRP C[C@H]1C[N@H+](CCCNC(=O)C(=O)N2CCN(C)C[C@H]2C[NH3+])CCCO1 ZINC000642190908 483479777 /nfs/dbraw/zinc/47/97/77/483479777.db2.gz DPZSKDLTTHHHGG-LSDHHAIUSA-N 2 0 355.483 -1.295 20 0 FAADRP CC(C)C[N@@H+]1CCO[C@@H](CNC(=O)C(=O)N2CCN(C)C[C@H]2C[NH3+])C1 ZINC000642222755 483494759 /nfs/dbraw/zinc/49/47/59/483494759.db2.gz ZYCULKOGGSOWDN-CABCVRRESA-N 2 0 355.483 -1.439 20 0 FAADRP CC(C)C[N@@H+]1CCO[C@@H](CNC(=O)C(=O)N2CCN(C)C[C@@H]2C[NH3+])C1 ZINC000642222756 483495580 /nfs/dbraw/zinc/49/55/80/483495580.db2.gz ZYCULKOGGSOWDN-GJZGRUSLSA-N 2 0 355.483 -1.439 20 0 FAADRP CC(C)C[N@@H+]1CCO[C@H](CNC(=O)C(=O)N2CCN(C)C[C@H]2C[NH3+])C1 ZINC000642222758 483495817 /nfs/dbraw/zinc/49/58/17/483495817.db2.gz ZYCULKOGGSOWDN-HUUCEWRRSA-N 2 0 355.483 -1.439 20 0 FAADRP CC(C)C[N@@H+]1CCO[C@H](CNC(=O)C(=O)N2CCN(C)C[C@@H]2C[NH3+])C1 ZINC000642222759 483494809 /nfs/dbraw/zinc/49/48/09/483494809.db2.gz ZYCULKOGGSOWDN-LSDHHAIUSA-N 2 0 355.483 -1.439 20 0 FAADRP C[N@@H+]1CCC[C@H]1C(=O)N1CCN(C(=O)C(=O)NCC[NH2+]C2CC2)CC1 ZINC000642918078 482673729 /nfs/dbraw/zinc/67/37/29/482673729.db2.gz LYAFXWJTBPTWKM-AWEZNQCLSA-N 2 0 351.451 -1.380 20 0 FAADRP C[N@@H+]1CCC[C@@H]1C(=O)N1CCN(C(=O)C(=O)NCC[NH2+]C2CC2)CC1 ZINC000642918079 482673221 /nfs/dbraw/zinc/67/32/21/482673221.db2.gz LYAFXWJTBPTWKM-CQSZACIVSA-N 2 0 351.451 -1.380 20 0 FAADRP O=C(C[NH+]1CCCC1)N1CCN(C(=O)C(=O)NCC[NH2+]C2CC2)CC1 ZINC000642918496 482672903 /nfs/dbraw/zinc/67/29/03/482672903.db2.gz WUCZKJIMJNBDRR-UHFFFAOYSA-N 2 0 351.451 -1.379 20 0 FAADRP CC[NH+](CC)CC(=O)N1CCN(C(=O)C(=O)NCC[NH2+]C2CC2)CC1 ZINC000642919786 482675039 /nfs/dbraw/zinc/67/50/39/482675039.db2.gz GLSFEHFAMKSTDQ-UHFFFAOYSA-N 2 0 353.467 -1.133 20 0 FAADRP C[N@@H+]1CCC[C@@H]1C(=O)N1CCN(C(=O)C(=O)NCC2([NH3+])CCC2)CC1 ZINC000642978011 482756160 /nfs/dbraw/zinc/75/61/60/482756160.db2.gz VESVJNQOHINAGG-CYBMUJFWSA-N 2 0 351.451 -1.251 20 0 FAADRP C[N@@H+]1CCC[C@H]1C(=O)N1CCN(C(=O)C(=O)NCC2([NH3+])CCC2)CC1 ZINC000642978012 482755640 /nfs/dbraw/zinc/75/56/40/482755640.db2.gz VESVJNQOHINAGG-ZDUSSCGKSA-N 2 0 351.451 -1.251 20 0 FAADRP CN1CCN(C(=O)C(=O)N2CCN([C@@H]3CCC[N@H+](C)C3)CC2)[C@@H](C[NH3+])C1 ZINC000643576967 482535171 /nfs/dbraw/zinc/53/51/71/482535171.db2.gz UHAPLYBTWMBALI-CVEARBPZSA-N 2 0 366.510 -1.674 20 0 FAADRP CN1CCN(C(=O)C(=O)N2CCN([C@H]3CCC[N@H+](C)C3)CC2)[C@@H](C[NH3+])C1 ZINC000643576968 482536076 /nfs/dbraw/zinc/53/60/76/482536076.db2.gz UHAPLYBTWMBALI-HOTGVXAUSA-N 2 0 366.510 -1.674 20 0 FAADRP CN1CCN(C(=O)C(=O)N2CCN([C@@H]3CCC[N@H+](C)C3)CC2)[C@H](C[NH3+])C1 ZINC000643576969 482536015 /nfs/dbraw/zinc/53/60/15/482536015.db2.gz UHAPLYBTWMBALI-HZPDHXFCSA-N 2 0 366.510 -1.674 20 0 FAADRP CN1CCN(C(=O)C(=O)N2CCN([C@H]3CCC[N@H+](C)C3)CC2)[C@H](C[NH3+])C1 ZINC000643576970 482535258 /nfs/dbraw/zinc/53/52/58/482535258.db2.gz UHAPLYBTWMBALI-JKSUJKDBSA-N 2 0 366.510 -1.674 20 0 FAADRP C[C@@H]([NH3+])[C@@H]1CN(C(=O)C(=O)N(C)CCC[N@H+](C)CCN(C)C)CCO1 ZINC000643577467 482535109 /nfs/dbraw/zinc/53/51/09/482535109.db2.gz JOPJXRYRMDORJJ-CABCVRRESA-N 2 0 357.499 -1.097 20 0 FAADRP C[C@H]([NH3+])[C@@H]1CN(C(=O)C(=O)N(C)CCC[N@H+](C)CCN(C)C)CCO1 ZINC000643577471 482535675 /nfs/dbraw/zinc/53/56/75/482535675.db2.gz JOPJXRYRMDORJJ-GJZGRUSLSA-N 2 0 357.499 -1.097 20 0 FAADRP C[C@@H]([NH3+])[C@H]1CN(C(=O)C(=O)N(C)CCC[N@H+](C)CCN(C)C)CCO1 ZINC000643577473 482534995 /nfs/dbraw/zinc/53/49/95/482534995.db2.gz JOPJXRYRMDORJJ-HUUCEWRRSA-N 2 0 357.499 -1.097 20 0 FAADRP C[C@H]([NH3+])[C@H]1CN(C(=O)C(=O)N(C)CCC[N@H+](C)CCN(C)C)CCO1 ZINC000643577474 482535081 /nfs/dbraw/zinc/53/50/81/482535081.db2.gz JOPJXRYRMDORJJ-LSDHHAIUSA-N 2 0 357.499 -1.097 20 0 FAADRP CN1CCN(C(=O)C(=O)N2CCC(C[NH+]3CCOCC3)CC2)[C@@H](C[NH3+])C1 ZINC000643577841 482535330 /nfs/dbraw/zinc/53/53/30/482535330.db2.gz YYUIYQHEKRLXHK-INIZCTEOSA-N 2 0 367.494 -1.342 20 0 FAADRP CN1CCN(C(=O)C(=O)N2CCC(C[NH+]3CCOCC3)CC2)[C@H](C[NH3+])C1 ZINC000643577842 482535879 /nfs/dbraw/zinc/53/58/79/482535879.db2.gz YYUIYQHEKRLXHK-MRXNPFEDSA-N 2 0 367.494 -1.342 20 0 FAADRP C[N@@H+]1CCC[C@H]1C(=O)N1CCN(C(=O)C(=O)N2CCC[NH2+]CC2)CC1 ZINC000643580955 482535614 /nfs/dbraw/zinc/53/56/14/482535614.db2.gz CCLSAZMONNMWJK-AWEZNQCLSA-N 2 0 351.451 -1.427 20 0 FAADRP C[N@@H+]1CCC[C@@H]1C(=O)N1CCN(C(=O)C(=O)N2CCC[NH2+]CC2)CC1 ZINC000643580956 482535362 /nfs/dbraw/zinc/53/53/62/482535362.db2.gz CCLSAZMONNMWJK-CQSZACIVSA-N 2 0 351.451 -1.427 20 0 FAADRP O=C(C[NH+]1CCCC1)N1CCN(C(=O)C(=O)N2CC[C@@H]3C[NH2+]C[C@@H]32)CC1 ZINC000643593947 482537655 /nfs/dbraw/zinc/53/76/55/482537655.db2.gz LOQJOMXOTZMTGL-CABCVRRESA-N 2 0 363.462 -1.427 20 0 FAADRP O=C(CCNC(=O)[C@@H]1CCC[NH2+]1)N[C@@H]1CC[N@H+](CCN2CCOCC2)C1 ZINC000646009610 483415169 /nfs/dbraw/zinc/41/51/69/483415169.db2.gz WZHFGUNRDMATAF-CVEARBPZSA-N 2 0 367.494 -1.233 20 0 FAADRP O=C(CCNC(=O)[C@@H]1CCC[NH2+]1)N[C@H]1CC[N@H+](CCN2CCOCC2)C1 ZINC000646009611 483415111 /nfs/dbraw/zinc/41/51/11/483415111.db2.gz WZHFGUNRDMATAF-HOTGVXAUSA-N 2 0 367.494 -1.233 20 0 FAADRP O=C(CCNC(=O)[C@H]1CCC[NH2+]1)N[C@@H]1CC[N@H+](CCN2CCOCC2)C1 ZINC000646009612 483414609 /nfs/dbraw/zinc/41/46/09/483414609.db2.gz WZHFGUNRDMATAF-HZPDHXFCSA-N 2 0 367.494 -1.233 20 0 FAADRP O=C(CCNC(=O)[C@H]1CCC[NH2+]1)N[C@H]1CC[N@H+](CCN2CCOCC2)C1 ZINC000646009613 483415319 /nfs/dbraw/zinc/41/53/19/483415319.db2.gz WZHFGUNRDMATAF-JKSUJKDBSA-N 2 0 367.494 -1.233 20 0 FAADRP O=C(C[C@]1(C(=O)N2C[C@H]3C[NH2+]C[C@H]3C2)CC[NH2+]C1)N1C[C@H]2C[NH2+]C[C@H]2C1 ZINC000647113632 482569395 /nfs/dbraw/zinc/56/93/95/482569395.db2.gz UGOLRLSGZIBTAI-NTODXPRQSA-N 3 0 361.490 -1.288 20 0 FAADRP O=C(C[C@@]1(C(=O)N2C[C@H]3C[NH2+]C[C@H]3C2)CC[NH2+]C1)N1C[C@H]2C[NH2+]C[C@H]2C1 ZINC000647113633 482569541 /nfs/dbraw/zinc/56/95/41/482569541.db2.gz UGOLRLSGZIBTAI-WPECMILSSA-N 3 0 361.490 -1.288 20 0 FAADRP C[NH+](C)C[C@@H](CO)NC(=O)[C@@H]1CCCC[C@H]1C(=O)N[C@H](CO)C[NH+](C)C ZINC000647709973 482820389 /nfs/dbraw/zinc/82/03/89/482820389.db2.gz DYIRWLLWEUAMRD-CAOSSQGBSA-N 2 0 372.510 -1.130 20 0 FAADRP C[NH+](C)C[C@H](CO)NC(=O)[C@@H]1CCCC[C@H]1C(=O)N[C@@H](CO)C[NH+](C)C ZINC000647709974 482820531 /nfs/dbraw/zinc/82/05/31/482820531.db2.gz DYIRWLLWEUAMRD-KLHDSHLOSA-N 2 0 372.510 -1.130 20 0 FAADRP C[NH+](C)C[C@H](CO)NC(=O)[C@@H]1CCCC[C@H]1C(=O)N[C@H](CO)C[NH+](C)C ZINC000647709975 482820549 /nfs/dbraw/zinc/82/05/49/482820549.db2.gz DYIRWLLWEUAMRD-QKPAOTATSA-N 2 0 372.510 -1.130 20 0 FAADRP O=C(C[C@@]1(C(=O)NC[C@@H]2C[C@H](F)C[NH2+]2)CC[NH2+]C1)NC[C@@H]1C[C@H](F)C[NH2+]1 ZINC000648141065 482537454 /nfs/dbraw/zinc/53/74/54/482537454.db2.gz ZOQBZTBLCBSKGU-DEEHTKSCSA-N 3 0 373.448 -1.011 20 0 FAADRP O=C(C[C@]1(C(=O)NC[C@@H]2C[C@H](F)C[NH2+]2)CC[NH2+]C1)NC[C@@H]1C[C@H](F)C[NH2+]1 ZINC000648141066 482537146 /nfs/dbraw/zinc/53/71/46/482537146.db2.gz ZOQBZTBLCBSKGU-GGOFEBJYSA-N 3 0 373.448 -1.011 20 0 FAADRP C[C@H]1C(=O)N(CC[NH+](C)C)CN1C(=O)[C@H]1CC(=O)N(CC[NH+](C)C)C1 ZINC000649075885 483562524 /nfs/dbraw/zinc/56/25/24/483562524.db2.gz LYNDPRXUYNLFSJ-KBPBESRZSA-N 2 0 353.467 -1.025 20 0 FAADRP C[C@@H]1C(=O)N(CC[NH+](C)C)CN1C(=O)[C@H]1CC(=O)N(CC[NH+](C)C)C1 ZINC000649075886 483562587 /nfs/dbraw/zinc/56/25/87/483562587.db2.gz LYNDPRXUYNLFSJ-KGLIPLIRSA-N 2 0 353.467 -1.025 20 0 FAADRP C[C@H]1C(=O)N(CC[NH+](C)C)CN1C(=O)[C@@H]1CC(=O)N(CC[NH+](C)C)C1 ZINC000649075887 483563754 /nfs/dbraw/zinc/56/37/54/483563754.db2.gz LYNDPRXUYNLFSJ-UONOGXRCSA-N 2 0 353.467 -1.025 20 0 FAADRP C[C@@H]1C(=O)N(CC[NH+](C)C)CN1C(=O)[C@@H]1CC(=O)N(CC[NH+](C)C)C1 ZINC000649075888 483563360 /nfs/dbraw/zinc/56/33/60/483563360.db2.gz LYNDPRXUYNLFSJ-ZIAGYGMSSA-N 2 0 353.467 -1.025 20 0 FAADRP CC(C)[C@H]([NH3+])C(=O)NCC(=O)N[C@H]1CC[N@H+](CCN2CCOCC2)C1 ZINC000649335447 483601294 /nfs/dbraw/zinc/60/12/94/483601294.db2.gz AUCUEPBLKCUQSA-HOCLYGCPSA-N 2 0 355.483 -1.391 20 0 FAADRP CC(C)[C@H]([NH3+])C(=O)NCC(=O)N[C@@H]1CC[N@H+](CCN2CCOCC2)C1 ZINC000649335448 483601825 /nfs/dbraw/zinc/60/18/25/483601825.db2.gz AUCUEPBLKCUQSA-ZBFHGGJFSA-N 2 0 355.483 -1.391 20 0 FAADRP [NH3+][C@H]1CCCCN(CC(=O)N[C@@H]2CC[N@H+](CCN3CCOCC3)C2)C1=O ZINC000649335732 483601898 /nfs/dbraw/zinc/60/18/98/483601898.db2.gz VQBWWOPMQOYTTR-CVEARBPZSA-N 2 0 367.494 -1.151 20 0 FAADRP [NH3+][C@H]1CCCCN(CC(=O)N[C@H]2CC[N@H+](CCN3CCOCC3)C2)C1=O ZINC000649335733 483602588 /nfs/dbraw/zinc/60/25/88/483602588.db2.gz VQBWWOPMQOYTTR-HOTGVXAUSA-N 2 0 367.494 -1.151 20 0 FAADRP [NH3+][C@@H]1CCCCN(CC(=O)N[C@@H]2CC[N@H+](CCN3CCOCC3)C2)C1=O ZINC000649335734 483602647 /nfs/dbraw/zinc/60/26/47/483602647.db2.gz VQBWWOPMQOYTTR-HZPDHXFCSA-N 2 0 367.494 -1.151 20 0 FAADRP [NH3+][C@@H]1CCCCN(CC(=O)N[C@H]2CC[N@H+](CCN3CCOCC3)C2)C1=O ZINC000649335735 483601521 /nfs/dbraw/zinc/60/15/21/483601521.db2.gz VQBWWOPMQOYTTR-JKSUJKDBSA-N 2 0 367.494 -1.151 20 0 FAADRP C[NH+]1CCN(C[C@@H]2CN(C(=O)CN3CCCC[C@H]([NH3+])C3=O)CCO2)CC1 ZINC000649352447 483605301 /nfs/dbraw/zinc/60/53/01/483605301.db2.gz SGSKOAGSIJCCNC-CVEARBPZSA-N 2 0 367.494 -1.199 20 0 FAADRP C[NH+]1CCN(C[C@H]2CN(C(=O)CN3CCCC[C@H]([NH3+])C3=O)CCO2)CC1 ZINC000649352448 483604759 /nfs/dbraw/zinc/60/47/59/483604759.db2.gz SGSKOAGSIJCCNC-HOTGVXAUSA-N 2 0 367.494 -1.199 20 0 FAADRP C[NH+]1CCN(C[C@@H]2CN(C(=O)CN3CCCC[C@@H]([NH3+])C3=O)CCO2)CC1 ZINC000649352449 483605653 /nfs/dbraw/zinc/60/56/53/483605653.db2.gz SGSKOAGSIJCCNC-HZPDHXFCSA-N 2 0 367.494 -1.199 20 0 FAADRP C[NH+]1CCN(C[C@H]2CN(C(=O)CN3CCCC[C@@H]([NH3+])C3=O)CCO2)CC1 ZINC000649352450 483605351 /nfs/dbraw/zinc/60/53/51/483605351.db2.gz SGSKOAGSIJCCNC-JKSUJKDBSA-N 2 0 367.494 -1.199 20 0 FAADRP [NH3+]C[C@H]1CN(C(=O)[C@@H]2CC(=O)N(CCN3CCOCC3)C2)CCCO1 ZINC000649368186 483607102 /nfs/dbraw/zinc/60/71/02/483607102.db2.gz QGJQCJRYQPKUAJ-CABCVRRESA-N 2 0 354.451 -1.257 20 0 FAADRP [NH3+]C[C@H]1CN(C(=O)[C@H]2CC(=O)N(CCN3CCOCC3)C2)CCCO1 ZINC000649368187 483606607 /nfs/dbraw/zinc/60/66/07/483606607.db2.gz QGJQCJRYQPKUAJ-GJZGRUSLSA-N 2 0 354.451 -1.257 20 0 FAADRP [NH3+]C[C@@H]1CN(C(=O)[C@@H]2CC(=O)N(CCN3CCOCC3)C2)CCCO1 ZINC000649368188 483607042 /nfs/dbraw/zinc/60/70/42/483607042.db2.gz QGJQCJRYQPKUAJ-HUUCEWRRSA-N 2 0 354.451 -1.257 20 0 FAADRP [NH3+]C[C@@H]1CN(C(=O)[C@H]2CC(=O)N(CCN3CCOCC3)C2)CCCO1 ZINC000649368189 483606529 /nfs/dbraw/zinc/60/65/29/483606529.db2.gz QGJQCJRYQPKUAJ-LSDHHAIUSA-N 2 0 354.451 -1.257 20 0 FAADRP Cn1cnc2c1c(=O)n(CCC[N@H+](C)CCN1CC[NH2+]CC1)c(=O)n2C ZINC000649409630 483608200 /nfs/dbraw/zinc/60/82/00/483608200.db2.gz GFCDDKTYEPWZAJ-UHFFFAOYSA-N 2 0 363.466 -1.339 20 0 FAADRP Cn1cnc2c1c(=O)n(CCC[NH+]1CCC(O)(C[NH3+])CC1)c(=O)n2C ZINC000649420838 483609614 /nfs/dbraw/zinc/60/96/14/483609614.db2.gz CRVPUNRTEVLWSS-UHFFFAOYSA-N 2 0 350.423 -1.391 20 0 FAADRP C[NH+](C)CCCN1C(=O)C[C@H](N2CCN(CC[NH+](C)C)C(=O)C2)C1=O ZINC000649482308 483617047 /nfs/dbraw/zinc/61/70/47/483617047.db2.gz IIWYFDRPUDTIAA-AWEZNQCLSA-N 2 0 353.467 -1.229 20 0 FAADRP C[NH+](C)CCCN1C(=O)C[C@@H](N2CCN(CC[NH+](C)C)C(=O)C2)C1=O ZINC000649482309 483617675 /nfs/dbraw/zinc/61/76/75/483617675.db2.gz IIWYFDRPUDTIAA-CQSZACIVSA-N 2 0 353.467 -1.229 20 0 FAADRP C[NH+](C)CCN1CCN(CCN2CCN(CC[NH+](C)C)C(=O)C2)CC1=O ZINC000649686412 483632397 /nfs/dbraw/zinc/63/23/97/483632397.db2.gz GYMMUWRQWAJZBF-UHFFFAOYSA-N 2 0 368.526 -1.602 20 0 FAADRP CN1CCN(C(=O)CCNC(=O)N2CCN(CC[NH+](C)C)C(=O)C2)CC1 ZINC000650639918 482672847 /nfs/dbraw/zinc/67/28/47/482672847.db2.gz FGINZYNABYJPHK-UHFFFAOYSA-N 2 0 368.482 -1.434 20 0 FAADRP CNC(=O)CN1CCC(NC(=O)N2CCN(CC[NH+](C)C)C(=O)C2)CC1 ZINC000650663510 482676618 /nfs/dbraw/zinc/67/66/18/482676618.db2.gz RSXIRHZWKNLUEL-UHFFFAOYSA-N 2 0 368.482 -1.388 20 0 FAADRP C[NH+](C)CCN(CC[NH+](C)C)C(=O)c1nc(N)nc(N2CCOCC2)n1 ZINC000651263858 482768300 /nfs/dbraw/zinc/76/83/00/482768300.db2.gz PAOUTXQUFSQHTG-UHFFFAOYSA-N 2 0 366.470 -1.314 20 0 FAADRP O[C@@H]1CC[NH+](C2CN(c3cc(N4CC([N@@H+]5CC[C@@H](O)C5)C4)ncn3)C2)C1 ZINC000651450829 482781264 /nfs/dbraw/zinc/78/12/64/482781264.db2.gz HDLTYFBNDRDCTB-HZPDHXFCSA-N 2 0 360.462 -1.013 20 0 FAADRP O[C@@H]1CC[NH+](C2CN(c3cncc(N4CC([N@@H+]5CC[C@@H](O)C5)C4)n3)C2)C1 ZINC000651451336 482781557 /nfs/dbraw/zinc/78/15/57/482781557.db2.gz MKFMQQPJUASWFM-HZPDHXFCSA-N 2 0 360.462 -1.013 20 0 FAADRP CCO[C@@H]1CN(CC(=O)NCCCN(C)S(C)(=O)=O)C[C@H]1C[NH3+] ZINC000652356848 482853467 /nfs/dbraw/zinc/85/34/67/482853467.db2.gz LFKAMINYGUFGKQ-CHWSQXEVSA-N 2 0 350.485 -1.320 20 0 FAADRP C[NH+](C)CCN1CCN(C(=O)C(=O)N2CC[C@H]([NH+]3CCCC3)C2)CC1=O ZINC000652427434 482858847 /nfs/dbraw/zinc/85/88/47/482858847.db2.gz VUYHBVXCPCCIPU-HNNXBMFYSA-N 2 0 365.478 -1.085 20 0 FAADRP C[NH+](C)CCN1CCN(C(=O)C(=O)N2CC[C@@H]([NH+]3CCCC3)C2)CC1=O ZINC000652427435 482858167 /nfs/dbraw/zinc/85/81/67/482858167.db2.gz VUYHBVXCPCCIPU-OAHLLOKOSA-N 2 0 365.478 -1.085 20 0 FAADRP C[NH+](C)CCN1CCN(C(=O)C(=O)N2CCC[C@H]([NH+](C)C)C2)CC1=O ZINC000652429327 482856203 /nfs/dbraw/zinc/85/62/03/482856203.db2.gz KBVOIHPVVUNQRL-AWEZNQCLSA-N 2 0 353.467 -1.229 20 0 FAADRP C[NH+](C)CCN1CCN(C(=O)C(=O)N2CCC[C@@H]([NH+](C)C)C2)CC1=O ZINC000652429328 482856221 /nfs/dbraw/zinc/85/62/21/482856221.db2.gz KBVOIHPVVUNQRL-CQSZACIVSA-N 2 0 353.467 -1.229 20 0 FAADRP CN(C(=O)C(=O)N1CCN(CC[NH+](C)C)C(=O)C1)[C@H]1CC[N@@H+](C2CC2)C1 ZINC000652433991 482858139 /nfs/dbraw/zinc/85/81/39/482858139.db2.gz MPKGIJPRWNDSCY-HNNXBMFYSA-N 2 0 365.478 -1.086 20 0 FAADRP CN(C(=O)C(=O)N1CCN(CC[NH+](C)C)C(=O)C1)[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000652433992 482858291 /nfs/dbraw/zinc/85/82/91/482858291.db2.gz MPKGIJPRWNDSCY-OAHLLOKOSA-N 2 0 365.478 -1.086 20 0 FAADRP COCCN(CC[NH+](C)C)C(=O)C(=O)N1CCN(CC[NH+](C)C)C(=O)C1 ZINC000652434240 482858244 /nfs/dbraw/zinc/85/82/44/482858244.db2.gz WYLFJMKOFLTZFD-UHFFFAOYSA-N 2 0 371.482 -1.745 20 0 FAADRP C[NH+](C)CCN1CCN(C(=O)C(=O)N2CC[C@H]3CC[C@@H](C2)[N@@H+]3C)CC1=O ZINC000652459425 482859961 /nfs/dbraw/zinc/85/99/61/482859961.db2.gz QGJCYEKCAOQQMX-CABCVRRESA-N 2 0 365.478 -1.086 20 0 FAADRP CN(CC[N@H+](C)C1CC1)C(=O)C(=O)N1CCN(CC[NH+](C)C)C(=O)C1 ZINC000652473405 482861614 /nfs/dbraw/zinc/86/16/14/482861614.db2.gz GBTMGOHNQMILJK-UHFFFAOYSA-N 2 0 353.467 -1.229 20 0 FAADRP C[NH+](C)CCN1CCN(C(=O)C(=O)N2CC[C@H]3CC[N@H+](C)C[C@@H]32)CC1=O ZINC000652480460 482862547 /nfs/dbraw/zinc/86/25/47/482862547.db2.gz GCXFTVFRHKHTCK-CABCVRRESA-N 2 0 365.478 -1.229 20 0 FAADRP C[NH+](C)CCN1CCN(C(=O)C(=O)N2CC[C@@H]3CC[N@H+](C)C[C@@H]32)CC1=O ZINC000652480461 482862113 /nfs/dbraw/zinc/86/21/13/482862113.db2.gz GCXFTVFRHKHTCK-GJZGRUSLSA-N 2 0 365.478 -1.229 20 0 FAADRP C[NH+](C)CCN1CCN(C(=O)C(=O)N2CC[C@H]3CC[N@H+](C)C[C@H]32)CC1=O ZINC000652480462 482862260 /nfs/dbraw/zinc/86/22/60/482862260.db2.gz GCXFTVFRHKHTCK-HUUCEWRRSA-N 2 0 365.478 -1.229 20 0 FAADRP C[NH+](C)CCN1CCN(C(=O)C(=O)N2CC[C@@H]3CC[N@H+](C)C[C@H]32)CC1=O ZINC000652480463 482861983 /nfs/dbraw/zinc/86/19/83/482861983.db2.gz GCXFTVFRHKHTCK-LSDHHAIUSA-N 2 0 365.478 -1.229 20 0 FAADRP CN(C[C@@H]1CCC[N@@H+]1C)C(=O)C(=O)N1CCN(CC[NH+](C)C)C(=O)C1 ZINC000652490872 482863351 /nfs/dbraw/zinc/86/33/51/482863351.db2.gz DTMCIQQGTXPIQC-AWEZNQCLSA-N 2 0 353.467 -1.229 20 0 FAADRP CN(C[C@H]1CCC[N@@H+]1C)C(=O)C(=O)N1CCN(CC[NH+](C)C)C(=O)C1 ZINC000652490873 482863665 /nfs/dbraw/zinc/86/36/65/482863665.db2.gz DTMCIQQGTXPIQC-CQSZACIVSA-N 2 0 353.467 -1.229 20 0 FAADRP C[NH+](C)CCN1CCN(C(=O)C(=O)N2CC[C@H]([NH+]3CC=CC3)C2)CC1=O ZINC000652505337 482863791 /nfs/dbraw/zinc/86/37/91/482863791.db2.gz FSZAYTXUAQXXBR-HNNXBMFYSA-N 2 0 363.462 -1.309 20 0 FAADRP C[NH+](C)CCN1CCN(C(=O)C(=O)N2CC[C@@H]([NH+]3CC=CC3)C2)CC1=O ZINC000652505338 482865297 /nfs/dbraw/zinc/86/52/97/482865297.db2.gz FSZAYTXUAQXXBR-OAHLLOKOSA-N 2 0 363.462 -1.309 20 0 FAADRP C[NH+](C)CCN1CCN(C(=O)C(=O)N2C[C@@H]3CC[N@H+](C)[C@@H]3C2)CC1=O ZINC000652505382 482865567 /nfs/dbraw/zinc/86/55/67/482865567.db2.gz JVQXZBXUAVOVQM-UONOGXRCSA-N 2 0 351.451 -1.619 20 0 FAADRP C[NH+](C)CCN1CCN(C(=O)C(=O)N2CC[C@@]3(CC[N@H+](C)C3)C2)CC1=O ZINC000652505430 482865732 /nfs/dbraw/zinc/86/57/32/482865732.db2.gz QEMUKDKSJYKESL-GOSISDBHSA-N 2 0 365.478 -1.227 20 0 FAADRP C[NH+](C)CCN1CCN(C(=O)C(=O)N2CC[C@]3(CC[N@H+](C)C3)C2)CC1=O ZINC000652505431 482865325 /nfs/dbraw/zinc/86/53/25/482865325.db2.gz QEMUKDKSJYKESL-SFHVURJKSA-N 2 0 365.478 -1.227 20 0 FAADRP C[NH+](C)CCN1CCN(C(=O)C(=O)N2CCC[C@H]3C[N@H+](C)C[C@H]32)CC1=O ZINC000652505447 482865248 /nfs/dbraw/zinc/86/52/48/482865248.db2.gz SJQPCLHVDALGAG-LSDHHAIUSA-N 2 0 365.478 -1.229 20 0 FAADRP C[NH+](C)CCn1cc(NC(=O)C(=O)N2CCN([C@H]3CC[NH2+]C3)CC2)cn1 ZINC000652623788 482874383 /nfs/dbraw/zinc/87/43/83/482874383.db2.gz RNTBCFGXRZIGMI-HNNXBMFYSA-N 2 0 363.466 -1.111 20 0 FAADRP C[NH+](C)CCn1cc(NC(=O)C(=O)N2CCN([C@@H]3CC[NH2+]C3)CC2)cn1 ZINC000652623789 482873427 /nfs/dbraw/zinc/87/34/27/482873427.db2.gz RNTBCFGXRZIGMI-OAHLLOKOSA-N 2 0 363.466 -1.111 20 0 FAADRP CCO[C@@H]1CN(C(=O)C(=O)NC2CCN(CC[NH+](C)C)CC2)C[C@H]1C[NH3+] ZINC000652679090 482905681 /nfs/dbraw/zinc/90/56/81/482905681.db2.gz WNJHRSGOZQWCEC-GDBMZVCRSA-N 2 0 369.510 -1.049 20 0 FAADRP CCO[C@@H]1CN(C(=O)C(=O)NCCN2CC[N@H+](C)C(C)(C)C2)C[C@H]1C[NH3+] ZINC000652679156 482905505 /nfs/dbraw/zinc/90/55/05/482905505.db2.gz YXDAMSHEFQTFGL-HUUCEWRRSA-N 2 0 369.510 -1.049 20 0 FAADRP CCO[C@@H]1CN(C(=O)C(=O)NCCCC[NH+]2CCN(C)CC2)C[C@H]1C[NH3+] ZINC000652683785 482907005 /nfs/dbraw/zinc/90/70/05/482907005.db2.gz XUSVOKCOIHEUSP-HZPDHXFCSA-N 2 0 369.510 -1.048 20 0 FAADRP CCO[C@@H]1CN(C(=O)C(=O)NC[C@H](C)C[NH+]2CCN(C)CC2)C[C@H]1C[NH3+] ZINC000652694462 482832026 /nfs/dbraw/zinc/83/20/26/482832026.db2.gz XYPDITQVHWDVML-ARFHVFGLSA-N 2 0 369.510 -1.192 20 0 FAADRP CCO[C@@H]1CN(C(=O)C(=O)NC[C@@H](C)C[NH+]2CCN(C)CC2)C[C@H]1C[NH3+] ZINC000652694463 482831752 /nfs/dbraw/zinc/83/17/52/482831752.db2.gz XYPDITQVHWDVML-BZUAXINKSA-N 2 0 369.510 -1.192 20 0 FAADRP [NH3+]CC1(CCNC(=O)C(=O)N2CCN(C(=O)C[NH+]3CCCC3)CC2)CC1 ZINC000652712413 482964063 /nfs/dbraw/zinc/96/40/63/482964063.db2.gz QRKHCUZNLFWBEB-UHFFFAOYSA-N 2 0 365.478 -1.002 20 0 FAADRP C[N@@H+]1CCC[C@H]1C(=O)N1CCN(C(=O)C(=O)NCCC2(C[NH3+])CC2)CC1 ZINC000652712631 482963964 /nfs/dbraw/zinc/96/39/64/482963964.db2.gz XEJXMZRFPWMKAH-AWEZNQCLSA-N 2 0 365.478 -1.003 20 0 FAADRP C[N@@H+]1CCC[C@@H]1C(=O)N1CCN(C(=O)C(=O)NCCC2(C[NH3+])CC2)CC1 ZINC000652712632 482963227 /nfs/dbraw/zinc/96/32/27/482963227.db2.gz XEJXMZRFPWMKAH-CQSZACIVSA-N 2 0 365.478 -1.003 20 0 FAADRP CCO[C@@H]1CN(C(=O)C(=O)N(C)CCCN2CC[NH+](C)CC2)C[C@H]1C[NH3+] ZINC000652728775 483013051 /nfs/dbraw/zinc/01/30/51/483013051.db2.gz AATOYAQBVBXBKK-HZPDHXFCSA-N 2 0 369.510 -1.096 20 0 FAADRP CCO[C@@H]1CN(C(=O)C(=O)N(CC[NH+](C)C)CC[NH+](C)C)C[C@H]1C[NH3+] ZINC000652728847 483013512 /nfs/dbraw/zinc/01/35/12/483013512.db2.gz CYFPZFBPGOCWPI-HUUCEWRRSA-N 3 0 357.499 -1.240 20 0 FAADRP C[NH+](C)CCN1C[C@@H](C(=O)N2CCN(CC[NH+](C)C)C(=O)C2)CC1=O ZINC000652735143 483075218 /nfs/dbraw/zinc/07/52/18/483075218.db2.gz CLZIUMIHRLWZOB-AWEZNQCLSA-N 2 0 353.467 -1.371 20 0 FAADRP C[NH+](C)CCN1C[C@H](C(=O)N2CCN(CC[NH+](C)C)C(=O)C2)CC1=O ZINC000652735144 483074783 /nfs/dbraw/zinc/07/47/83/483074783.db2.gz CLZIUMIHRLWZOB-CQSZACIVSA-N 2 0 353.467 -1.371 20 0 FAADRP C[NH+](C)CCNC(=O)Cn1cc(NC(=O)[C@]23C[NH2+]C[C@H]2COC3)cn1 ZINC000653121761 482567390 /nfs/dbraw/zinc/56/73/90/482567390.db2.gz BDVJRRULBZNJAD-LRDDRELGSA-N 2 0 350.423 -1.265 20 0 FAADRP O=C(N1CC[C@@H]2[C@@H](C1)NC(=O)N2C1CC[NH2+]CC1)[C@]12C[NH2+]C[C@H]1COC2 ZINC000653164464 482651811 /nfs/dbraw/zinc/65/18/11/482651811.db2.gz NAUFCQBIIQQQIN-AZAGILFBSA-N 2 0 363.462 -1.031 20 0 FAADRP O=C(N1CC[C@@H]2[C@H](C1)NC(=O)N2C1CC[NH2+]CC1)[C@]12C[NH2+]C[C@H]1COC2 ZINC000653164465 482650954 /nfs/dbraw/zinc/65/09/54/482650954.db2.gz NAUFCQBIIQQQIN-FRQROOTJSA-N 2 0 363.462 -1.031 20 0 FAADRP O=C(N1CC[C@H]2[C@@H](C1)NC(=O)N2C1CC[NH2+]CC1)[C@]12C[NH2+]C[C@H]1COC2 ZINC000653164466 482650916 /nfs/dbraw/zinc/65/09/16/482650916.db2.gz NAUFCQBIIQQQIN-OGIUKLMXSA-N 2 0 363.462 -1.031 20 0 FAADRP O=C(N1CC[C@H]2[C@H](C1)NC(=O)N2C1CC[NH2+]CC1)[C@]12C[NH2+]C[C@H]1COC2 ZINC000653164467 482651657 /nfs/dbraw/zinc/65/16/57/482651657.db2.gz NAUFCQBIIQQQIN-OWCBBSPXSA-N 2 0 363.462 -1.031 20 0 FAADRP CC[NH+]1CCC(NC(=O)C(=O)N2CCN(CC[NH+](C)C)C(=O)C2)CC1 ZINC000653355122 483039302 /nfs/dbraw/zinc/03/93/02/483039302.db2.gz KDIURMUJRHEZIP-UHFFFAOYSA-N 2 0 353.467 -1.181 20 0 FAADRP C[NH+](C)CCN1CCN(C(=O)C(=O)NC2CC[NH+](C3CC3)CC2)CC1=O ZINC000653361528 483059728 /nfs/dbraw/zinc/05/97/28/483059728.db2.gz RJDKLBAGRJLUKP-UHFFFAOYSA-N 2 0 365.478 -1.038 20 0 FAADRP C[NH+](C)CCN1CCN(C(=O)C(=O)N[C@@H]2CC[N@@H+]3CCC[C@H]3C2)CC1=O ZINC000653373080 483082944 /nfs/dbraw/zinc/08/29/44/483082944.db2.gz CKCPPKFIGNLTIJ-CABCVRRESA-N 2 0 365.478 -1.038 20 0 FAADRP C[NH+](C)CCN1CCN(C(=O)C(=O)N[C@H]2CC[N@@H+]3CCC[C@H]3C2)CC1=O ZINC000653373081 483083230 /nfs/dbraw/zinc/08/32/30/483083230.db2.gz CKCPPKFIGNLTIJ-GJZGRUSLSA-N 2 0 365.478 -1.038 20 0 FAADRP C[NH+](C)CCN1CCN(C(=O)C(=O)N[C@@H]2CC[N@@H+]3CCC[C@@H]3C2)CC1=O ZINC000653373082 483082527 /nfs/dbraw/zinc/08/25/27/483082527.db2.gz CKCPPKFIGNLTIJ-HUUCEWRRSA-N 2 0 365.478 -1.038 20 0 FAADRP C[NH+](C)CCN1CCN(C(=O)C(=O)N[C@H]2CC[N@@H+]3CCC[C@@H]3C2)CC1=O ZINC000653373083 483083369 /nfs/dbraw/zinc/08/33/69/483083369.db2.gz CKCPPKFIGNLTIJ-LSDHHAIUSA-N 2 0 365.478 -1.038 20 0 FAADRP C[NH+](C)CCN1CCN(C(=O)C(=O)NC[C@@H]2CC[N@@H+](C3CC3)C2)CC1=O ZINC000653374893 483085423 /nfs/dbraw/zinc/08/54/23/483085423.db2.gz RSUCARQJRVGPRK-AWEZNQCLSA-N 2 0 365.478 -1.181 20 0 FAADRP C[NH+](C)CCN1CCN(C(=O)C(=O)NC[C@H]2CC[N@@H+](C3CC3)C2)CC1=O ZINC000653374894 483084208 /nfs/dbraw/zinc/08/42/08/483084208.db2.gz RSUCARQJRVGPRK-CQSZACIVSA-N 2 0 365.478 -1.181 20 0 FAADRP C[C@H](Cn1ccnc1)NC(=O)C(=O)N1CCN(CC[NH+](C)C)C(=O)C1 ZINC000653375743 483085176 /nfs/dbraw/zinc/08/51/76/483085176.db2.gz LUBBOATVEJVKBR-CYBMUJFWSA-N 2 0 350.423 -1.380 20 0 FAADRP C[C@@H](Cn1ccnc1)NC(=O)C(=O)N1CCN(CC[NH+](C)C)C(=O)C1 ZINC000653375744 483084694 /nfs/dbraw/zinc/08/46/94/483084694.db2.gz LUBBOATVEJVKBR-ZDUSSCGKSA-N 2 0 350.423 -1.380 20 0 FAADRP C[NH+](C)CCN1CCN(C(=O)C(=O)N[C@@H]2CC[N@@H+]3CCCC[C@@H]23)CC1=O ZINC000653376498 483084452 /nfs/dbraw/zinc/08/44/52/483084452.db2.gz CDLCMZSTMOCVAT-CABCVRRESA-N 2 0 365.478 -1.038 20 0 FAADRP C[NH+](C)CCN1CCN(C(=O)C(=O)N[C@H]2CC[N@@H+]3CCCC[C@@H]23)CC1=O ZINC000653376499 483085252 /nfs/dbraw/zinc/08/52/52/483085252.db2.gz CDLCMZSTMOCVAT-GJZGRUSLSA-N 2 0 365.478 -1.038 20 0 FAADRP C[NH+](C)CCN1CCN(C(=O)C(=O)N[C@@H]2CC[N@@H+]3CCCC[C@H]23)CC1=O ZINC000653376500 483085271 /nfs/dbraw/zinc/08/52/71/483085271.db2.gz CDLCMZSTMOCVAT-HUUCEWRRSA-N 2 0 365.478 -1.038 20 0 FAADRP C[NH+](C)CCN1CCN(C(=O)C(=O)N[C@H]2CC[N@@H+]3CCCC[C@H]23)CC1=O ZINC000653376501 483084293 /nfs/dbraw/zinc/08/42/93/483084293.db2.gz CDLCMZSTMOCVAT-LSDHHAIUSA-N 2 0 365.478 -1.038 20 0 FAADRP C[NH+](C)CCN1CCN(C(=O)C(=O)N[C@@H]2CC[N@@H+](C3CC3)C2)CC1=O ZINC000653383426 483086832 /nfs/dbraw/zinc/08/68/32/483086832.db2.gz OMTOEHLZAXEHHS-CYBMUJFWSA-N 2 0 351.451 -1.428 20 0 FAADRP C[NH+](C)CCN1CCN(C(=O)C(=O)N[C@H]2CC[N@@H+](C3CC3)C2)CC1=O ZINC000653383427 483086550 /nfs/dbraw/zinc/08/65/50/483086550.db2.gz OMTOEHLZAXEHHS-ZDUSSCGKSA-N 2 0 351.451 -1.428 20 0 FAADRP COCC[N@H+](C)CCNC(=O)C(=O)N1CCN(CC[NH+](C)C)C(=O)C1 ZINC000653386574 483091687 /nfs/dbraw/zinc/09/16/87/483091687.db2.gz DDDVSWCPORYHSK-UHFFFAOYSA-N 2 0 357.455 -2.087 20 0 FAADRP CC[N@H+](CCNC(=O)C(=O)N1CCN(CC[NH+](C)C)C(=O)C1)C1CC1 ZINC000653389092 483093062 /nfs/dbraw/zinc/09/30/62/483093062.db2.gz UILKWIFXUNWSTQ-UHFFFAOYSA-N 2 0 353.467 -1.181 20 0 FAADRP C[C@H](CNC(=O)C(=O)N1CCN(CC[NH+](C)C)C(=O)C1)[N@H+](C)C1CC1 ZINC000653389577 483092895 /nfs/dbraw/zinc/09/28/95/483092895.db2.gz FMKNLFKKSODKFS-CYBMUJFWSA-N 2 0 353.467 -1.182 20 0 FAADRP C[C@@H](CNC(=O)C(=O)N1CCN(CC[NH+](C)C)C(=O)C1)[N@H+](C)C1CC1 ZINC000653389578 483092401 /nfs/dbraw/zinc/09/24/01/483092401.db2.gz FMKNLFKKSODKFS-ZDUSSCGKSA-N 2 0 353.467 -1.182 20 0 FAADRP C[NH+](C)CCN1CCN(C(=O)C(=O)N[C@H]2CC[N@H+](CC3CC3)C2)CC1=O ZINC000653392313 483094265 /nfs/dbraw/zinc/09/42/65/483094265.db2.gz YVVSHZOBADOLSK-HNNXBMFYSA-N 2 0 365.478 -1.181 20 0 FAADRP C[NH+](C)CCN1CCN(C(=O)C(=O)N[C@@H]2CC[N@H+](CC3CC3)C2)CC1=O ZINC000653392314 483094325 /nfs/dbraw/zinc/09/43/25/483094325.db2.gz YVVSHZOBADOLSK-OAHLLOKOSA-N 2 0 365.478 -1.181 20 0 FAADRP COCC[N@@H+]1CC[C@H](NC(=O)C(=O)N2CCN(CC[NH+](C)C)C(=O)C2)C1 ZINC000653392779 483093928 /nfs/dbraw/zinc/09/39/28/483093928.db2.gz LJCYKQVAIUMLKL-AWEZNQCLSA-N 2 0 369.466 -1.944 20 0 FAADRP COCC[N@@H+]1CC[C@@H](NC(=O)C(=O)N2CCN(CC[NH+](C)C)C(=O)C2)C1 ZINC000653392780 483094241 /nfs/dbraw/zinc/09/42/41/483094241.db2.gz LJCYKQVAIUMLKL-CQSZACIVSA-N 2 0 369.466 -1.944 20 0 FAADRP CN1CC[N@H+](C)C[C@@H]1CNC(=O)C(=O)N1CCN(CC[NH+](C)C)C(=O)C1 ZINC000653396662 483097499 /nfs/dbraw/zinc/09/74/99/483097499.db2.gz DJZIUKSOLGZCJH-AWEZNQCLSA-N 2 0 368.482 -2.419 20 0 FAADRP CN1CC[N@H+](C)C[C@H]1CNC(=O)C(=O)N1CCN(CC[NH+](C)C)C(=O)C1 ZINC000653396663 483098019 /nfs/dbraw/zinc/09/80/19/483098019.db2.gz DJZIUKSOLGZCJH-CQSZACIVSA-N 2 0 368.482 -2.419 20 0 FAADRP C[C@H]1C[C@@H](NC(=O)C(=O)N2CCN(CC[NH+](C)C)C(=O)C2)CC[N@@H+]1C ZINC000653396958 483097657 /nfs/dbraw/zinc/09/76/57/483097657.db2.gz JMWMJOCGJCCSQW-KBPBESRZSA-N 2 0 353.467 -1.182 20 0 FAADRP C[C@@H]1C[C@@H](NC(=O)C(=O)N2CCN(CC[NH+](C)C)C(=O)C2)CC[N@@H+]1C ZINC000653396959 483098009 /nfs/dbraw/zinc/09/80/09/483098009.db2.gz JMWMJOCGJCCSQW-KGLIPLIRSA-N 2 0 353.467 -1.182 20 0 FAADRP C[C@H]1C[C@H](NC(=O)C(=O)N2CCN(CC[NH+](C)C)C(=O)C2)CC[N@@H+]1C ZINC000653396960 483097255 /nfs/dbraw/zinc/09/72/55/483097255.db2.gz JMWMJOCGJCCSQW-UONOGXRCSA-N 2 0 353.467 -1.182 20 0 FAADRP C[C@@H]1C[C@H](NC(=O)C(=O)N2CCN(CC[NH+](C)C)C(=O)C2)CC[N@@H+]1C ZINC000653396961 483097981 /nfs/dbraw/zinc/09/79/81/483097981.db2.gz JMWMJOCGJCCSQW-ZIAGYGMSSA-N 2 0 353.467 -1.182 20 0 FAADRP CN1CCN(C(=O)C(=O)N[C@@H]2CCN(C3CC[NH+](C)CC3)C2)CC1=O ZINC000653398965 483099550 /nfs/dbraw/zinc/09/95/50/483099550.db2.gz VIGVRNOYYJAMCC-CYBMUJFWSA-N 2 0 351.451 -1.428 20 0 FAADRP CN1CCN(C(=O)C(=O)N[C@H]2CCN(C3CC[NH+](C)CC3)C2)CC1=O ZINC000653398966 483098754 /nfs/dbraw/zinc/09/87/54/483098754.db2.gz VIGVRNOYYJAMCC-ZDUSSCGKSA-N 2 0 351.451 -1.428 20 0 FAADRP C[NH+](C)CCN1CCN(C(=O)C(=O)NCC2([NH+](C)C)CCC2)CC1=O ZINC000653405194 483100803 /nfs/dbraw/zinc/10/08/03/483100803.db2.gz WBLAQIJCIADGQF-UHFFFAOYSA-N 2 0 353.467 -1.181 20 0 FAADRP C[NH+](C)CCOCCNC(=O)C(=O)N1CCN(CC[NH+](C)C)C(=O)C1 ZINC000653416147 483109537 /nfs/dbraw/zinc/10/95/37/483109537.db2.gz JRFLAAIBCURQRW-UHFFFAOYSA-N 2 0 357.455 -2.087 20 0 FAADRP C[C@H]1C[C@H](NC(=O)C(=O)N2CCN(CC[NH+](C)C)C(=O)C2)C[N@@H+]1C1CC1 ZINC000653425903 483137449 /nfs/dbraw/zinc/13/74/49/483137449.db2.gz GJOVZLMVGRPGQM-KBPBESRZSA-N 2 0 365.478 -1.040 20 0 FAADRP C[C@@H]1C[C@H](NC(=O)C(=O)N2CCN(CC[NH+](C)C)C(=O)C2)C[N@@H+]1C1CC1 ZINC000653425904 483140552 /nfs/dbraw/zinc/14/05/52/483140552.db2.gz GJOVZLMVGRPGQM-KGLIPLIRSA-N 2 0 365.478 -1.040 20 0 FAADRP C[C@H]1C[C@@H](NC(=O)C(=O)N2CCN(CC[NH+](C)C)C(=O)C2)C[N@@H+]1C1CC1 ZINC000653425905 483139311 /nfs/dbraw/zinc/13/93/11/483139311.db2.gz GJOVZLMVGRPGQM-UONOGXRCSA-N 2 0 365.478 -1.040 20 0 FAADRP C[C@@H]1C[C@@H](NC(=O)C(=O)N2CCN(CC[NH+](C)C)C(=O)C2)C[N@@H+]1C1CC1 ZINC000653425906 483140709 /nfs/dbraw/zinc/14/07/09/483140709.db2.gz GJOVZLMVGRPGQM-ZIAGYGMSSA-N 2 0 365.478 -1.040 20 0 FAADRP C[C@H]1C[N@@H+](C2CC2)C[C@H]1NC(=O)C(=O)N1CCN(CC[NH+](C)C)C(=O)C1 ZINC000653426287 483140326 /nfs/dbraw/zinc/14/03/26/483140326.db2.gz NQXSDOIRUGRNIF-DZGCQCFKSA-N 2 0 365.478 -1.182 20 0 FAADRP C[C@@H]1C[N@@H+](C2CC2)C[C@@H]1NC(=O)C(=O)N1CCN(CC[NH+](C)C)C(=O)C1 ZINC000653426288 483140811 /nfs/dbraw/zinc/14/08/11/483140811.db2.gz NQXSDOIRUGRNIF-HIFRSBDPSA-N 2 0 365.478 -1.182 20 0 FAADRP C[C@@H]1C[N@@H+](C2CC2)C[C@H]1NC(=O)C(=O)N1CCN(CC[NH+](C)C)C(=O)C1 ZINC000653426289 483139527 /nfs/dbraw/zinc/13/95/27/483139527.db2.gz NQXSDOIRUGRNIF-UKRRQHHQSA-N 2 0 365.478 -1.182 20 0 FAADRP C[C@H]1C[N@@H+](C2CC2)C[C@@H]1NC(=O)C(=O)N1CCN(CC[NH+](C)C)C(=O)C1 ZINC000653426290 483140431 /nfs/dbraw/zinc/14/04/31/483140431.db2.gz NQXSDOIRUGRNIF-ZFWWWQNUSA-N 2 0 365.478 -1.182 20 0 FAADRP C[C@H](NC(=O)C(=O)N1CCN(CC[NH+](C)C)C(=O)C1)C1=CC[N@H+](C)CC1 ZINC000653429930 483146639 /nfs/dbraw/zinc/14/66/39/483146639.db2.gz REHNCLASJUCRBT-AWEZNQCLSA-N 2 0 365.478 -1.015 20 0 FAADRP C[C@@H](NC(=O)C(=O)N1CCN(CC[NH+](C)C)C(=O)C1)C1=CC[N@H+](C)CC1 ZINC000653429931 483147788 /nfs/dbraw/zinc/14/77/88/483147788.db2.gz REHNCLASJUCRBT-CQSZACIVSA-N 2 0 365.478 -1.015 20 0 FAADRP CCN1C[C@H](CNC(=O)C(=O)N(CC[NH+](C)C)CC[NH+](C)C)CC1=O ZINC000653451165 483715557 /nfs/dbraw/zinc/71/55/57/483715557.db2.gz USEGIWHLTFHJDR-AWEZNQCLSA-N 2 0 355.483 -1.077 20 0 FAADRP CCN1C[C@@H](CNC(=O)C(=O)N(CC[NH+](C)C)CC[NH+](C)C)CC1=O ZINC000653451166 483715281 /nfs/dbraw/zinc/71/52/81/483715281.db2.gz USEGIWHLTFHJDR-CQSZACIVSA-N 2 0 355.483 -1.077 20 0 FAADRP O[C@@H]1C[C@H]2CN(CCOCCN3CC[N@@H+]4C[C@H](O)C[C@H]4C3)CC[NH+]2C1 ZINC000653829711 483527024 /nfs/dbraw/zinc/52/70/24/483527024.db2.gz TXJOZNCBKULYRH-WNRNVDISSA-N 2 0 354.495 -1.495 20 0 FAADRP O=C(N[C@@H]1CC[NH+](CCN2CCOCC2)C1)N1CC[N@@H+]2C[C@H](O)C[C@H]2C1 ZINC000654446105 483684363 /nfs/dbraw/zinc/68/43/63/483684363.db2.gz GZYZTRVYNJETDY-IXDOHACOSA-N 2 0 367.494 -1.147 20 0 FAADRP O=C(N[C@H]1CC[NH+](CCN2CCOCC2)C1)N1CC[N@@H+]2C[C@H](O)C[C@H]2C1 ZINC000654446106 483684745 /nfs/dbraw/zinc/68/47/45/483684745.db2.gz GZYZTRVYNJETDY-YESZJQIVSA-N 2 0 367.494 -1.147 20 0 FAADRP C[C@@H](C(=O)N1C[C@H](O)[C@@H]([NH+](C)C)C1)[C@H](C)C(=O)N1C[C@H](O)[C@@H]([NH+](C)C)C1 ZINC000655095723 483695842 /nfs/dbraw/zinc/69/58/42/483695842.db2.gz PFGCAMKHDWHNIV-KARBZBNUSA-N 2 0 370.494 -1.475 20 0 FAADRP C[C@@H](C(=O)N1C[C@H](O)[C@@H]([NH+](C)C)C1)[C@@H](C)C(=O)N1C[C@H](O)[C@@H]([NH+](C)C)C1 ZINC000655095724 483695771 /nfs/dbraw/zinc/69/57/71/483695771.db2.gz PFGCAMKHDWHNIV-LGFJLYTPSA-N 2 0 370.494 -1.475 20 0 FAADRP C[C@H](C(=O)N1C[C@H](O)[C@@H]([NH+](C)C)C1)[C@H](C)C(=O)N1C[C@H](O)[C@@H]([NH+](C)C)C1 ZINC000655095725 483695524 /nfs/dbraw/zinc/69/55/24/483695524.db2.gz PFGCAMKHDWHNIV-QNILMXGZSA-N 2 0 370.494 -1.475 20 0 FAADRP O=C(NCCC[NH2+]Cc1cccnc1)C(=O)N1CC[N@@H+]2C[C@H](O)C[C@H]2C1 ZINC000656019223 483699901 /nfs/dbraw/zinc/69/99/01/483699901.db2.gz CQDGROYLJJTCOL-JKSUJKDBSA-N 2 0 361.446 -1.045 20 0 FAADRP CCC(C)(C)[NH+]1CCN(C(=O)C(=O)NCC(=O)N2CC[NH2+]CC2)CC1 ZINC000656020631 483699798 /nfs/dbraw/zinc/69/97/98/483699798.db2.gz TZHXGBKJQOUSLM-UHFFFAOYSA-N 2 0 353.467 -1.133 20 0 FAADRP O=C(CNC(=O)C(=O)N[C@H]1CCC[N@@H+]2CCCC[C@@H]12)N1CC[NH2+]CC1 ZINC000656020656 483700117 /nfs/dbraw/zinc/70/01/17/483700117.db2.gz VBNINFLEHBEPEL-KBPBESRZSA-N 2 0 351.451 -1.333 20 0 FAADRP O=C(CNC(=O)C(=O)N[C@@H]1CCC[N@@H+]2CCCC[C@@H]12)N1CC[NH2+]CC1 ZINC000656020657 483700341 /nfs/dbraw/zinc/70/03/41/483700341.db2.gz VBNINFLEHBEPEL-KGLIPLIRSA-N 2 0 351.451 -1.333 20 0 FAADRP O=C(CNC(=O)C(=O)N[C@H]1CCC[N@@H+]2CCCC[C@H]12)N1CC[NH2+]CC1 ZINC000656020658 483700024 /nfs/dbraw/zinc/70/00/24/483700024.db2.gz VBNINFLEHBEPEL-UONOGXRCSA-N 2 0 351.451 -1.333 20 0 FAADRP O=C(CNC(=O)C(=O)N[C@@H]1CCC[N@@H+]2CCCC[C@H]12)N1CC[NH2+]CC1 ZINC000656020659 483699721 /nfs/dbraw/zinc/69/97/21/483699721.db2.gz VBNINFLEHBEPEL-ZIAGYGMSSA-N 2 0 351.451 -1.333 20 0 FAADRP C[NH+](C)CCN(C[C@H]1CCCO1)C(=O)C(=O)N1CC[N@@H+]2C[C@H](O)C[C@H]2C1 ZINC000656067812 483700173 /nfs/dbraw/zinc/70/01/73/483700173.db2.gz NDEGSCJSJUHSLR-ARFHVFGLSA-N 2 0 368.478 -1.167 20 0 FAADRP C[NH+](C)CCN(C[C@@H]1CCCO1)C(=O)C(=O)N1CC[N@@H+]2C[C@H](O)C[C@H]2C1 ZINC000656067813 483699611 /nfs/dbraw/zinc/69/96/11/483699611.db2.gz NDEGSCJSJUHSLR-XHSDSOJGSA-N 2 0 368.478 -1.167 20 0 FAADRP C[NH+](C)CCN(CC[NH+](C)C)C(=O)C(=O)NCc1nnn(C(C)(C)C)n1 ZINC000656069525 483701189 /nfs/dbraw/zinc/70/11/89/483701189.db2.gz FOUYNHAWGNHDBY-UHFFFAOYSA-N 2 0 368.486 -1.004 20 0 FAADRP COC1(CO)CCN(C(=O)C(=O)N(CC[NH+](C)C)CC[NH+](C)C)CC1 ZINC000656069587 483701047 /nfs/dbraw/zinc/70/10/47/483701047.db2.gz HIUWWHHSUQFKLB-UHFFFAOYSA-N 2 0 358.483 -1.062 20 0 FAADRP 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CC(C)C[N@@H+]1CCO[C@H](CNC(=O)C(=O)N2CC[NH+]3C[C@H](O)C[C@H]3C2)C1 ZINC000656285158 483705601 /nfs/dbraw/zinc/70/56/01/483705601.db2.gz FDRCSKJAVQKYGT-ARFHVFGLSA-N 2 0 368.478 -1.263 20 0 FAADRP CC(C)C[N@@H+]1CCO[C@@H](CNC(=O)C(=O)N2CC[NH+]3C[C@H](O)C[C@H]3C2)C1 ZINC000656285162 483705194 /nfs/dbraw/zinc/70/51/94/483705194.db2.gz FDRCSKJAVQKYGT-XHSDSOJGSA-N 2 0 368.478 -1.263 20 0 FAADRP C[NH+](C)CCN1CCC(NC(=O)C(=O)N2CC[N@@H+]3C[C@H](O)C[C@H]3C2)CC1 ZINC000656293874 483705441 /nfs/dbraw/zinc/70/54/41/483705441.db2.gz OEEGWYFFPGKEFV-JKSUJKDBSA-N 2 0 367.494 -1.594 20 0 FAADRP O=C(NCCCC[NH+]1CCOCC1)C(=O)N1CC[N@@H+]2C[C@H](O)C[C@H]2C1 ZINC000656296947 483705480 /nfs/dbraw/zinc/70/54/80/483705480.db2.gz PKOSQGLHQNTVCK-LSDHHAIUSA-N 2 0 354.451 -1.508 20 0 FAADRP C[NH+](C)[C@@]1(CNC(=O)C(=O)N2CC[N@@H+]3C[C@H](O)C[C@H]3C2)CCSC1 ZINC000656298519 483705508 /nfs/dbraw/zinc/70/55/08/483705508.db2.gz GYJBVYHARBXTLJ-WOSRLPQWSA-N 2 0 356.492 -1.183 20 0 FAADRP C[NH+](C)[C@]1(CNC(=O)C(=O)N2CC[N@@H+]3C[C@H](O)C[C@H]3C2)CCSC1 ZINC000656298520 483705527 /nfs/dbraw/zinc/70/55/27/483705527.db2.gz GYJBVYHARBXTLJ-ZENOOKHLSA-N 2 0 356.492 -1.183 20 0 FAADRP C[C@@H](CNC(=O)C(=O)N1CC[N@@H+]2C[C@H](O)C[C@H]2C1)C[NH+]1CCN(C)CC1 ZINC000656299564 483705297 /nfs/dbraw/zinc/70/52/97/483705297.db2.gz AIKPMHJSFAKFGN-HRCADAONSA-N 2 0 367.494 -1.737 20 0 FAADRP C[C@H](CNC(=O)C(=O)N1CC[N@@H+]2C[C@H](O)C[C@H]2C1)C[NH+]1CCN(C)CC1 ZINC000656299565 483705548 /nfs/dbraw/zinc/70/55/48/483705548.db2.gz AIKPMHJSFAKFGN-OWCLPIDISA-N 2 0 367.494 -1.737 20 0 FAADRP COCC[NH+]1CCC(NC(=O)C(=O)N2CC[N@@H+]3C[C@H](O)C[C@H]3C2)CC1 ZINC000656303020 483705353 /nfs/dbraw/zinc/70/53/53/483705353.db2.gz YJIYHQXMVPHDFE-LSDHHAIUSA-N 2 0 354.451 -1.509 20 0 FAADRP COCCC[NH+]1CCC(NC(=O)C(=O)N2CC[N@@H+]3C[C@H](O)C[C@H]3C2)CC1 ZINC000656308369 483705545 /nfs/dbraw/zinc/70/55/45/483705545.db2.gz CXDJWGJWEXDOQY-JKSUJKDBSA-N 2 0 368.478 -1.119 20 0 FAADRP COCC[N@@H+]1CCC[C@@H]1CNC(=O)C(=O)N1CC[NH+]2C[C@H](O)C[C@H]2C1 ZINC000656309768 483705047 /nfs/dbraw/zinc/70/50/47/483705047.db2.gz VCPVLWHZLBZHDG-QLFBSQMISA-N 2 0 354.451 -1.509 20 0 FAADRP COCC[N@@H+]1CCC[C@H]1CNC(=O)C(=O)N1CC[NH+]2C[C@H](O)C[C@H]2C1 ZINC000656309769 483705110 /nfs/dbraw/zinc/70/51/10/483705110.db2.gz VCPVLWHZLBZHDG-SOUVJXGZSA-N 2 0 354.451 -1.509 20 0 FAADRP C[N@@H+]1CCN(CCNC(=O)C(=O)N2CC[NH+]3C[C@H](O)C[C@H]3C2)CC1(C)C ZINC000656316976 483706348 /nfs/dbraw/zinc/70/63/48/483706348.db2.gz AYOGCYPAPAPOAH-LSDHHAIUSA-N 2 0 367.494 -1.594 20 0 FAADRP C[C@H]1C[N@H+](CCCNC(=O)C(=O)N2CC[NH+]3C[C@H](O)C[C@H]3C2)CCCO1 ZINC000656327938 483706073 /nfs/dbraw/zinc/70/60/73/483706073.db2.gz YNXLESPFZYYDRL-HRCADAONSA-N 2 0 368.478 -1.119 20 0 FAADRP C[C@@H]1C[N@H+](CCCNC(=O)C(=O)N2CC[NH+]3C[C@H](O)C[C@H]3C2)CCCO1 ZINC000656327941 483705976 /nfs/dbraw/zinc/70/59/76/483705976.db2.gz YNXLESPFZYYDRL-OWCLPIDISA-N 2 0 368.478 -1.119 20 0 FAADRP O=C(CNc1cc(NCC(=O)N2CC[NH2+]CC2)ncn1)N1CC[NH2+]CC1 ZINC000656604643 483708054 /nfs/dbraw/zinc/70/80/54/483708054.db2.gz BALCTDZIUDQQOX-UHFFFAOYSA-N 2 0 362.438 -1.836 20 0 FAADRP COCCN1CCN(C(=O)C(=O)N2CCN(CCO)C(C)(C)C2)CC1 ZINC000657968203 483723136 /nfs/dbraw/zinc/72/31/36/483723136.db2.gz IZSPKXZIAZWMFF-UHFFFAOYSA-N 2 0 356.467 -1.308 20 0 FAADRP C[NH+](C)CCN(CC[NH+](C)C)C(=O)C(=O)NCc1nc(C(N)=O)cs1 ZINC000658535251 483733547 /nfs/dbraw/zinc/73/35/47/483733547.db2.gz GYCQTBSECNAWMK-UHFFFAOYSA-N 2 0 370.479 -1.190 20 0 FAADRP CN(CC1C[NH+](C)C1)C(=O)C(=O)N1CCN(C(=O)C[NH+]2CCCC2)CC1 ZINC000658536648 483733240 /nfs/dbraw/zinc/73/32/40/483733240.db2.gz QBIAKEIFUSVMRR-UHFFFAOYSA-N 2 0 365.478 -1.227 20 0 FAADRP C[NH+](C)CCN(CC[NH+](C)C)C(=O)C(=O)N1CCN([C@H]2CCOC2)CC1 ZINC000658537090 483733188 /nfs/dbraw/zinc/73/31/88/483733188.db2.gz UDMGHJPLYUVMTL-INIZCTEOSA-N 2 0 369.510 -1.129 20 0 FAADRP C[NH+](C)CCN(CC[NH+](C)C)C(=O)C(=O)N1CCN([C@@H]2CCOC2)CC1 ZINC000658537095 483733536 /nfs/dbraw/zinc/73/35/36/483733536.db2.gz UDMGHJPLYUVMTL-MRXNPFEDSA-N 2 0 369.510 -1.129 20 0 FAADRP CN(CC1C[NH+](C)C1)C(=O)C(=O)N1CCN(C(=O)[C@@H]2CCC[N@@H+]2C)CC1 ZINC000658676519 483734423 /nfs/dbraw/zinc/73/44/23/483734423.db2.gz HDGRMZZGJWPMDU-HNNXBMFYSA-N 2 0 365.478 -1.229 20 0 FAADRP CN(CC1C[NH+](C)C1)C(=O)C(=O)N1CCN(C(=O)[C@H]2CCC[N@@H+]2C)CC1 ZINC000658676522 483734760 /nfs/dbraw/zinc/73/47/60/483734760.db2.gz HDGRMZZGJWPMDU-OAHLLOKOSA-N 2 0 365.478 -1.229 20 0 FAADRP C[NH+](C)CCC[C@@H]1CN(C(=O)C(=O)N2CC[N@@H+]3C[C@H](O)C[C@H]3C2)CCO1 ZINC000658785178 483735338 /nfs/dbraw/zinc/73/53/38/483735338.db2.gz LTUARCRKNWVUCT-ARFHVFGLSA-N 2 0 368.478 -1.167 20 0 FAADRP C[NH+](C)CCC[C@H]1CN(C(=O)C(=O)N2CC[N@@H+]3C[C@H](O)C[C@H]3C2)CCO1 ZINC000658785180 483692550 /nfs/dbraw/zinc/69/25/50/483692550.db2.gz LTUARCRKNWVUCT-XHSDSOJGSA-N 2 0 368.478 -1.167 20 0 FAADRP CCN(C(=O)C(=O)N1CCN(CC[NH+](C)C)C(=O)C1)[C@H]1CC[N@H+](C)C1 ZINC000658803241 483735901 /nfs/dbraw/zinc/73/59/01/483735901.db2.gz OTIHTFQHFVNUNT-AWEZNQCLSA-N 2 0 353.467 -1.229 20 0 FAADRP CCN(C(=O)C(=O)N1CCN(CC[NH+](C)C)C(=O)C1)[C@@H]1CC[N@H+](C)C1 ZINC000658803242 483735789 /nfs/dbraw/zinc/73/57/89/483735789.db2.gz OTIHTFQHFVNUNT-CQSZACIVSA-N 2 0 353.467 -1.229 20 0 FAADRP C[NH+](C)[C@H]1CCN(C(=O)C(=O)N2CCN(C(=O)C[NH+]3CCCC3)CC2)C1 ZINC000659308064 483736523 /nfs/dbraw/zinc/73/65/23/483736523.db2.gz UPORBXPAMQKCTR-HNNXBMFYSA-N 2 0 365.478 -1.085 20 0 FAADRP C[NH+](C)[C@@H]1CCN(C(=O)C(=O)N2CCN(C(=O)C[NH+]3CCCC3)CC2)C1 ZINC000659308065 483736491 /nfs/dbraw/zinc/73/64/91/483736491.db2.gz UPORBXPAMQKCTR-OAHLLOKOSA-N 2 0 365.478 -1.085 20 0 FAADRP C[NH+](C)CCN(CC[NH+](C)C)C(=O)C(=O)N1CCN(CCO)C(C)(C)C1 ZINC000659318423 483736142 /nfs/dbraw/zinc/73/61/42/483736142.db2.gz AMPRCTPDBGDYOK-UHFFFAOYSA-N 2 0 371.526 -1.147 20 0 FAADRP CN(C)C(=O)CC[NH+]1CCC(NC(=O)C(=O)N2CC[C@@H](F)[C@H]([NH3+])C2)CC1 ZINC000659671736 483739014 /nfs/dbraw/zinc/73/90/14/483739014.db2.gz GRSWYOOYOJGNSL-ZIAGYGMSSA-N 2 0 371.457 -1.057 20 0 FAADRP C[NH2+]C[C@H](C)NC(=O)C(=O)NCC1(N2CCOCC2)CC[NH+](C)CC1 ZINC000659685380 483739273 /nfs/dbraw/zinc/73/92/73/483739273.db2.gz QVGXIOQKTWBLPZ-AWEZNQCLSA-N 2 0 355.483 -1.377 20 0 FAADRP C[NH2+]C[C@@H](C)NC(=O)C(=O)NCC1(N2CCOCC2)CC[NH+](C)CC1 ZINC000659685385 483739313 /nfs/dbraw/zinc/73/93/13/483739313.db2.gz QVGXIOQKTWBLPZ-CQSZACIVSA-N 2 0 355.483 -1.377 20 0 FAADRP NC(=O)[C@@H]1CCC[N@H+](CCCNC(=O)C(=O)N2CC[C@@H](F)[C@H]([NH3+])C2)C1 ZINC000659695637 483739411 /nfs/dbraw/zinc/73/94/11/483739411.db2.gz AJJGASRORBUENW-JHJVBQTASA-N 2 0 357.430 -1.412 20 0 FAADRP NC(=O)[C@H]1CCC[N@H+](CCCNC(=O)C(=O)N2CC[C@@H](F)[C@H]([NH3+])C2)C1 ZINC000659695642 483739183 /nfs/dbraw/zinc/73/91/83/483739183.db2.gz AJJGASRORBUENW-YNEHKIRRSA-N 2 0 357.430 -1.412 20 0 FAADRP NC(=O)[C@H]1CCC[N@H+](CCCNC(=O)C(=O)N2CC3CC2(C[NH3+])C3)C1 ZINC000659696749 483739549 /nfs/dbraw/zinc/73/95/49/483739549.db2.gz PWUYPRFRFSVYOX-JZLYGMAVSA-N 2 0 351.451 -1.360 20 0 FAADRP NC(=O)[C@@H]1CCC[N@H+](CCCNC(=O)C(=O)N2CC3CC2(C[NH3+])C3)C1 ZINC000659696770 483739370 /nfs/dbraw/zinc/73/93/70/483739370.db2.gz PWUYPRFRFSVYOX-UIORMTCPSA-N 2 0 351.451 -1.360 20 0 FAADRP NC(=O)[C@H]1CCC[N@H+](CCCNC(=O)C(=O)NCC23CC(C2)C[NH2+]3)C1 ZINC000659697511 483739563 /nfs/dbraw/zinc/73/95/63/483739563.db2.gz XFSZVZUVSBNGRF-JZLYGMAVSA-N 2 0 351.451 -1.442 20 0 FAADRP NC(=O)[C@@H]1CCC[N@H+](CCCNC(=O)C(=O)NCC23CC(C2)C[NH2+]3)C1 ZINC000659697514 483739240 /nfs/dbraw/zinc/73/92/40/483739240.db2.gz XFSZVZUVSBNGRF-UIORMTCPSA-N 2 0 351.451 -1.442 20 0 FAADRP CN(C)C(=O)[C@@H]1CCC[N@@H+]1CCCNC(=O)C(=O)N1CC2CC1(C[NH3+])C2 ZINC000659699692 483739514 /nfs/dbraw/zinc/73/95/14/483739514.db2.gz SXFRSBWNEMAFCK-FVRSWCFKSA-N 2 0 365.478 -1.005 20 0 FAADRP CN(C)C(=O)[C@H]1CCC[N@@H+]1CCCNC(=O)C(=O)N1CC2CC1(C[NH3+])C2 ZINC000659699693 483739542 /nfs/dbraw/zinc/73/95/42/483739542.db2.gz SXFRSBWNEMAFCK-TXKKKEFDSA-N 2 0 365.478 -1.005 20 0 FAADRP CN(C)C(=O)[C@@H]1CCC[N@@H+]1CCCNC(=O)C(=O)N1CC[C@@H](F)[C@H]([NH3+])C1 ZINC000659699870 483739490 /nfs/dbraw/zinc/73/94/90/483739490.db2.gz WTBBXFCAPGWPBO-MCIONIFRSA-N 2 0 371.457 -1.057 20 0 FAADRP CN(C)C(=O)[C@H]1CCC[N@@H+]1CCCNC(=O)C(=O)N1CC[C@@H](F)[C@H]([NH3+])C1 ZINC000659699871 483739636 /nfs/dbraw/zinc/73/96/36/483739636.db2.gz WTBBXFCAPGWPBO-MGPQQGTHSA-N 2 0 371.457 -1.057 20 0 FAADRP CN(C)C(=O)[C@@H]1CCC[N@@H+]1CCCNC(=O)C(=O)NCC12CC(C1)C[NH2+]2 ZINC000659699918 483739446 /nfs/dbraw/zinc/73/94/46/483739446.db2.gz XNNAWSLBUWLZTG-FVRSWCFKSA-N 2 0 365.478 -1.087 20 0 FAADRP CN(C)C(=O)[C@H]1CCC[N@@H+]1CCCNC(=O)C(=O)NCC12CC(C1)C[NH2+]2 ZINC000659699920 483739386 /nfs/dbraw/zinc/73/93/86/483739386.db2.gz XNNAWSLBUWLZTG-TXKKKEFDSA-N 2 0 365.478 -1.087 20 0 FAADRP C[NH+](C)CCC[C@H]1CN(C(=O)C(=O)NCCN2CC[NH2+]CC2)CCO1 ZINC000659709290 483739294 /nfs/dbraw/zinc/73/92/94/483739294.db2.gz BHFYVLFBUCMJFV-HNNXBMFYSA-N 2 0 355.483 -1.423 20 0 FAADRP C[NH+](C)CCC[C@@H]1CN(C(=O)C(=O)NCCN2CC[NH2+]CC2)CCO1 ZINC000659709292 483739350 /nfs/dbraw/zinc/73/93/50/483739350.db2.gz BHFYVLFBUCMJFV-OAHLLOKOSA-N 2 0 355.483 -1.423 20 0 FAADRP C[NH+](C)CCC[C@H]1CN(C(=O)C(=O)NCCCN2CC[NH2+]CC2)CCO1 ZINC000659709964 483739325 /nfs/dbraw/zinc/73/93/25/483739325.db2.gz KGORLJXJNLCMHK-INIZCTEOSA-N 2 0 369.510 -1.033 20 0 FAADRP C[NH+](C)CCC[C@@H]1CN(C(=O)C(=O)NCCCN2CC[NH2+]CC2)CCO1 ZINC000659709968 483739575 /nfs/dbraw/zinc/73/95/75/483739575.db2.gz KGORLJXJNLCMHK-MRXNPFEDSA-N 2 0 369.510 -1.033 20 0 FAADRP O=C(CNC(=O)C(=O)NCC1CC[NH+](CC2CC2)CC1)N1CC[NH2+]CC1 ZINC000659715611 483739823 /nfs/dbraw/zinc/73/98/23/483739823.db2.gz PVBDGRJNFWORIV-UHFFFAOYSA-N 2 0 365.478 -1.227 20 0 FAADRP C[NH+](C)CCC[C@H]1CN(C(=O)C(=O)NCC(=O)N2CC[NH2+]CC2)CCO1 ZINC000659715636 483739935 /nfs/dbraw/zinc/73/99/35/483739935.db2.gz QEJRGQRKPZIDGA-AWEZNQCLSA-N 2 0 369.466 -1.896 20 0 FAADRP C[NH+](C)CCC[C@@H]1CN(C(=O)C(=O)NCC(=O)N2CC[NH2+]CC2)CCO1 ZINC000659715637 483739877 /nfs/dbraw/zinc/73/98/77/483739877.db2.gz QEJRGQRKPZIDGA-CQSZACIVSA-N 2 0 369.466 -1.896 20 0 FAADRP CCC[N@@H+]1CC[C@H](NC(=O)C(=O)N2CCC[C@H](C(=O)NCC[NH3+])C2)C1 ZINC000659738622 483740601 /nfs/dbraw/zinc/74/06/01/483740601.db2.gz HGCSADVAZOOYHG-KBPBESRZSA-N 2 0 353.467 -1.100 20 0 FAADRP CCC[N@@H+]1CC[C@H](NC(=O)C(=O)N2CCC[C@@H](C(=O)NCC[NH3+])C2)C1 ZINC000659738623 483740381 /nfs/dbraw/zinc/74/03/81/483740381.db2.gz HGCSADVAZOOYHG-KGLIPLIRSA-N 2 0 353.467 -1.100 20 0 FAADRP CCC[N@@H+]1CC[C@@H](NC(=O)C(=O)N2CCC[C@H](C(=O)NCC[NH3+])C2)C1 ZINC000659738624 483740515 /nfs/dbraw/zinc/74/05/15/483740515.db2.gz HGCSADVAZOOYHG-UONOGXRCSA-N 2 0 353.467 -1.100 20 0 FAADRP CCC[N@@H+]1CC[C@@H](NC(=O)C(=O)N2CCC[C@@H](C(=O)NCC[NH3+])C2)C1 ZINC000659738625 483740403 /nfs/dbraw/zinc/74/04/03/483740403.db2.gz HGCSADVAZOOYHG-ZIAGYGMSSA-N 2 0 353.467 -1.100 20 0 FAADRP CN1CCN(C(=O)C(=O)NC2CC[NH+]([C@@H]3CCOC3)CC2)[C@@H](C[NH3+])C1 ZINC000659738703 483740379 /nfs/dbraw/zinc/74/03/79/483740379.db2.gz IOHUCHZAANICMM-CABCVRRESA-N 2 0 353.467 -1.543 20 0 FAADRP CN1CCN(C(=O)C(=O)NC2CC[NH+]([C@H]3CCOC3)CC2)[C@@H](C[NH3+])C1 ZINC000659738704 483740701 /nfs/dbraw/zinc/74/07/01/483740701.db2.gz IOHUCHZAANICMM-GJZGRUSLSA-N 2 0 353.467 -1.543 20 0 FAADRP CN1CCN(C(=O)C(=O)NC2CC[NH+]([C@@H]3CCOC3)CC2)[C@H](C[NH3+])C1 ZINC000659738705 483740420 /nfs/dbraw/zinc/74/04/20/483740420.db2.gz IOHUCHZAANICMM-HUUCEWRRSA-N 2 0 353.467 -1.543 20 0 FAADRP CN1CCN(C(=O)C(=O)NC2CC[NH+]([C@H]3CCOC3)CC2)[C@H](C[NH3+])C1 ZINC000659738706 483740411 /nfs/dbraw/zinc/74/04/11/483740411.db2.gz IOHUCHZAANICMM-LSDHHAIUSA-N 2 0 353.467 -1.543 20 0 FAADRP C[N@@H+]1CCC[C@H]1C(=O)N1CCN(C(=O)C(=O)NCC23CC(C2)C[NH2+]3)CC1 ZINC000659745716 483741205 /nfs/dbraw/zinc/74/12/05/483741205.db2.gz URRYUKJHHMBGNS-FVRSWCFKSA-N 2 0 363.462 -1.380 20 0 FAADRP C[N@@H+]1CCC[C@@H]1C(=O)N1CCN(C(=O)C(=O)NCC23CC(C2)C[NH2+]3)CC1 ZINC000659745717 483741078 /nfs/dbraw/zinc/74/10/78/483741078.db2.gz URRYUKJHHMBGNS-TXKKKEFDSA-N 2 0 363.462 -1.380 20 0 FAADRP O=C(C[NH+]1CCCC1)N1CCN(C(=O)C(=O)NCC23CC(C2)C[NH2+]3)CC1 ZINC000659745753 483741042 /nfs/dbraw/zinc/74/10/42/483741042.db2.gz WAGFNHHMFYDXFI-UHFFFAOYSA-N 2 0 363.462 -1.379 20 0 FAADRP CC[NH+](CC)CC(=O)N1CCN(C(=O)C(=O)NCC23CC(C2)C[NH2+]3)CC1 ZINC000659745930 483740859 /nfs/dbraw/zinc/74/08/59/483740859.db2.gz WJJTYQDHNPOJJK-UHFFFAOYSA-N 2 0 365.478 -1.133 20 0 FAADRP C[NH+](C)CCN(CC[NH+](C)C)C(=O)C(=O)NCc1nc(C[NH3+])cc(=O)[nH]1 ZINC000659748447 483741276 /nfs/dbraw/zinc/74/12/76/483741276.db2.gz JHJSLZALJIMVJV-UHFFFAOYSA-N 3 0 367.454 -1.791 20 0 FAADRP Cn1cnc2c1c(=O)n(CCC[NH2+]C1(CO)CC[NH2+]CC1)c(=O)n2C ZINC000662287235 483745209 /nfs/dbraw/zinc/74/52/09/483745209.db2.gz WBNVSCDKCVBIQZ-UHFFFAOYSA-N 2 0 350.423 -1.472 20 0 FAADRP [NH3+]CCN(CC(=O)NCC1([NH+]2CCOCC2)CCCCC1)C[C@H](O)CO ZINC000662288635 483745754 /nfs/dbraw/zinc/74/57/54/483745754.db2.gz RZTKELBAJQOQHE-INIZCTEOSA-N 2 0 372.510 -1.248 20 0 FAADRP [NH3+]CCN(CC(=O)NCC1([NH+]2CCOCC2)CCCCC1)C[C@@H](O)CO ZINC000662288636 483745429 /nfs/dbraw/zinc/74/54/29/483745429.db2.gz RZTKELBAJQOQHE-MRXNPFEDSA-N 2 0 372.510 -1.248 20 0 FAADRP CC[NH+](CC)CC(=O)N1CCN(C(=O)C(=O)N2CC3CC2(C[NH3+])C3)CC1 ZINC000662929417 483747927 /nfs/dbraw/zinc/74/79/27/483747927.db2.gz AJKAEFYUNQYKEY-UHFFFAOYSA-N 2 0 365.478 -1.051 20 0 FAADRP CC[NH+](CC)CC(=O)N1CCN(C(=O)C(=O)N2CC[C@@H](F)[C@H]([NH3+])C2)CC1 ZINC000662929474 483748314 /nfs/dbraw/zinc/74/83/14/483748314.db2.gz BHPZBGHFJHTPMT-ZIAGYGMSSA-N 2 0 371.457 -1.103 20 0 FAADRP [NH3+]CC12CC(C1)CN2C(=O)C(=O)N1CCN(C(=O)C[NH+]2CCCC2)CC1 ZINC000662929702 483748207 /nfs/dbraw/zinc/74/82/07/483748207.db2.gz FTZSCRBTIRNAHH-UHFFFAOYSA-N 2 0 363.462 -1.297 20 0 FAADRP CN(CC(C)(C)[NH3+])C(=O)C(=O)N1CCN(C(=O)C[NH+]2CCCC2)CC1 ZINC000662930713 483747964 /nfs/dbraw/zinc/74/79/64/483747964.db2.gz VLIZYMYXZXGTQR-UHFFFAOYSA-N 2 0 353.467 -1.051 20 0 FAADRP [NH3+][C@@H]1CN(C(=O)C(=O)N2CCN(C(=O)C[NH+]3CCCC3)CC2)CC[C@H]1F ZINC000662930752 483748002 /nfs/dbraw/zinc/74/80/02/483748002.db2.gz WKEXJLUUPHJXOY-ZIAGYGMSSA-N 2 0 369.441 -1.349 20 0 FAADRP C[N@@H+]1CCC[C@H]1C(=O)N1CCN(C(=O)C(=O)N2CC3CC2(C[NH3+])C3)CC1 ZINC000662940946 483748125 /nfs/dbraw/zinc/74/81/25/483748125.db2.gz QSOQJIZCCWZICY-FVRSWCFKSA-N 2 0 363.462 -1.299 20 0 FAADRP C[N@@H+]1CCC[C@@H]1C(=O)N1CCN(C(=O)C(=O)N2CC3CC2(C[NH3+])C3)CC1 ZINC000662940949 483748071 /nfs/dbraw/zinc/74/80/71/483748071.db2.gz QSOQJIZCCWZICY-TXKKKEFDSA-N 2 0 363.462 -1.299 20 0 FAADRP CN(CC(C)(C)[NH3+])C(=O)C(=O)N1CCN(C(=O)[C@H]2CCC[N@@H+]2C)CC1 ZINC000662941485 483748034 /nfs/dbraw/zinc/74/80/34/483748034.db2.gz WLKXJTGAOPOGSM-CYBMUJFWSA-N 2 0 353.467 -1.053 20 0 FAADRP CN(CC(C)(C)[NH3+])C(=O)C(=O)N1CCN(C(=O)[C@@H]2CCC[N@@H+]2C)CC1 ZINC000662941488 483748150 /nfs/dbraw/zinc/74/81/50/483748150.db2.gz WLKXJTGAOPOGSM-ZDUSSCGKSA-N 2 0 353.467 -1.053 20 0 FAADRP C[N@@H+]1CCC[C@H]1C(=O)N1CCN(C(=O)C(=O)N2CC[C@@H](F)[C@H]([NH3+])C2)CC1 ZINC000662941850 483748870 /nfs/dbraw/zinc/74/88/70/483748870.db2.gz ZNTBFESNVXNWIL-MCIONIFRSA-N 2 0 369.441 -1.351 20 0 FAADRP C[N@@H+]1CCC[C@@H]1C(=O)N1CCN(C(=O)C(=O)N2CC[C@@H](F)[C@H]([NH3+])C2)CC1 ZINC000662941851 483748800 /nfs/dbraw/zinc/74/88/00/483748800.db2.gz ZNTBFESNVXNWIL-MGPQQGTHSA-N 2 0 369.441 -1.351 20 0 FAADRP CN1CCN(C(=O)C(=O)N2CCO[C@@H](CCC[NH+](C)C)C2)[C@H](C[NH3+])C1 ZINC000662946939 483748742 /nfs/dbraw/zinc/74/87/42/483748742.db2.gz JLRCQKUHXYRQQX-CABCVRRESA-N 2 0 355.483 -1.343 20 0 FAADRP CN1CCN(C(=O)C(=O)N2CCO[C@@H](CCC[NH+](C)C)C2)[C@@H](C[NH3+])C1 ZINC000662946940 483748736 /nfs/dbraw/zinc/74/87/36/483748736.db2.gz JLRCQKUHXYRQQX-GJZGRUSLSA-N 2 0 355.483 -1.343 20 0 FAADRP CN1CCN(C(=O)C(=O)N2CCO[C@H](CCC[NH+](C)C)C2)[C@H](C[NH3+])C1 ZINC000662946941 483748556 /nfs/dbraw/zinc/74/85/56/483748556.db2.gz JLRCQKUHXYRQQX-HUUCEWRRSA-N 2 0 355.483 -1.343 20 0 FAADRP CN1CCN(C(=O)C(=O)N2CCO[C@H](CCC[NH+](C)C)C2)[C@@H](C[NH3+])C1 ZINC000662946942 483748513 /nfs/dbraw/zinc/74/85/13/483748513.db2.gz JLRCQKUHXYRQQX-LSDHHAIUSA-N 2 0 355.483 -1.343 20 0 FAADRP COCCOCCN1CCN(C(=O)C(=O)N2CC[C@@H](F)[C@H]([NH3+])C2)CC1 ZINC000662964921 483749508 /nfs/dbraw/zinc/74/95/08/483749508.db2.gz GPDNKVJWOVHPLL-ZIAGYGMSSA-N 2 0 360.430 -1.309 20 0 FAADRP O[C@@H]1CC[NH+](C2CN(c3cnc(N4CC([N@@H+]5CC[C@@H](O)C5)C4)cn3)C2)C1 ZINC000664066911 483751230 /nfs/dbraw/zinc/75/12/30/483751230.db2.gz GBPRCTDFAQNXQJ-HZPDHXFCSA-N 2 0 360.462 -1.013 20 0 FAADRP O[C@@H]1C[C@H]2CN(c3cnc(N4CC[N@@H+]5C[C@H](O)C[C@H]5C4)cn3)CC[NH+]2C1 ZINC000664076318 483751256 /nfs/dbraw/zinc/75/12/56/483751256.db2.gz PLTASXJRIGSXBP-CAOSSQGBSA-N 2 0 360.462 -1.013 20 0 FAADRP C[NH+](C)[C@H]1CN(C(=O)N[C@H]2CC[N@H+](CCN3CCOCC3)C2)C[C@@H]1O ZINC000664142775 483752311 /nfs/dbraw/zinc/75/23/11/483752311.db2.gz KPWKVLRLZDKITB-JYJNAYRXSA-N 2 0 355.483 -1.291 20 0 FAADRP C[NH+](C)[C@H]1CN(C(=O)N[C@@H]2CC[N@H+](CCN3CCOCC3)C2)C[C@@H]1O ZINC000664142776 483752029 /nfs/dbraw/zinc/75/20/29/483752029.db2.gz KPWKVLRLZDKITB-PMPSAXMXSA-N 2 0 355.483 -1.291 20 0 FAADRP CN(C)S(=O)(=O)NCCNC(=O)N(CC[NH+](C)C)CC[NH+](C)C ZINC000665014782 483753634 /nfs/dbraw/zinc/75/36/34/483753634.db2.gz OBBUBNZGXMWNEH-UHFFFAOYSA-N 2 0 352.505 -1.483 20 0 FAADRP O=C(NCCC[NH+]1CCN(c2cc[nH+]cc2)CC1)C(=O)N[C@H]1CCNC1=O ZINC000668751179 482709590 /nfs/dbraw/zinc/70/95/90/482709590.db2.gz RQKWHQAGLZHWIP-HNNXBMFYSA-N 2 0 374.445 -1.285 20 0 FAADRP COCC[N@H+](C)CCNC(=O)C(=O)N1CCC([NH+]2CC[C@H](O)C2)CC1 ZINC000668751707 482710149 /nfs/dbraw/zinc/71/01/49/482710149.db2.gz YJMSOBMXGWNZEU-HNNXBMFYSA-N 2 0 356.467 -1.262 20 0 FAADRP COCC[N@H+](C)CCNC(=O)C(=O)N1CCC([NH+]2CC[C@@H](O)C2)CC1 ZINC000668751708 482709910 /nfs/dbraw/zinc/70/99/10/482709910.db2.gz YJMSOBMXGWNZEU-OAHLLOKOSA-N 2 0 356.467 -1.262 20 0 FAADRP COCC[N@@H+]1CC[C@@H](NC(=O)C(=O)N2CCN([C@H]3CCOC3)CC2)C1 ZINC000668840170 482749102 /nfs/dbraw/zinc/74/91/02/482749102.db2.gz FCFFFHLCKOIORI-CABCVRRESA-N 2 0 354.451 -1.244 20 0 FAADRP COCC[N@@H+]1CC[C@H](NC(=O)C(=O)N2CCN([C@H]3CCOC3)CC2)C1 ZINC000668840172 482749553 /nfs/dbraw/zinc/74/95/53/482749553.db2.gz FCFFFHLCKOIORI-GJZGRUSLSA-N 2 0 354.451 -1.244 20 0 FAADRP COCC[N@@H+]1CC[C@@H](NC(=O)C(=O)N2CCN([C@@H]3CCOC3)CC2)C1 ZINC000668840173 482748261 /nfs/dbraw/zinc/74/82/61/482748261.db2.gz FCFFFHLCKOIORI-HUUCEWRRSA-N 2 0 354.451 -1.244 20 0 FAADRP COCC[N@@H+]1CC[C@H](NC(=O)C(=O)N2CCN([C@@H]3CCOC3)CC2)C1 ZINC000668840175 482749396 /nfs/dbraw/zinc/74/93/96/482749396.db2.gz FCFFFHLCKOIORI-LSDHHAIUSA-N 2 0 354.451 -1.244 20 0 FAADRP COCC[N@@H+]1CC[C@@H](NC(=O)C(=O)N2CCC([NH+]3CC[C@@H](O)C3)CC2)C1 ZINC000668843830 482750737 /nfs/dbraw/zinc/75/07/37/482750737.db2.gz YZAKPVJCGPOJKG-GDBMZVCRSA-N 2 0 368.478 -1.119 20 0 FAADRP COCC[N@@H+]1CC[C@H](NC(=O)C(=O)N2CCC([NH+]3CC[C@@H](O)C3)CC2)C1 ZINC000668843831 482751178 /nfs/dbraw/zinc/75/11/78/482751178.db2.gz YZAKPVJCGPOJKG-GOEBONIOSA-N 2 0 368.478 -1.119 20 0 FAADRP COCC[N@@H+]1CC[C@H](NC(=O)C(=O)N2CCC([NH+]3CC[C@H](O)C3)CC2)C1 ZINC000668843832 482751113 /nfs/dbraw/zinc/75/11/13/482751113.db2.gz YZAKPVJCGPOJKG-HOCLYGCPSA-N 2 0 368.478 -1.119 20 0 FAADRP COCC[N@@H+]1CC[C@@H](NC(=O)C(=O)N2CCC([NH+]3CC[C@H](O)C3)CC2)C1 ZINC000668843833 482750433 /nfs/dbraw/zinc/75/04/33/482750433.db2.gz YZAKPVJCGPOJKG-ZBFHGGJFSA-N 2 0 368.478 -1.119 20 0 FAADRP CN1CC[N@H+](C)C[C@H]1CNC(=O)C(=O)N1CCO[C@@H](CCC[NH+](C)C)C1 ZINC000668893023 482774768 /nfs/dbraw/zinc/77/47/68/482774768.db2.gz LURKRXMTDNAVFM-CVEARBPZSA-N 2 0 369.510 -1.082 20 0 FAADRP CN1CC[N@H+](C)C[C@@H]1CNC(=O)C(=O)N1CCO[C@@H](CCC[NH+](C)C)C1 ZINC000668893025 482774109 /nfs/dbraw/zinc/77/41/09/482774109.db2.gz LURKRXMTDNAVFM-HOTGVXAUSA-N 2 0 369.510 -1.082 20 0 FAADRP CN1CC[N@H+](C)C[C@H]1CNC(=O)C(=O)N1CCO[C@H](CCC[NH+](C)C)C1 ZINC000668893026 482773367 /nfs/dbraw/zinc/77/33/67/482773367.db2.gz LURKRXMTDNAVFM-HZPDHXFCSA-N 2 0 369.510 -1.082 20 0 FAADRP CN1CC[N@H+](C)C[C@@H]1CNC(=O)C(=O)N1CCO[C@H](CCC[NH+](C)C)C1 ZINC000668893027 482774490 /nfs/dbraw/zinc/77/44/90/482774490.db2.gz LURKRXMTDNAVFM-JKSUJKDBSA-N 2 0 369.510 -1.082 20 0 FAADRP C[NH+](C)CCOCCNC(=O)C(=O)N1CCC([N@@H+]2CC[C@H](O)C2)CC1 ZINC000669228244 482908126 /nfs/dbraw/zinc/90/81/26/482908126.db2.gz KRNHGEFIWBEEIZ-HNNXBMFYSA-N 2 0 356.467 -1.262 20 0 FAADRP C[NH+](C)CCOCCNC(=O)C(=O)N1CCC([N@@H+]2CC[C@@H](O)C2)CC1 ZINC000669228246 482907798 /nfs/dbraw/zinc/90/77/98/482907798.db2.gz KRNHGEFIWBEEIZ-OAHLLOKOSA-N 2 0 356.467 -1.262 20 0 FAADRP C[NH+](C)CCN(CC[NH+](C)C)C(=O)C(=O)NCc1nnc2n1CCC2 ZINC000670775599 482713741 /nfs/dbraw/zinc/71/37/41/482713741.db2.gz DXSKMBKTPSTMNT-UHFFFAOYSA-N 2 0 351.455 -1.208 20 0 FAADRP CN1CCN(C(=O)CCNC(=O)C(=O)N2CC[N@@H+]3CCC[C@H]3C2)CC1 ZINC000670967582 483151313 /nfs/dbraw/zinc/15/13/13/483151313.db2.gz DYKJEVFXWIEFKO-AWEZNQCLSA-N 2 0 351.451 -1.427 20 0 FAADRP CN1CCN(C(=O)CCNC(=O)C(=O)N2CC[N@@H+]3CCC[C@@H]3C2)CC1 ZINC000670967583 483152147 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C[C@@H](NC(=O)C(=O)NCCC(=O)N1CCN(C)CC1)[C@@H]1CN(C)CCO1 ZINC000670967741 483152012 /nfs/dbraw/zinc/15/20/12/483152012.db2.gz RNFGDEOZSHIBLO-KGLIPLIRSA-N 2 0 369.466 -1.898 20 0 FAADRP C[C@H](NC(=O)C(=O)NCCC(=O)N1CCN(C)CC1)[C@H]1CN(C)CCO1 ZINC000670967742 483152220 /nfs/dbraw/zinc/15/22/20/483152220.db2.gz RNFGDEOZSHIBLO-UONOGXRCSA-N 2 0 369.466 -1.898 20 0 FAADRP C[C@@H](NC(=O)C(=O)NCCC(=O)N1CCN(C)CC1)[C@H]1CN(C)CCO1 ZINC000670967743 483150891 /nfs/dbraw/zinc/15/08/91/483150891.db2.gz RNFGDEOZSHIBLO-ZIAGYGMSSA-N 2 0 369.466 -1.898 20 0 FAADRP C[N@H+](CCNC(=O)C(=O)NCCC[NH+]1CCC[C@@H](C(N)=O)C1)C1CC1 ZINC000671981588 483784373 /nfs/dbraw/zinc/78/43/73/483784373.db2.gz YHNKDXRBKXYCFF-CYBMUJFWSA-N 2 0 353.467 -1.100 20 0 FAADRP C[N@H+](CCNC(=O)C(=O)NCCC[NH+]1CCC[C@H](C(N)=O)C1)C1CC1 ZINC000671981589 483784307 /nfs/dbraw/zinc/78/43/07/483784307.db2.gz YHNKDXRBKXYCFF-ZDUSSCGKSA-N 2 0 353.467 -1.100 20 0 FAADRP C[N@@H+]1CCC[C@H](NC(=O)C(=O)NCCC[NH+]2CCC[C@H](C(N)=O)C2)C1 ZINC000671981782 483784428 /nfs/dbraw/zinc/78/44/28/483784428.db2.gz VUIHHVHJOIDMKU-KBPBESRZSA-N 2 0 353.467 -1.100 20 0 FAADRP C[N@@H+]1CCC[C@H](NC(=O)C(=O)NCCC[NH+]2CCC[C@@H](C(N)=O)C2)C1 ZINC000671981783 483784409 /nfs/dbraw/zinc/78/44/09/483784409.db2.gz VUIHHVHJOIDMKU-KGLIPLIRSA-N 2 0 353.467 -1.100 20 0 FAADRP C[N@@H+]1CCC[C@@H](NC(=O)C(=O)NCCC[NH+]2CCC[C@H](C(N)=O)C2)C1 ZINC000671981784 483784337 /nfs/dbraw/zinc/78/43/37/483784337.db2.gz VUIHHVHJOIDMKU-UONOGXRCSA-N 2 0 353.467 -1.100 20 0 FAADRP C[N@@H+]1CCC[C@@H](NC(=O)C(=O)NCCC[NH+]2CCC[C@@H](C(N)=O)C2)C1 ZINC000671981785 483783971 /nfs/dbraw/zinc/78/39/71/483783971.db2.gz VUIHHVHJOIDMKU-ZIAGYGMSSA-N 2 0 353.467 -1.100 20 0 FAADRP COCC[N@H+](C)CCNC(=O)C(=O)N[C@H]1CCN(C2CC[NH+](C)CC2)C1 ZINC000672004059 482665950 /nfs/dbraw/zinc/66/59/50/482665950.db2.gz GFBXGRDGTCUYHZ-HNNXBMFYSA-N 2 0 369.510 -1.035 20 0 FAADRP COCC[N@H+](C)CCNC(=O)C(=O)N[C@@H]1CCN(C2CC[NH+](C)CC2)C1 ZINC000672004060 482666759 /nfs/dbraw/zinc/66/67/59/482666759.db2.gz GFBXGRDGTCUYHZ-OAHLLOKOSA-N 2 0 369.510 -1.035 20 0 FAADRP COCC[N@H+](C)CCNC(=O)C(=O)N1CCN([C@H]2CCC[NH+](C)C2)CC1 ZINC000672004176 482666865 /nfs/dbraw/zinc/66/68/65/482666865.db2.gz XRFFLJYIZXRTEZ-INIZCTEOSA-N 2 0 369.510 -1.081 20 0 FAADRP COCC[N@H+](C)CCNC(=O)C(=O)N1CCN([C@@H]2CCC[NH+](C)C2)CC1 ZINC000672004181 482666937 /nfs/dbraw/zinc/66/69/37/482666937.db2.gz XRFFLJYIZXRTEZ-MRXNPFEDSA-N 2 0 369.510 -1.081 20 0 FAADRP CCN(C)C(=O)CNC(=O)C(=O)N[C@H]1CCN(C2CC[NH+](C)CC2)C1 ZINC000672638089 482689634 /nfs/dbraw/zinc/68/96/34/482689634.db2.gz JFGFFTAXPUXVGD-ZDUSSCGKSA-N 2 0 353.467 -1.134 20 0 FAADRP C[NH+](C)CCOCCNC(=O)C(=O)N[C@H]1CCN(C2CC[NH+](C)CC2)C1 ZINC000672642199 483788118 /nfs/dbraw/zinc/78/81/18/483788118.db2.gz YYCOUOFIIAJDLS-HNNXBMFYSA-N 2 0 369.510 -1.035 20 0 FAADRP C[NH+](C)CCOCCNC(=O)C(=O)N[C@@H]1CCN(C2CC[NH+](C)CC2)C1 ZINC000672642200 483788110 /nfs/dbraw/zinc/78/81/10/483788110.db2.gz YYCOUOFIIAJDLS-OAHLLOKOSA-N 2 0 369.510 -1.035 20 0 FAADRP C[NH+](C)CCOCCNC(=O)C(=O)N1CCN([C@H]2CCC[N@H+](C)C2)CC1 ZINC000673351681 483789537 /nfs/dbraw/zinc/78/95/37/483789537.db2.gz BXLWUCRJAJCHHX-INIZCTEOSA-N 2 0 369.510 -1.081 20 0 FAADRP C[NH+](C)CCOCCNC(=O)C(=O)N1CCN([C@@H]2CCC[N@H+](C)C2)CC1 ZINC000673351682 483789057 /nfs/dbraw/zinc/78/90/57/483789057.db2.gz BXLWUCRJAJCHHX-MRXNPFEDSA-N 2 0 369.510 -1.081 20 0 FAADRP C[NH+](C)C[C@H](CO)NC(=O)[C@@H]1CCC[C@@H](C(=O)N[C@H](CO)C[NH+](C)C)C1 ZINC000673520892 483788826 /nfs/dbraw/zinc/78/88/26/483788826.db2.gz IVWIUQYFLQKUJS-FPCVCCKLSA-N 2 0 372.510 -1.130 20 0 FAADRP C[NH+](C)C[C@H](CO)NC(=O)[C@@H]1CCC[C@H](C(=O)N[C@H](CO)C[NH+](C)C)C1 ZINC000673520901 483789495 /nfs/dbraw/zinc/78/94/95/483789495.db2.gz IVWIUQYFLQKUJS-GEEKYZPCSA-N 2 0 372.510 -1.130 20 0 FAADRP C[NH+](C)C[C@H](CO)NC(=O)[C@@H]1CCC[C@@H](C(=O)N[C@@H](CO)C[NH+](C)C)C1 ZINC000673521041 483788917 /nfs/dbraw/zinc/78/89/17/483788917.db2.gz IVWIUQYFLQKUJS-KLHDSHLOSA-N 2 0 372.510 -1.130 20 0 FAADRP C[NH+](C)C[C@H](CO)NC(=O)[C@@H]1CCC[C@H](C(=O)N[C@@H](CO)C[NH+](C)C)C1 ZINC000673521042 483789595 /nfs/dbraw/zinc/78/95/95/483789595.db2.gz IVWIUQYFLQKUJS-QKPAOTATSA-N 2 0 372.510 -1.130 20 0 FAADRP O=C(N[C@H]1CC[N@H+](CCN2CCOCC2)C1)[C@H]1C[NH+]2CCN1CCC2 ZINC000677892432 483795064 /nfs/dbraw/zinc/79/50/64/483795064.db2.gz WSPBPSITMQQVFY-DLBZAZTESA-N 2 0 351.495 -1.101 20 0 FAADRP O=C(N[C@@H]1CC[N@H+](CCN2CCOCC2)C1)[C@H]1C[NH+]2CCN1CCC2 ZINC000677892433 483794849 /nfs/dbraw/zinc/79/48/49/483794849.db2.gz WSPBPSITMQQVFY-IAGOWNOFSA-N 2 0 351.495 -1.101 20 0 FAADRP O=C(N[C@H]1CC[N@H+](CCN2CCOCC2)C1)[C@@H]1C[NH+]2CCN1CCC2 ZINC000677892434 483794820 /nfs/dbraw/zinc/79/48/20/483794820.db2.gz WSPBPSITMQQVFY-IRXDYDNUSA-N 2 0 351.495 -1.101 20 0 FAADRP O=C(N[C@@H]1CC[N@H+](CCN2CCOCC2)C1)[C@@H]1C[NH+]2CCN1CCC2 ZINC000677892435 483794871 /nfs/dbraw/zinc/79/48/71/483794871.db2.gz WSPBPSITMQQVFY-SJORKVTESA-N 2 0 351.495 -1.101 20 0 FAADRP CN1CCC([N@@H+]2CC[C@H](NC(=O)NCCN3CCNC(=O)C3)C2)CC1 ZINC000679713451 483797391 /nfs/dbraw/zinc/79/73/91/483797391.db2.gz ULOQRSGPXKUUHL-AWEZNQCLSA-N 2 0 352.483 -1.114 20 0 FAADRP CN1CCC([N@@H+]2CC[C@@H](NC(=O)NCCN3CCNC(=O)C3)C2)CC1 ZINC000679713454 483797424 /nfs/dbraw/zinc/79/74/24/483797424.db2.gz ULOQRSGPXKUUHL-CQSZACIVSA-N 2 0 352.483 -1.114 20 0 FAADRP C[N@@H+]1CC[C@@](O)(CNC(=O)N[C@H]2CC[NH+](CCN3CCOCC3)C2)C1 ZINC000680834194 483798992 /nfs/dbraw/zinc/79/89/92/483798992.db2.gz CUPGCVRDRQEIGH-DOTOQJQBSA-N 2 0 355.483 -1.241 20 0 FAADRP C[N@@H+]1CC[C@@](O)(CNC(=O)N[C@@H]2CC[NH+](CCN3CCOCC3)C2)C1 ZINC000680834202 483798696 /nfs/dbraw/zinc/79/86/96/483798696.db2.gz CUPGCVRDRQEIGH-NVXWUHKLSA-N 2 0 355.483 -1.241 20 0 FAADRP C[N@@H+]1CC[C@](O)(CNC(=O)N[C@H]2CC[NH+](CCN3CCOCC3)C2)C1 ZINC000680834203 483798613 /nfs/dbraw/zinc/79/86/13/483798613.db2.gz CUPGCVRDRQEIGH-RDJZCZTQSA-N 2 0 355.483 -1.241 20 0 FAADRP C[N@@H+]1CC[C@](O)(CNC(=O)N[C@@H]2CC[NH+](CCN3CCOCC3)C2)C1 ZINC000680834204 483798666 /nfs/dbraw/zinc/79/86/66/483798666.db2.gz CUPGCVRDRQEIGH-WBVHZDCISA-N 2 0 355.483 -1.241 20 0 FAADRP C[C@@H](NC(=O)C(=O)N(CC[NH+](C)C)CC[NH+](C)C)[C@@H]1CN(C)CCO1 ZINC000685341024 483805481 /nfs/dbraw/zinc/80/54/81/483805481.db2.gz MITZXMXMHOEIHY-CABCVRRESA-N 2 0 357.499 -1.227 20 0 FAADRP C[C@H](NC(=O)C(=O)N(CC[NH+](C)C)CC[NH+](C)C)[C@@H]1CN(C)CCO1 ZINC000685341045 483805500 /nfs/dbraw/zinc/80/55/00/483805500.db2.gz MITZXMXMHOEIHY-GJZGRUSLSA-N 2 0 357.499 -1.227 20 0 FAADRP C[C@@H](NC(=O)C(=O)N(CC[NH+](C)C)CC[NH+](C)C)[C@H]1CN(C)CCO1 ZINC000685341048 483804906 /nfs/dbraw/zinc/80/49/06/483804906.db2.gz MITZXMXMHOEIHY-HUUCEWRRSA-N 2 0 357.499 -1.227 20 0 FAADRP C[C@H](NC(=O)C(=O)N(CC[NH+](C)C)CC[NH+](C)C)[C@H]1CN(C)CCO1 ZINC000685341050 483804722 /nfs/dbraw/zinc/80/47/22/483804722.db2.gz MITZXMXMHOEIHY-LSDHHAIUSA-N 2 0 357.499 -1.227 20 0 FAADRP COCC[N@@H+]1CC[C@H](NC(=O)C(=O)NC[C@H]2C[NH+]3CCC[C@H]3CO2)C1 ZINC000804061061 658587648 /nfs/dbraw/zinc/58/76/48/658587648.db2.gz RSRKVEDAWDHRME-KKUMJFAQSA-N 2 0 354.451 -1.197 20 0 FAADRP COCC[N@@H+]1CC[C@H](NC(=O)C(=O)NC[C@@H]2C[NH+]3CCC[C@@H]3CO2)C1 ZINC000804061062 658587797 /nfs/dbraw/zinc/58/77/97/658587797.db2.gz RSRKVEDAWDHRME-RRFJBIMHSA-N 2 0 354.451 -1.197 20 0 FAADRP COCC[N@@H+]1CC[C@H](NC(=O)C(=O)NC[C@@H]2C[NH+]3CCC[C@H]3CO2)C1 ZINC000804061063 658588131 /nfs/dbraw/zinc/58/81/31/658588131.db2.gz RSRKVEDAWDHRME-SOUVJXGZSA-N 2 0 354.451 -1.197 20 0 FAADRP COCC[N@@H+]1CC[C@H](NC(=O)C(=O)NC[C@H]2C[NH+]3CCC[C@@H]3CO2)C1 ZINC000804061064 658588215 /nfs/dbraw/zinc/58/82/15/658588215.db2.gz RSRKVEDAWDHRME-ZNMIVQPWSA-N 2 0 354.451 -1.197 20 0 FAADRP CCO[C@@H]1CN(C(=O)C(=O)NC[C@H]2C[N@@H+]3CCC[C@@H]3CO2)C[C@H]1C[NH3+] ZINC000846331198 658689570 /nfs/dbraw/zinc/68/95/70/658689570.db2.gz SAJZBHYFSKZLCX-APIJFGDWSA-N 2 0 354.451 -1.212 20 0 FAADRP CCO[C@@H]1CN(C(=O)C(=O)NC[C@H]2C[N@@H+]3CCC[C@H]3CO2)C[C@H]1C[NH3+] ZINC000846331201 658689432 /nfs/dbraw/zinc/68/94/32/658689432.db2.gz SAJZBHYFSKZLCX-CBBWQLFWSA-N 2 0 354.451 -1.212 20 0 FAADRP CCO[C@@H]1CN(C(=O)C(=O)NC[C@@H]2C[N@@H+]3CCC[C@@H]3CO2)C[C@H]1C[NH3+] ZINC000846331204 658689287 /nfs/dbraw/zinc/68/92/87/658689287.db2.gz SAJZBHYFSKZLCX-KBUPBQIOSA-N 2 0 354.451 -1.212 20 0 FAADRP CCO[C@@H]1CN(C(=O)C(=O)NC[C@@H]2C[N@@H+]3CCC[C@H]3CO2)C[C@H]1C[NH3+] ZINC000846331206 658689536 /nfs/dbraw/zinc/68/95/36/658689536.db2.gz SAJZBHYFSKZLCX-LXTVHRRPSA-N 2 0 354.451 -1.212 20 0 FAADRP C[NH+]1CC[C@H](C(=O)NCCS(=O)(=O)CCNC(=O)[C@H]2CC[N@@H+](C)C2)C1 ZINC000848038721 658698200 /nfs/dbraw/zinc/69/82/00/658698200.db2.gz OBMLLLLZSDTFDZ-KBPBESRZSA-N 2 0 374.507 -1.463 20 0 FAADRP C[NH+]1CC[C@@H](C(=O)NCCS(=O)(=O)CCNC(=O)[C@H]2CC[N@@H+](C)C2)C1 ZINC000848038722 658698096 /nfs/dbraw/zinc/69/80/96/658698096.db2.gz OBMLLLLZSDTFDZ-OKILXGFUSA-N 2 0 374.507 -1.463 20 0 FAADRP C[NH+]1CC[C@@H](C(=O)NCCS(=O)(=O)CCNC(=O)[C@@H]2CC[N@@H+](C)C2)C1 ZINC000848038723 658698305 /nfs/dbraw/zinc/69/83/05/658698305.db2.gz OBMLLLLZSDTFDZ-ZIAGYGMSSA-N 2 0 374.507 -1.463 20 0 FAADRP O=C(NC[C@H]1C[NH+]2CCC[C@@H]2CO1)C(=O)N1CC[N@@H+]2C[C@H](O)C[C@H]2C1 ZINC000848932322 658702377 /nfs/dbraw/zinc/70/23/77/658702377.db2.gz NMOISPRWIHOMRF-BARDWOONSA-N 2 0 352.435 -1.757 20 0 FAADRP O=C(NC[C@@H]1C[NH+]2CCC[C@H]2CO1)C(=O)N1CC[N@@H+]2C[C@H](O)C[C@H]2C1 ZINC000848932323 658702512 /nfs/dbraw/zinc/70/25/12/658702512.db2.gz NMOISPRWIHOMRF-BYNSBNAKSA-N 2 0 352.435 -1.757 20 0 FAADRP O=C(NC[C@@H]1C[NH+]2CCC[C@@H]2CO1)C(=O)N1CC[N@@H+]2C[C@H](O)C[C@H]2C1 ZINC000848932324 658702534 /nfs/dbraw/zinc/70/25/34/658702534.db2.gz NMOISPRWIHOMRF-LXTVHRRPSA-N 2 0 352.435 -1.757 20 0 FAADRP O=C(NC[C@H]1C[NH+]2CCC[C@H]2CO1)C(=O)N1CC[N@@H+]2C[C@H](O)C[C@H]2C1 ZINC000848932325 658702282 /nfs/dbraw/zinc/70/22/82/658702282.db2.gz NMOISPRWIHOMRF-XQLPTFJDSA-N 2 0 352.435 -1.757 20 0 FAADRP C[NH+](C)C[C@H](CO)NC(=O)[C@@H]1CC[C@H](C(=O)N[C@@H](CO)C[NH+](C)C)C1 ZINC000854469175 658721074 /nfs/dbraw/zinc/72/10/74/658721074.db2.gz XKHZPWDJPCFOCO-LXTVHRRPSA-N 2 0 358.483 -1.520 20 0 FAADRP C[NH+](C)C[C@H](CO)NC(=O)[C@@H]1CC[C@H](C(=O)N[C@H](CO)C[NH+](C)C)C1 ZINC000854469176 658721209 /nfs/dbraw/zinc/72/12/09/658721209.db2.gz XKHZPWDJPCFOCO-NMWPEEMBSA-N 2 0 358.483 -1.520 20 0 FAADRP C[NH+](C)C[C@H](CO)NC(=O)[C@H]1CC[C@@H](C(=O)N[C@H](CO)C[NH+](C)C)C1 ZINC000854469177 658721817 /nfs/dbraw/zinc/72/18/17/658721817.db2.gz XKHZPWDJPCFOCO-PYHGIMPFSA-N 2 0 358.483 -1.520 20 0 FAADRP C[NH+](C)C[C@@H](CO)NC(=O)[C@@H]1CC[C@H](C(=O)N[C@H](CO)C[NH+](C)C)C1 ZINC000854469178 658721400 /nfs/dbraw/zinc/72/14/00/658721400.db2.gz XKHZPWDJPCFOCO-XGUBFFRZSA-N 2 0 358.483 -1.520 20 0 FAADRP C[Si](C)(CC[NH+]1CC[C@@](O)(C(N)=O)C1)CC[N@@H+]1CC[C@@](O)(C(N)=O)C1 ZINC000859272196 658734063 /nfs/dbraw/zinc/73/40/63/658734063.db2.gz OGOHCDZNFXGOOQ-HOTGVXAUSA-N 2 0 372.542 -1.461 20 0 FAADRP C[Si](C)(CC[NH+]1CC[C@](O)(C(N)=O)C1)CC[N@@H+]1CC[C@](O)(C(N)=O)C1 ZINC000859272197 658733988 /nfs/dbraw/zinc/73/39/88/658733988.db2.gz OGOHCDZNFXGOOQ-HZPDHXFCSA-N 2 0 372.542 -1.461 20 0 FAADRP C[Si](C)(CC[NH+]1CC[C@](O)(C(N)=O)C1)CC[N@@H+]1CC[C@@](O)(C(N)=O)C1 ZINC000859272209 658733567 /nfs/dbraw/zinc/73/35/67/658733567.db2.gz OGOHCDZNFXGOOQ-IYBDPMFKSA-N 2 0 372.542 -1.461 20 0 FAADRP C[Si](C)(CC[NH+]1C[C@H](O)C[C@H]1C(N)=O)CC[N@@H+]1C[C@H](O)C[C@H]1C(N)=O ZINC000859364626 658735328 /nfs/dbraw/zinc/73/53/28/658735328.db2.gz LBUCDACUWKNVLH-MQYQWHSLSA-N 2 0 372.542 -1.464 20 0 FAADRP C[C@H]([NH3+])CN(C)C(=O)C(=O)NCC1(N2CCOCC2)CC[NH+](C)CC1 ZINC000861741464 658742326 /nfs/dbraw/zinc/74/23/26/658742326.db2.gz ONJFPYZMPGYHQC-AWEZNQCLSA-N 2 0 355.483 -1.295 20 0 FAADRP C[C@@H]([NH3+])CN(C)C(=O)C(=O)NCC1(N2CCOCC2)CC[NH+](C)CC1 ZINC000861741465 658742228 /nfs/dbraw/zinc/74/22/28/658742228.db2.gz ONJFPYZMPGYHQC-CQSZACIVSA-N 2 0 355.483 -1.295 20 0 FAADRP COC(=O)CN(C)C(=O)CC[N@@H+]1CC[C@@H](N2C(=O)O[C@H]3C[NH2+]C[C@H]32)C1 ZINC000866711226 658754630 /nfs/dbraw/zinc/75/46/30/658754630.db2.gz FRRHRSQPRUXHJY-UPJWGTAASA-N 2 0 354.407 -1.125 20 0 FAADRP COC(=O)CN(C)C(=O)CC[N@@H+]1CC[C@H](N2C(=O)O[C@H]3C[NH2+]C[C@H]32)C1 ZINC000866711227 658754804 /nfs/dbraw/zinc/75/48/04/658754804.db2.gz FRRHRSQPRUXHJY-XQQFMLRXSA-N 2 0 354.407 -1.125 20 0 FAADRP C[C@H]1C(=O)NCCN1C(=O)C(=O)N1C[C@@H](C[NH+](C)C)[C@H](C[NH+](C)C)C1 ZINC000867424568 658689453 /nfs/dbraw/zinc/68/94/53/658689453.db2.gz TWNZNXIRFNVBIA-BFHYXJOUSA-N 2 0 353.467 -1.469 20 0 FAADRP C[C@@H]1C(=O)NCCN1C(=O)C(=O)N1C[C@@H](C[NH+](C)C)[C@H](C[NH+](C)C)C1 ZINC000867424569 658689125 /nfs/dbraw/zinc/68/91/25/658689125.db2.gz TWNZNXIRFNVBIA-MGPQQGTHSA-N 2 0 353.467 -1.469 20 0 FAADRP CN(CCOCCO)C(=O)C(=O)N1C[C@@H](C[NH+](C)C)[C@H](C[NH+](C)C)C1 ZINC000867560332 658755887 /nfs/dbraw/zinc/75/58/87/658755887.db2.gz YMOOZFRQBBSYGS-HUUCEWRRSA-N 2 0 358.483 -1.349 20 0 FAADRP C[C@H]1C(=O)N(C)CN1C(=O)C(=O)N1C[C@@H](C[NH+](C)C)[C@H](C[NH+](C)C)C1 ZINC000867621877 658755961 /nfs/dbraw/zinc/75/59/61/658755961.db2.gz COYXQIDIOOBQOO-BFHYXJOUSA-N 2 0 353.467 -1.169 20 0 FAADRP C[C@@H]1C(=O)N(C)CN1C(=O)C(=O)N1C[C@@H](C[NH+](C)C)[C@H](C[NH+](C)C)C1 ZINC000867621878 658756125 /nfs/dbraw/zinc/75/61/25/658756125.db2.gz COYXQIDIOOBQOO-MGPQQGTHSA-N 2 0 353.467 -1.169 20 0 FAADRP CN1CCN(C(=O)C(=O)N2C[C@@H](C[NH+](C)C)[C@H](C[NH+](C)C)C2)CC1=O ZINC000867626161 658756069 /nfs/dbraw/zinc/75/60/69/658756069.db2.gz OBOCITBFBOOCDX-ZIAGYGMSSA-N 2 0 353.467 -1.515 20 0 FAADRP C[C@H]1CN(C(=O)C(=O)N2C[C@@H](C[NH+](C)C)[C@H](C[NH+](C)C)C2)CC(=O)N1 ZINC000867675398 658755805 /nfs/dbraw/zinc/75/58/05/658755805.db2.gz DIMYNUMSTGXVOK-BFHYXJOUSA-N 2 0 353.467 -1.469 20 0 FAADRP C[C@@H]1CN(C(=O)C(=O)N2C[C@@H](C[NH+](C)C)[C@H](C[NH+](C)C)C2)CC(=O)N1 ZINC000867675399 658756184 /nfs/dbraw/zinc/75/61/84/658756184.db2.gz DIMYNUMSTGXVOK-MGPQQGTHSA-N 2 0 353.467 -1.469 20 0 FAADRP CN(CC[NH+](C)C)C(=O)C(=O)N1CC[C@@H](N2C(=O)O[C@H]3C[NH2+]C[C@H]32)C1 ZINC000868358052 658757741 /nfs/dbraw/zinc/75/77/41/658757741.db2.gz KZLDQZOZRKXAMB-UPJWGTAASA-N 2 0 353.423 -1.600 20 0 FAADRP CN(CC[NH+](C)C)C(=O)C(=O)N1CC[C@H](N2C(=O)O[C@H]3C[NH2+]C[C@H]32)C1 ZINC000868358053 658757223 /nfs/dbraw/zinc/75/72/23/658757223.db2.gz KZLDQZOZRKXAMB-XQQFMLRXSA-N 2 0 353.423 -1.600 20 0 FAADRP C[NH+](C)C[C@@H]1CN(C(=O)C(=O)N2CCO[C@@H](C[NH3+])C2)C[C@H]1C[NH+](C)C ZINC000868389097 658758502 /nfs/dbraw/zinc/75/85/02/658758502.db2.gz MTDSSNKJYACYHK-KFWWJZLASA-N 3 0 355.483 -1.630 20 0 FAADRP C[NH+](C)C[C@@H]1CN(C(=O)C(=O)N2CCO[C@H](C[NH3+])C2)C[C@H]1C[NH+](C)C ZINC000868389100 658758441 /nfs/dbraw/zinc/75/84/41/658758441.db2.gz MTDSSNKJYACYHK-RBSFLKMASA-N 3 0 355.483 -1.630 20 0 FAADRP C[NH+](C)C[C@@H]1CN(C(=O)C(=O)N2C[C@H]3C[NH2+]C[C@H]3C2)C[C@H]1C[NH+](C)C ZINC000868389521 658758283 /nfs/dbraw/zinc/75/82/83/658758283.db2.gz RUADAKYGDLQOFP-QKPAOTATSA-N 3 0 351.495 -1.138 20 0 FAADRP CN(CCOCC[NH3+])C(=O)C(=O)N1C[C@@H](C[NH+](C)C)[C@H](C[NH+](C)C)C1 ZINC000868397298 658758445 /nfs/dbraw/zinc/75/84/45/658758445.db2.gz ROMBWCVNCPTVGW-HUUCEWRRSA-N 3 0 357.499 -1.382 20 0 FAADRP CN(C)S(=O)(=O)N(C)CC(=O)N1C[C@@H](C[NH+](C)C)[C@H](C[NH+](C)C)C1 ZINC000870018642 658760165 /nfs/dbraw/zinc/76/01/65/658760165.db2.gz UWXSHMJKVHQEMQ-ZIAGYGMSSA-N 2 0 363.528 -1.078 20 0 FAADRP Cn1c(=O)ccn(CC(=O)N2C[C@@H](C[NH+](C)C)[C@H](C[NH+](C)C)C2)c1=O ZINC000870023672 658760017 /nfs/dbraw/zinc/76/00/17/658760017.db2.gz IGNIZWPAAZIJGS-ZIAGYGMSSA-N 2 0 351.451 -1.255 20 0 FAADRP COC[C@]1(C(=O)N2CC[C@@H](N3C(=O)O[C@H]4C[NH2+]C[C@H]43)C2)C[NH2+]CCO1 ZINC000872302215 658762604 /nfs/dbraw/zinc/76/26/04/658762604.db2.gz RUPOWCOCADFFHO-FOCJUVANSA-N 2 0 354.407 -1.615 20 0 FAADRP COC[C@@]1(C(=O)N2CC[C@@H](N3C(=O)O[C@H]4C[NH2+]C[C@H]43)C2)C[NH2+]CCO1 ZINC000872302216 658762542 /nfs/dbraw/zinc/76/25/42/658762542.db2.gz RUPOWCOCADFFHO-NFFDBFGFSA-N 2 0 354.407 -1.615 20 0 FAADRP COC[C@@]1(C(=O)N2CC[C@H](N3C(=O)O[C@H]4C[NH2+]C[C@H]43)C2)C[NH2+]CCO1 ZINC000872302217 658762373 /nfs/dbraw/zinc/76/23/73/658762373.db2.gz RUPOWCOCADFFHO-RSUWNVLCSA-N 2 0 354.407 -1.615 20 0 FAADRP COC[C@]1(C(=O)N2CC[C@H](N3C(=O)O[C@H]4C[NH2+]C[C@H]43)C2)C[NH2+]CCO1 ZINC000872302218 658762626 /nfs/dbraw/zinc/76/26/26/658762626.db2.gz RUPOWCOCADFFHO-ZWUHOBOKSA-N 2 0 354.407 -1.615 20 0 FAADRP C[NH+](C)CCN(CC[NH+](C)C)C(=O)C(=O)N1CCC(CO)(CO)CC1 ZINC000872855713 658764109 /nfs/dbraw/zinc/76/41/09/658764109.db2.gz OZQXPUAXNQRFGY-UHFFFAOYSA-N 2 0 358.483 -1.468 20 0 FAADRP CCN(C)C(=O)CNC(=O)C(=O)N1C[C@@H](C[NH+](C)C)[C@H](C[NH+](C)C)C1 ZINC000875314718 658766954 /nfs/dbraw/zinc/76/69/54/658766954.db2.gz LTYYCAXGNZUTBU-ZIAGYGMSSA-N 2 0 355.483 -1.221 20 0 FAADRP C[NH+](C)C[C@@H]1CN(C(=O)NCCN2CCNC(=O)C2)C[C@H]1C[NH+](C)C ZINC000875478023 658766655 /nfs/dbraw/zinc/76/66/55/658766655.db2.gz WFDFBHYIIFYZKO-HUUCEWRRSA-N 2 0 354.499 -1.201 20 0 FAADRP COC[C@]1(C(=O)N2CCC[C@@H](C(=O)N3CC[NH2+]CC3)C2)C[NH2+]CCO1 ZINC000876512064 658769433 /nfs/dbraw/zinc/76/94/33/658769433.db2.gz FDIZECQNRNYRBU-PBHICJAKSA-N 2 0 354.451 -1.338 20 0 FAADRP COC[C@@]1(C(=O)N2CCC[C@@H](C(=O)N3CC[NH2+]CC3)C2)C[NH2+]CCO1 ZINC000876512065 658769871 /nfs/dbraw/zinc/76/98/71/658769871.db2.gz FDIZECQNRNYRBU-RHSMWYFYSA-N 2 0 354.451 -1.338 20 0 FAADRP COC[C@@]1(C(=O)N2CCC[C@H](C(=O)N3CC[NH2+]CC3)C2)C[NH2+]CCO1 ZINC000876512066 658769958 /nfs/dbraw/zinc/76/99/58/658769958.db2.gz FDIZECQNRNYRBU-WMLDXEAASA-N 2 0 354.451 -1.338 20 0 FAADRP COC[C@]1(C(=O)N2CCC[C@H](C(=O)N3CC[NH2+]CC3)C2)C[NH2+]CCO1 ZINC000876512068 658769777 /nfs/dbraw/zinc/76/97/77/658769777.db2.gz FDIZECQNRNYRBU-YOEHRIQHSA-N 2 0 354.451 -1.338 20 0 FAADRP COC[C@]1(C(=O)N2CCN(C(=O)C[NH+]3CCCC3)CC2)C[NH2+]CCO1 ZINC000876752408 658770674 /nfs/dbraw/zinc/77/06/74/658770674.db2.gz OTEREUBLXCCHRK-KRWDZBQOSA-N 2 0 354.451 -1.242 20 0 FAADRP COC[C@@]1(C(=O)N2CCN(C(=O)C[NH+]3CCCC3)CC2)C[NH2+]CCO1 ZINC000876752409 658770445 /nfs/dbraw/zinc/77/04/45/658770445.db2.gz OTEREUBLXCCHRK-QGZVFWFLSA-N 2 0 354.451 -1.242 20 0 FAADRP COC[C@@]1(C(=O)N[C@H]2CC[N@H+](CCN3CCOCC3)C2)C[NH2+]CCO1 ZINC000876767928 658770526 /nfs/dbraw/zinc/77/05/26/658770526.db2.gz DXJFOLDTCOABBI-DOTOQJQBSA-N 2 0 356.467 -1.486 20 0 FAADRP COC[C@@]1(C(=O)N[C@@H]2CC[N@H+](CCN3CCOCC3)C2)C[NH2+]CCO1 ZINC000876767935 658770324 /nfs/dbraw/zinc/77/03/24/658770324.db2.gz DXJFOLDTCOABBI-NVXWUHKLSA-N 2 0 356.467 -1.486 20 0 FAADRP COC[C@]1(C(=O)N[C@H]2CC[N@H+](CCN3CCOCC3)C2)C[NH2+]CCO1 ZINC000876767938 658770366 /nfs/dbraw/zinc/77/03/66/658770366.db2.gz DXJFOLDTCOABBI-RDJZCZTQSA-N 2 0 356.467 -1.486 20 0 FAADRP COC[C@]1(C(=O)N[C@@H]2CC[N@H+](CCN3CCOCC3)C2)C[NH2+]CCO1 ZINC000876767941 658770480 /nfs/dbraw/zinc/77/04/80/658770480.db2.gz DXJFOLDTCOABBI-WBVHZDCISA-N 2 0 356.467 -1.486 20 0 FAADRP COC[C@]1(C(=O)NC[C@H](N2CC[NH2+]CC2)C(F)(F)F)C[NH2+]CCO1 ZINC000876841714 658770547 /nfs/dbraw/zinc/77/05/47/658770547.db2.gz ULPPDMFOAMSSGL-AAEUAGOBSA-N 2 0 354.373 -1.056 20 0 FAADRP COC[C@@]1(C(=O)NC[C@@H](N2CC[NH2+]CC2)C(F)(F)F)C[NH2+]CCO1 ZINC000876841715 658770399 /nfs/dbraw/zinc/77/03/99/658770399.db2.gz ULPPDMFOAMSSGL-DGCLKSJQSA-N 2 0 354.373 -1.056 20 0 FAADRP COC[C@@]1(C(=O)NC[C@H](N2CC[NH2+]CC2)C(F)(F)F)C[NH2+]CCO1 ZINC000876841716 658770520 /nfs/dbraw/zinc/77/05/20/658770520.db2.gz ULPPDMFOAMSSGL-WCQYABFASA-N 2 0 354.373 -1.056 20 0 FAADRP COC[C@]1(C(=O)NC[C@@H](N2CC[NH2+]CC2)C(F)(F)F)C[NH2+]CCO1 ZINC000876841717 658770614 /nfs/dbraw/zinc/77/06/14/658770614.db2.gz ULPPDMFOAMSSGL-YPMHNXCESA-N 2 0 354.373 -1.056 20 0 FAADRP COC[C@]1(C(=O)N2CCN(C(=O)N3CC[NH2+]CC3)CC2)C[NH2+]CCO1 ZINC000876997304 658771694 /nfs/dbraw/zinc/77/16/94/658771694.db2.gz SMKLURIWUXJQQY-INIZCTEOSA-N 2 0 355.439 -1.839 20 0 FAADRP COC[C@@]1(C(=O)N2CCN(C(=O)N3CC[NH2+]CC3)CC2)C[NH2+]CCO1 ZINC000876997305 658771250 /nfs/dbraw/zinc/77/12/50/658771250.db2.gz SMKLURIWUXJQQY-MRXNPFEDSA-N 2 0 355.439 -1.839 20 0 FAADRP CN(C)S(=O)(=O)CCS(=O)(=O)N(CC[NH+](C)C)CC[NH+](C)C ZINC000881859802 658775577 /nfs/dbraw/zinc/77/55/77/658775577.db2.gz CUHZUCFCIQLAPP-UHFFFAOYSA-N 2 0 358.530 -1.367 20 0 FAADRP COCC[N@H+](C)CCNC(=O)C(=O)NC[C@@H]1CC2(CO1)CC[NH2+]CC2 ZINC000884563161 658782298 /nfs/dbraw/zinc/78/22/98/658782298.db2.gz XXUXDVBCJNAXRA-AWEZNQCLSA-N 2 0 356.467 -1.044 20 0 FAADRP COCC[N@H+](C)CCNC(=O)C(=O)NC[C@H]1CC2(CO1)CC[NH2+]CC2 ZINC000884563162 658782192 /nfs/dbraw/zinc/78/21/92/658782192.db2.gz XXUXDVBCJNAXRA-CQSZACIVSA-N 2 0 356.467 -1.044 20 0 FAADRP CN(C)C(=O)[C@@H]1CCC[N@@H+]1CCCNC(=O)C(=O)N1CCC[C@@H]1C[NH3+] ZINC000884601110 658782165 /nfs/dbraw/zinc/78/21/65/658782165.db2.gz BHBSGCSIIRXSMC-KGLIPLIRSA-N 2 0 353.467 -1.005 20 0 FAADRP CN(C)C(=O)[C@H]1CCC[N@@H+]1CCCNC(=O)C(=O)N1CCC[C@@H]1C[NH3+] ZINC000884601111 658782385 /nfs/dbraw/zinc/78/23/85/658782385.db2.gz BHBSGCSIIRXSMC-ZIAGYGMSSA-N 2 0 353.467 -1.005 20 0 FAADRP C[C@@H]1C[C@H]([NH3+])CN1C(=O)C(=O)NCCC[N@@H+]1CCC[C@@H]1C(=O)N(C)C ZINC000884601316 658782536 /nfs/dbraw/zinc/78/25/36/658782536.db2.gz HNLQJXHNJIIIBT-HZSPNIEDSA-N 2 0 353.467 -1.007 20 0 FAADRP C[C@@H]1C[C@@H]([NH3+])CN1C(=O)C(=O)NCCC[N@@H+]1CCC[C@H]1C(=O)N(C)C ZINC000884601317 658782267 /nfs/dbraw/zinc/78/22/67/658782267.db2.gz HNLQJXHNJIIIBT-MCIONIFRSA-N 2 0 353.467 -1.007 20 0 FAADRP C[C@@H]1C[C@@H]([NH3+])CN1C(=O)C(=O)NCCC[N@@H+]1CCC[C@@H]1C(=O)N(C)C ZINC000884601318 658782482 /nfs/dbraw/zinc/78/24/82/658782482.db2.gz HNLQJXHNJIIIBT-MGPQQGTHSA-N 2 0 353.467 -1.007 20 0 FAADRP C[C@@H]1C[C@H]([NH3+])CN1C(=O)C(=O)NCCC[N@@H+]1CCC[C@H]1C(=O)N(C)C ZINC000884601319 658782149 /nfs/dbraw/zinc/78/21/49/658782149.db2.gz HNLQJXHNJIIIBT-RDBSUJKOSA-N 2 0 353.467 -1.007 20 0 FAADRP CN(C)C(=O)[C@@H]1CCC[N@@H+]1CCCNC(=O)C(=O)N1C[C@@H]2C[C@H]1C[NH2+]2 ZINC000884601833 658782419 /nfs/dbraw/zinc/78/24/19/658782419.db2.gz WTSGMPIMWCARAF-IHRRRGAJSA-N 2 0 351.451 -1.382 20 0 FAADRP CN(C)C(=O)[C@H]1CCC[N@@H+]1CCCNC(=O)C(=O)N1C[C@@H]2C[C@H]1C[NH2+]2 ZINC000884601834 658782454 /nfs/dbraw/zinc/78/24/54/658782454.db2.gz WTSGMPIMWCARAF-MELADBBJSA-N 2 0 351.451 -1.382 20 0 FAADRP C[NH+](C)CCOCCNC(=O)C(=O)NC[C@@H]1CC2(CO1)CC[NH2+]CC2 ZINC000884662037 658782594 /nfs/dbraw/zinc/78/25/94/658782594.db2.gz GBERWNWOYARHNA-AWEZNQCLSA-N 2 0 356.467 -1.044 20 0 FAADRP C[NH+](C)CCOCCNC(=O)C(=O)NC[C@H]1CC2(CO1)CC[NH2+]CC2 ZINC000884662038 658782204 /nfs/dbraw/zinc/78/22/04/658782204.db2.gz GBERWNWOYARHNA-CQSZACIVSA-N 2 0 356.467 -1.044 20 0 FAADRP C[NH+](C)C1(C)CCC(NC(=O)C(=O)NCC(=O)N2CC[NH2+]CC2)CC1 ZINC000884679515 658783475 /nfs/dbraw/zinc/78/34/75/658783475.db2.gz KMHYPWPIWYEDBE-UHFFFAOYSA-N 2 0 353.467 -1.087 20 0 FAADRP CCC1([NH+](C)C)CCN(C(=O)C(=O)NCC(=O)N2CC[NH2+]CC2)CC1 ZINC000884679860 658783384 /nfs/dbraw/zinc/78/33/84/658783384.db2.gz XMJBLPQWSRIXDO-UHFFFAOYSA-N 2 0 353.467 -1.133 20 0 FAADRP C[NH+](C)C[C@@H]1CN(C(=O)C(=O)NC[C@@H]2C[NH2+]CCO2)C[C@H]1C[NH+](C)C ZINC000884725493 658783008 /nfs/dbraw/zinc/78/30/08/658783008.db2.gz LYSAZWQHJFIJEK-KFWWJZLASA-N 3 0 355.483 -1.711 20 0 FAADRP C[NH+](C)C[C@@H]1CN(C(=O)C(=O)NC[C@H]2C[NH2+]CCO2)C[C@H]1C[NH+](C)C ZINC000884725494 658783215 /nfs/dbraw/zinc/78/32/15/658783215.db2.gz LYSAZWQHJFIJEK-RBSFLKMASA-N 3 0 355.483 -1.711 20 0 FAADRP C[NH+](C)C[C@@H]1CN(C(=O)C(=O)NC[C@H]2COCC[NH2+]2)C[C@H]1C[NH+](C)C ZINC000884816660 658784180 /nfs/dbraw/zinc/78/41/80/658784180.db2.gz ZPBMYKZSFNDDJW-KFWWJZLASA-N 3 0 355.483 -1.711 20 0 FAADRP C[NH+](C)C[C@@H]1CN(C(=O)C(=O)NC[C@@H]2COCC[NH2+]2)C[C@H]1C[NH+](C)C ZINC000884816661 658783980 /nfs/dbraw/zinc/78/39/80/658783980.db2.gz ZPBMYKZSFNDDJW-RBSFLKMASA-N 3 0 355.483 -1.711 20 0 FAADRP CC(C)([NH3+])CCNC(=O)C(=O)N1CCN(C(=O)C[NH+]2CCCC2)CC1 ZINC000885200243 658784792 /nfs/dbraw/zinc/78/47/92/658784792.db2.gz AKECJAQOGSDXBJ-UHFFFAOYSA-N 2 0 353.467 -1.003 20 0 FAADRP C[N@@H+]1CCC[C@@H]1C(=O)N1CCN(C(=O)C(=O)NCCC(C)(C)[NH3+])CC1 ZINC000885201132 658785192 /nfs/dbraw/zinc/78/51/92/658785192.db2.gz RJEQGGMLWGEJRB-CYBMUJFWSA-N 2 0 353.467 -1.005 20 0 FAADRP C[N@@H+]1CCC[C@H]1C(=O)N1CCN(C(=O)C(=O)NCCC(C)(C)[NH3+])CC1 ZINC000885201133 658784667 /nfs/dbraw/zinc/78/46/67/658784667.db2.gz RJEQGGMLWGEJRB-ZDUSSCGKSA-N 2 0 353.467 -1.005 20 0 FAADRP C[NH+](C)C[C@@H]1CN(C(=O)NCC(=O)N2CC[NH2+]CC2)C[C@H]1C[NH+](C)C ZINC000891970843 657267055 /nfs/dbraw/zinc/26/70/55/657267055.db2.gz POMPXNKZHLYXRI-HUUCEWRRSA-N 3 0 354.499 -1.201 20 0 FAADRP O=C(NCCN1CC[NH2+]CC1)N1CC[C@@H](N2C(=O)O[C@H]3C[NH2+]C[C@H]32)C1 ZINC000891972225 657266976 /nfs/dbraw/zinc/26/69/76/657266976.db2.gz BLRFNGZXXAEYCM-MCIONIFRSA-N 2 0 352.439 -1.532 20 0 FAADRP O=C(NCCN1CC[NH2+]CC1)N1CC[C@H](N2C(=O)O[C@H]3C[NH2+]C[C@H]32)C1 ZINC000891972229 657267102 /nfs/dbraw/zinc/26/71/02/657267102.db2.gz BLRFNGZXXAEYCM-MJBXVCDLSA-N 2 0 352.439 -1.532 20 0 FAADRP COC(=O)[C@]12C[C@H]([NH3+])C[C@H]1C[N@H+](CC(=O)N1CCN(C(C)=O)CC1)C2 ZINC000903491046 659328948 /nfs/dbraw/zinc/32/89/48/659328948.db2.gz SJGXLCNFFVKDRT-VBQJREDUSA-N 2 0 352.435 -1.111 20 0 FAADRP [NH3+][C@@H]1CN(C(=O)C(=O)N2CC[N@@H+]3C[C@H](O)C[C@H]3C2)C[C@H]1C(F)(F)F ZINC000903772209 659331196 /nfs/dbraw/zinc/33/11/96/659331196.db2.gz WUMNKCYHOUCOCZ-LNFKQOIKSA-N 2 0 350.341 -1.388 20 0 FAADRP C[NH2+]CCOCCN(C)C(=O)C(=O)N1CC[C@@H]2[C@@H]1CCC[N@@H+]2CCO ZINC000904986104 657972473 /nfs/dbraw/zinc/97/24/73/657972473.db2.gz GJUNDXVNZLWECE-CABCVRRESA-N 2 0 356.467 -1.262 20 0 FAADRP C[NH2+]CCOCCN(C)C(=O)C(=O)N1CC[C@H]2[C@@H]1CCC[N@@H+]2CCO ZINC000904986105 657972643 /nfs/dbraw/zinc/97/26/43/657972643.db2.gz GJUNDXVNZLWECE-GJZGRUSLSA-N 2 0 356.467 -1.262 20 0 FAADRP C[NH2+]CCOCCN(C)C(=O)C(=O)N1CC[C@@H]2[C@H]1CCC[N@@H+]2CCO ZINC000904986106 657972509 /nfs/dbraw/zinc/97/25/09/657972509.db2.gz GJUNDXVNZLWECE-HUUCEWRRSA-N 2 0 356.467 -1.262 20 0 FAADRP C[NH2+]CCOCCN(C)C(=O)C(=O)N1CC[C@H]2[C@H]1CCC[N@@H+]2CCO ZINC000904986107 657972360 /nfs/dbraw/zinc/97/23/60/657972360.db2.gz GJUNDXVNZLWECE-LSDHHAIUSA-N 2 0 356.467 -1.262 20 0 FAADRP O=C(C(=O)N1CCNCC[NH2+]CC1)N1CC[C@@H]2[C@@H]1CCC[N@H+]2CCO ZINC000904987216 657972529 /nfs/dbraw/zinc/97/25/29/657972529.db2.gz NPAJQPHZKKBUFB-CABCVRRESA-N 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C[C@H]([NH3+])[C@@H]1CN(C(=O)C(=O)N2CC[C@H]3[C@H]2CCC[N@@H+]3CCO)CCO1 ZINC000904991701 657972376 /nfs/dbraw/zinc/97/23/76/657972376.db2.gz XHWZSYCQPZIXKR-XQLPTFJDSA-N 2 0 354.451 -1.381 20 0 FAADRP C[C@H]([NH3+])[C@@H]1CN(C(=O)C(=O)N2CC[C@@H]3[C@H]2CCC[N@@H+]3CCO)CCO1 ZINC000904991702 657972464 /nfs/dbraw/zinc/97/24/64/657972464.db2.gz XHWZSYCQPZIXKR-YJNKXOJESA-N 2 0 354.451 -1.381 20 0 FAADRP COC[C@@H]1C[NH2+]CCN1C(=O)C(=O)N1CCC([N@H+](C)CCCO)CC1 ZINC000905014435 657972592 /nfs/dbraw/zinc/97/25/92/657972592.db2.gz JMFTYNSCGXGVQO-HNNXBMFYSA-N 2 0 356.467 -1.262 20 0 FAADRP COC[C@H]1C[NH2+]CCN1C(=O)C(=O)N1CCC([N@H+](C)CCCO)CC1 ZINC000905014436 657972702 /nfs/dbraw/zinc/97/27/02/657972702.db2.gz JMFTYNSCGXGVQO-OAHLLOKOSA-N 2 0 356.467 -1.262 20 0 FAADRP COC[C@@H]1C[NH2+]CCN1C(=O)C(=O)N1CCN(CC(C)(C)O)[C@@H](C)C1 ZINC000905021034 657973347 /nfs/dbraw/zinc/97/33/47/657973347.db2.gz CRRNSZXFAGQGTA-KBPBESRZSA-N 2 0 356.467 -1.263 20 0 FAADRP COC[C@@H]1C[NH2+]CCN1C(=O)C(=O)N1CCN(CC(C)(C)O)[C@H](C)C1 ZINC000905021035 657973557 /nfs/dbraw/zinc/97/35/57/657973557.db2.gz CRRNSZXFAGQGTA-KGLIPLIRSA-N 2 0 356.467 -1.263 20 0 FAADRP COC[C@H]1C[NH2+]CCN1C(=O)C(=O)N1CCN(CC(C)(C)O)[C@@H](C)C1 ZINC000905021036 657973709 /nfs/dbraw/zinc/97/37/09/657973709.db2.gz CRRNSZXFAGQGTA-UONOGXRCSA-N 2 0 356.467 -1.263 20 0 FAADRP COC[C@H]1C[NH2+]CCN1C(=O)C(=O)N1CCN(CC(C)(C)O)[C@H](C)C1 ZINC000905021037 657973453 /nfs/dbraw/zinc/97/34/53/657973453.db2.gz CRRNSZXFAGQGTA-ZIAGYGMSSA-N 2 0 356.467 -1.263 20 0 FAADRP O=C(N1CC[NH2+]CC1)N1CCN(S(=O)(=O)CC2CC[NH2+]CC2)CC1 ZINC000905363099 657976530 /nfs/dbraw/zinc/97/65/30/657976530.db2.gz ZIGQPWHETZUVEK-UHFFFAOYSA-N 2 0 359.496 -1.041 20 0 FAADRP C[NH+](C)CCN(CC[NH+](C)C)S(=O)(=O)CC1CN(S(C)(=O)=O)C1 ZINC000906911133 657979875 /nfs/dbraw/zinc/97/98/75/657979875.db2.gz FWWIZASBIUWKHX-UHFFFAOYSA-N 2 0 370.541 -1.367 20 0 FAADRP CN(CCNC(=O)[C@]1(C)C[C@H](O)C[N@@H+]1C)C(=O)[C@@]1(C)C[C@H](O)C[NH+]1C 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UVOXLNKTFJUECR-OAHLLOKOSA-N 2 0 355.483 -1.375 20 0 FAADRP COC[C@H]1C[NH2+]CCN1C(=O)C(=O)NC[C@H]1C[N@H+](CC(C)C)CCO1 ZINC000910990348 657998259 /nfs/dbraw/zinc/99/82/59/657998259.db2.gz BVWJSQPJDWCWFB-CABCVRRESA-N 2 0 356.467 -1.094 20 0 FAADRP COC[C@@H]1C[NH2+]CCN1C(=O)C(=O)NC[C@H]1C[N@H+](CC(C)C)CCO1 ZINC000910990355 657998658 /nfs/dbraw/zinc/99/86/58/657998658.db2.gz BVWJSQPJDWCWFB-GJZGRUSLSA-N 2 0 356.467 -1.094 20 0 FAADRP COC[C@H]1C[NH2+]CCN1C(=O)C(=O)NC[C@@H]1C[N@H+](CC(C)C)CCO1 ZINC000910990357 657998722 /nfs/dbraw/zinc/99/87/22/657998722.db2.gz BVWJSQPJDWCWFB-HUUCEWRRSA-N 2 0 356.467 -1.094 20 0 FAADRP COC[C@@H]1C[NH2+]CCN1C(=O)C(=O)NC[C@@H]1C[N@H+](CC(C)C)CCO1 ZINC000910990360 657998585 /nfs/dbraw/zinc/99/85/85/657998585.db2.gz BVWJSQPJDWCWFB-LSDHHAIUSA-N 2 0 356.467 -1.094 20 0 FAADRP CC(C)C[N@@H+]1CCO[C@@H](CNC(=O)C(=O)N2CCNCC[NH2+]CC2)C1 ZINC000910993643 657998639 /nfs/dbraw/zinc/99/86/39/657998639.db2.gz UCWCGDOQAKTCKC-HNNXBMFYSA-N 2 0 355.483 -1.519 20 0 FAADRP CC(C)C[N@@H+]1CCO[C@H](CNC(=O)C(=O)N2CCNCC[NH2+]CC2)C1 ZINC000910993644 657999966 /nfs/dbraw/zinc/99/99/66/657999966.db2.gz UCWCGDOQAKTCKC-OAHLLOKOSA-N 2 0 355.483 -1.519 20 0 FAADRP CN1CC[N@H+](C)C[C@H]1CNC(=O)C(=O)N1C[C@@H](C(F)(F)F)[C@H]([NH3+])C1 ZINC000911030974 657999628 /nfs/dbraw/zinc/99/96/28/657999628.db2.gz NNCDAOWOOOMMIU-GMTAPVOTSA-N 2 0 351.373 -1.304 20 0 FAADRP CN1CC[N@H+](C)C[C@@H]1CNC(=O)C(=O)N1C[C@@H](C(F)(F)F)[C@H]([NH3+])C1 ZINC000911030975 657999978 /nfs/dbraw/zinc/99/99/78/657999978.db2.gz NNCDAOWOOOMMIU-HBNTYKKESA-N 2 0 351.373 -1.304 20 0 FAADRP C[NH+]1CCC(CNC(=O)C(=O)NCC2([NH3+])CC2)(N2CCOCC2)CC1 ZINC000911042715 657999669 /nfs/dbraw/zinc/99/96/69/657999669.db2.gz OHKSPORGSREPAV-UHFFFAOYSA-N 2 0 353.467 -1.493 20 0 FAADRP C[N@H+](CCNC(=O)C(=O)NC[C@H]1CC2(CC[NH2+]CC2)C(=O)O1)C1CC1 ZINC000911053469 658000003 /nfs/dbraw/zinc/00/00/03/658000003.db2.gz PQMJSOSOYGGJQH-CYBMUJFWSA-N 2 0 352.435 -1.002 20 0 FAADRP C[N@H+](CCNC(=O)C(=O)NC[C@@H]1CC2(CC[NH2+]CC2)C(=O)O1)C1CC1 ZINC000911053470 658000096 /nfs/dbraw/zinc/00/00/96/658000096.db2.gz PQMJSOSOYGGJQH-ZDUSSCGKSA-N 2 0 352.435 -1.002 20 0 FAADRP C[N@@H+]1CCN(CCNC(=O)C(=O)N2CCNCC[NH2+]CC2)CC1(C)C ZINC000911096270 658000680 /nfs/dbraw/zinc/00/06/80/658000680.db2.gz JBHSBMNHFKLAKH-UHFFFAOYSA-N 2 0 354.499 -1.850 20 0 FAADRP COC[C@@H]1C[NH2+]CCN1C(=O)C(=O)NCCN1CC[N@H+](C)C(C)(C)C1 ZINC000911097606 658000918 /nfs/dbraw/zinc/00/09/18/658000918.db2.gz RSOWUFLARHUITF-AWEZNQCLSA-N 2 0 355.483 -1.425 20 0 FAADRP COC[C@H]1C[NH2+]CCN1C(=O)C(=O)NCCN1CC[N@H+](C)C(C)(C)C1 ZINC000911097607 658001605 /nfs/dbraw/zinc/00/16/05/658001605.db2.gz RSOWUFLARHUITF-CQSZACIVSA-N 2 0 355.483 -1.425 20 0 FAADRP COC[C@@H]1C[NH2+]CCN1C(=O)C(=O)NC1CCN(CC[NH+](C)C)CC1 ZINC000911099751 658001172 /nfs/dbraw/zinc/00/11/72/658001172.db2.gz BHVAUNFDACCTFK-HNNXBMFYSA-N 2 0 355.483 -1.425 20 0 FAADRP COC[C@H]1C[NH2+]CCN1C(=O)C(=O)NC1CCN(CC[NH+](C)C)CC1 ZINC000911099752 658000803 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DTDGMORZTHVKQV-AWEZNQCLSA-N 2 0 356.467 -1.044 20 0 FAADRP COCC[N@H+](C)CCNC(=O)C(=O)N[C@H]1C[NH2+]CC2(CCOCC2)C1 ZINC000911154780 658002471 /nfs/dbraw/zinc/00/24/71/658002471.db2.gz DTDGMORZTHVKQV-CQSZACIVSA-N 2 0 356.467 -1.044 20 0 FAADRP COC[C@@H]1C[NH2+]CCN1C(=O)C(=O)NCCCC[NH+]1CCN(C)CC1 ZINC000911185338 658003717 /nfs/dbraw/zinc/00/37/17/658003717.db2.gz CURYDXJKWNDVJY-HNNXBMFYSA-N 2 0 355.483 -1.423 20 0 FAADRP COC[C@H]1C[NH2+]CCN1C(=O)C(=O)NCCCC[NH+]1CCN(C)CC1 ZINC000911185339 658003369 /nfs/dbraw/zinc/00/33/69/658003369.db2.gz CURYDXJKWNDVJY-OAHLLOKOSA-N 2 0 355.483 -1.423 20 0 FAADRP COCC[N@@H+]1CCC[C@H]1CNC(=O)C(=O)NCCN1CCC([NH3+])CC1 ZINC000911186636 658003298 /nfs/dbraw/zinc/00/32/98/658003298.db2.gz JQAQIYFZHWWDFX-HNNXBMFYSA-N 2 0 355.483 -1.247 20 0 FAADRP COCC[N@@H+]1CCC[C@@H]1CNC(=O)C(=O)NCCN1CCC([NH3+])CC1 ZINC000911186638 658003624 /nfs/dbraw/zinc/00/36/24/658003624.db2.gz JQAQIYFZHWWDFX-OAHLLOKOSA-N 2 0 355.483 -1.247 20 0 FAADRP C[C@@H]1CN(C(=O)C(=O)NCCC[N@@H+]2CCC[C@H]2C(=O)N(C)C)C[C@H]1[NH3+] ZINC000911187117 658003864 /nfs/dbraw/zinc/00/38/64/658003864.db2.gz MMNXDZKJKKWUBT-MCIONIFRSA-N 2 0 353.467 -1.149 20 0 FAADRP C[C@@H]1CN(C(=O)C(=O)NCCC[N@@H+]2CCC[C@@H]2C(=O)N(C)C)C[C@H]1[NH3+] ZINC000911187118 658003675 /nfs/dbraw/zinc/00/36/75/658003675.db2.gz MMNXDZKJKKWUBT-MGPQQGTHSA-N 2 0 353.467 -1.149 20 0 FAADRP C[C@@H]1C[NH2+]C[C@H]1NC(=O)C(=O)NCCC[N@@H+]1CCC[C@H]1C(=O)N(C)C ZINC000911187373 658003980 /nfs/dbraw/zinc/00/39/80/658003980.db2.gz ONJBIFPYPXIARZ-MCIONIFRSA-N 2 0 353.467 -1.231 20 0 FAADRP C[C@@H]1C[NH2+]C[C@H]1NC(=O)C(=O)NCCC[N@@H+]1CCC[C@@H]1C(=O)N(C)C ZINC000911187374 658004006 /nfs/dbraw/zinc/00/40/06/658004006.db2.gz ONJBIFPYPXIARZ-MGPQQGTHSA-N 2 0 353.467 -1.231 20 0 FAADRP CN(C)C(=O)[C@@H]1CCC[N@@H+]1CCCNC(=O)C(=O)N1CCC[C@H]([NH3+])C1 ZINC000911188737 658003401 /nfs/dbraw/zinc/00/34/01/658003401.db2.gz VWKKCHJRRVMWOW-KBPBESRZSA-N 2 0 353.467 -1.005 20 0 FAADRP CN(C)C(=O)[C@H]1CCC[N@@H+]1CCCNC(=O)C(=O)N1CCC[C@H]([NH3+])C1 ZINC000911188738 658004034 /nfs/dbraw/zinc/00/40/34/658004034.db2.gz VWKKCHJRRVMWOW-UONOGXRCSA-N 2 0 353.467 -1.005 20 0 FAADRP C[NH+](C)CCOCCNC(=O)C(=O)N[C@@H]1C[NH2+]CC2(CCOCC2)C1 ZINC000911259271 658006061 /nfs/dbraw/zinc/00/60/61/658006061.db2.gz XDJIUZBSSQTLSZ-AWEZNQCLSA-N 2 0 356.467 -1.044 20 0 FAADRP C[NH+](C)CCOCCNC(=O)C(=O)N[C@H]1C[NH2+]CC2(CCOCC2)C1 ZINC000911259273 658005607 /nfs/dbraw/zinc/00/56/07/658005607.db2.gz XDJIUZBSSQTLSZ-CQSZACIVSA-N 2 0 356.467 -1.044 20 0 FAADRP COC[C@@H]1C[NH2+]CCN1C(=O)C(=O)NC[C@@H](C)C[NH+]1CCN(C)CC1 ZINC000911270118 658004796 /nfs/dbraw/zinc/00/47/96/658004796.db2.gz SXCPWZQFAANZQP-CABCVRRESA-N 2 0 355.483 -1.567 20 0 FAADRP COC[C@@H]1C[NH2+]CCN1C(=O)C(=O)NC[C@H](C)C[NH+]1CCN(C)CC1 ZINC000911270119 658005165 /nfs/dbraw/zinc/00/51/65/658005165.db2.gz SXCPWZQFAANZQP-GJZGRUSLSA-N 2 0 355.483 -1.567 20 0 FAADRP COC[C@H]1C[NH2+]CCN1C(=O)C(=O)NC[C@@H](C)C[NH+]1CCN(C)CC1 ZINC000911270120 658004770 /nfs/dbraw/zinc/00/47/70/658004770.db2.gz SXCPWZQFAANZQP-HUUCEWRRSA-N 2 0 355.483 -1.567 20 0 FAADRP COC[C@H]1C[NH2+]CCN1C(=O)C(=O)NC[C@H](C)C[NH+]1CCN(C)CC1 ZINC000911270121 658005112 /nfs/dbraw/zinc/00/51/12/658005112.db2.gz SXCPWZQFAANZQP-LSDHHAIUSA-N 2 0 355.483 -1.567 20 0 FAADRP O=C(NCCN1CC[NH2+]CC1)C(=O)N1CC[C@@H]2[C@@H]1CCC[N@H+]2CCO ZINC000911274313 658005081 /nfs/dbraw/zinc/00/50/81/658005081.db2.gz OINFUXOUTITHSC-CABCVRRESA-N 2 0 353.467 -1.935 20 0 FAADRP O=C(NCCN1CC[NH2+]CC1)C(=O)N1CC[C@H]2[C@@H]1CCC[N@H+]2CCO ZINC000911274314 658005787 /nfs/dbraw/zinc/00/57/87/658005787.db2.gz OINFUXOUTITHSC-GJZGRUSLSA-N 2 0 353.467 -1.935 20 0 FAADRP O=C(NCCN1CC[NH2+]CC1)C(=O)N1CC[C@@H]2[C@H]1CCC[N@H+]2CCO ZINC000911274315 658006000 /nfs/dbraw/zinc/00/60/00/658006000.db2.gz OINFUXOUTITHSC-HUUCEWRRSA-N 2 0 353.467 -1.935 20 0 FAADRP O=C(NCCN1CC[NH2+]CC1)C(=O)N1CC[C@H]2[C@H]1CCC[N@H+]2CCO ZINC000911274316 658005850 /nfs/dbraw/zinc/00/58/50/658005850.db2.gz OINFUXOUTITHSC-LSDHHAIUSA-N 2 0 353.467 -1.935 20 0 FAADRP O=C(NC[C@@H]1C[NH2+]CCCO1)C(=O)N1CC[C@H]2[C@@H]1CCC[N@H+]2CCO ZINC000911309047 658005508 /nfs/dbraw/zinc/00/55/08/658005508.db2.gz DDCYGCSBDHWYRN-KKUMJFAQSA-N 2 0 354.451 -1.461 20 0 FAADRP O=C(NC[C@@H]1C[NH2+]CCCO1)C(=O)N1CC[C@@H]2[C@H]1CCC[N@H+]2CCO ZINC000911309048 658006016 /nfs/dbraw/zinc/00/60/16/658006016.db2.gz DDCYGCSBDHWYRN-RRFJBIMHSA-N 2 0 354.451 -1.461 20 0 FAADRP O=C(NC[C@@H]1C[NH2+]CCCO1)C(=O)N1CC[C@H]2[C@H]1CCC[N@H+]2CCO ZINC000911309049 658006597 /nfs/dbraw/zinc/00/65/97/658006597.db2.gz DDCYGCSBDHWYRN-SOUVJXGZSA-N 2 0 354.451 -1.461 20 0 FAADRP O=C(NC[C@@H]1C[NH2+]CCCO1)C(=O)N1CC[C@@H]2[C@@H]1CCC[N@H+]2CCO ZINC000911309050 658006505 /nfs/dbraw/zinc/00/65/05/658006505.db2.gz DDCYGCSBDHWYRN-ZNMIVQPWSA-N 2 0 354.451 -1.461 20 0 FAADRP COC[C@@H]1C[NH2+]CCN1C(=O)C(=O)NC1CC[NH+]([C@@H]2CCOC2)CC1 ZINC000911337811 658006793 /nfs/dbraw/zinc/00/67/93/658006793.db2.gz WYILVZOJPVSQSG-CABCVRRESA-N 2 0 354.451 -1.197 20 0 FAADRP COC[C@@H]1C[NH2+]CCN1C(=O)C(=O)NC1CC[NH+]([C@H]2CCOC2)CC1 ZINC000911338045 658006679 /nfs/dbraw/zinc/00/66/79/658006679.db2.gz WYILVZOJPVSQSG-GJZGRUSLSA-N 2 0 354.451 -1.197 20 0 FAADRP COC[C@H]1C[NH2+]CCN1C(=O)C(=O)NC1CC[NH+]([C@@H]2CCOC2)CC1 ZINC000911338047 658006926 /nfs/dbraw/zinc/00/69/26/658006926.db2.gz WYILVZOJPVSQSG-HUUCEWRRSA-N 2 0 354.451 -1.197 20 0 FAADRP COC[C@H]1C[NH2+]CCN1C(=O)C(=O)NC1CC[NH+]([C@H]2CCOC2)CC1 ZINC000911338049 658006952 /nfs/dbraw/zinc/00/69/52/658006952.db2.gz WYILVZOJPVSQSG-LSDHHAIUSA-N 2 0 354.451 -1.197 20 0 FAADRP CC[NH+](CC)CC(=O)N1CCN(C(=O)C(=O)N[C@@H]2C[NH2+]C[C@H]2C)CC1 ZINC000911373337 658009728 /nfs/dbraw/zinc/00/97/28/658009728.db2.gz DQXGCDRDBOQQOM-ZIAGYGMSSA-N 2 0 353.467 -1.277 20 0 FAADRP C[C@@H]1C[NH2+]C[C@H]1NC(=O)C(=O)N1CCN(C(=O)C[NH+]2CCCC2)CC1 ZINC000911374545 658010140 /nfs/dbraw/zinc/01/01/40/658010140.db2.gz RLDLRLDOPXWKQD-ZIAGYGMSSA-N 2 0 351.451 -1.523 20 0 FAADRP C[C@@H]1C[NH2+]C[C@H]1NC(=O)C(=O)N1CCN(C(=O)[C@@H]2CCC[N@@H+]2C)CC1 ZINC000911374548 658010396 /nfs/dbraw/zinc/01/03/96/658010396.db2.gz RNCVXUOUHSXVSC-MCIONIFRSA-N 2 0 351.451 -1.525 20 0 FAADRP C[C@@H]1C[NH2+]C[C@H]1NC(=O)C(=O)N1CCN(C(=O)[C@H]2CCC[N@@H+]2C)CC1 ZINC000911374549 658010625 /nfs/dbraw/zinc/01/06/25/658010625.db2.gz RNCVXUOUHSXVSC-MGPQQGTHSA-N 2 0 351.451 -1.525 20 0 FAADRP CC[NH+](CC)CC(=O)N1CCN(C(=O)C(=O)N[C@H]2C[C@H](C[NH3+])C2)CC1 ZINC000911560066 658013500 /nfs/dbraw/zinc/01/35/00/658013500.db2.gz JEVNRKPAPKUYNR-HDJSIYSDSA-N 2 0 353.467 -1.148 20 0 FAADRP C[N@@H+]1CCC[C@H]1C(=O)N1CCN(C(=O)C(=O)N[C@H]2C[C@H](C[NH3+])C2)CC1 ZINC000911560104 658013759 /nfs/dbraw/zinc/01/37/59/658013759.db2.gz KODLOFRRTSFFNW-IHRRRGAJSA-N 2 0 351.451 -1.395 20 0 FAADRP C[N@@H+]1CCC[C@@H]1C(=O)N1CCN(C(=O)C(=O)N[C@H]2C[C@H](C[NH3+])C2)CC1 ZINC000911560105 658013570 /nfs/dbraw/zinc/01/35/70/658013570.db2.gz KODLOFRRTSFFNW-MGPQQGTHSA-N 2 0 351.451 -1.395 20 0 FAADRP [NH3+]C[C@H]1C[C@H](NC(=O)C(=O)N2CCN(C(=O)C[NH+]3CCCC3)CC2)C1 ZINC000911561363 658013916 /nfs/dbraw/zinc/01/39/16/658013916.db2.gz YDTOHICDTMJMDZ-HDJSIYSDSA-N 2 0 351.451 -1.394 20 0 FAADRP CN1CCN(C(=O)CCCC(=O)N2CCN(C)C[C@H]2CO)[C@H](CO)C1 ZINC000912744698 658019311 /nfs/dbraw/zinc/01/93/11/658019311.db2.gz ZJGSELRWSUWDCI-GJZGRUSLSA-N 2 0 356.467 -1.574 20 0 FAADRP CN1CCN(C(=O)CCCC(=O)N2CCN(C)C[C@@H]2CO)[C@@H](CO)C1 ZINC000912744700 658018824 /nfs/dbraw/zinc/01/88/24/658018824.db2.gz ZJGSELRWSUWDCI-HUUCEWRRSA-N 2 0 356.467 -1.574 20 0 FAADRP O=C(NC[C@@H]1CCCN(S(=O)(=O)N2CC[NH2+]CC2)C1)[C@@H]1CCC[NH2+]1 ZINC000923577352 658425245 /nfs/dbraw/zinc/42/52/45/658425245.db2.gz UIUVSHJMAKVVLQ-KBPBESRZSA-N 2 0 359.496 -1.283 20 0 FAADRP O=C(NC[C@H]1CCCN(S(=O)(=O)N2CC[NH2+]CC2)C1)[C@@H]1CCC[NH2+]1 ZINC000923577357 658425402 /nfs/dbraw/zinc/42/54/02/658425402.db2.gz UIUVSHJMAKVVLQ-KGLIPLIRSA-N 2 0 359.496 -1.283 20 0 FAADRP O=C(NC[C@@H]1CCCN(S(=O)(=O)N2CC[NH2+]CC2)C1)[C@H]1CCC[NH2+]1 ZINC000923577359 658425624 /nfs/dbraw/zinc/42/56/24/658425624.db2.gz UIUVSHJMAKVVLQ-UONOGXRCSA-N 2 0 359.496 -1.283 20 0 FAADRP O=C(NC[C@H]1CCCN(S(=O)(=O)N2CC[NH2+]CC2)C1)[C@H]1CCC[NH2+]1 ZINC000923577362 658425464 /nfs/dbraw/zinc/42/54/64/658425464.db2.gz UIUVSHJMAKVVLQ-ZIAGYGMSSA-N 2 0 359.496 -1.283 20 0 FAADRP C[NH+](C)CCN(C[C@@H]1CCCO1)C(=O)C(=O)N1CCNCC[NH2+]CC1 ZINC000926328468 658795553 /nfs/dbraw/zinc/79/55/53/658795553.db2.gz QGUKKQZRGAGXIN-HNNXBMFYSA-N 2 0 355.483 -1.423 20 0 FAADRP C[NH+](C)CCN(C[C@H]1CCCO1)C(=O)C(=O)N1CCNCC[NH2+]CC1 ZINC000926328472 658795669 /nfs/dbraw/zinc/79/56/69/658795669.db2.gz QGUKKQZRGAGXIN-OAHLLOKOSA-N 2 0 355.483 -1.423 20 0 FAADRP C[NH+](C)CCN(C[C@H]1CCCO1)C(=O)C(=O)N1CCC[C@@]([NH3+])(CO)C1 ZINC000926329150 658795444 /nfs/dbraw/zinc/79/54/44/658795444.db2.gz WLFFFCGLJSFZNJ-PBHICJAKSA-N 2 0 356.467 -1.132 20 0 FAADRP C[NH+](C)CCN(C[C@H]1CCCO1)C(=O)C(=O)N1CCC[C@]([NH3+])(CO)C1 ZINC000926329152 658795510 /nfs/dbraw/zinc/79/55/10/658795510.db2.gz WLFFFCGLJSFZNJ-RHSMWYFYSA-N 2 0 356.467 -1.132 20 0 FAADRP C[NH+](C)CCN(C[C@@H]1CCCO1)C(=O)C(=O)N1CCC[C@]([NH3+])(CO)C1 ZINC000926329154 658795294 /nfs/dbraw/zinc/79/52/94/658795294.db2.gz WLFFFCGLJSFZNJ-WMLDXEAASA-N 2 0 356.467 -1.132 20 0 FAADRP C[NH+](C)CCN(C[C@@H]1CCCO1)C(=O)C(=O)N1CCC[C@@]([NH3+])(CO)C1 ZINC000926329156 658795690 /nfs/dbraw/zinc/79/56/90/658795690.db2.gz WLFFFCGLJSFZNJ-YOEHRIQHSA-N 2 0 356.467 -1.132 20 0 FAADRP CC[NH+](CC)CCN(CCOC)C(=O)C(=O)N1CCNCC[NH2+]CC1 ZINC000926330952 658795418 /nfs/dbraw/zinc/79/54/18/658795418.db2.gz CTPRRZGYVZDYDA-UHFFFAOYSA-N 2 0 357.499 -1.175 20 0 FAADRP C[NH+](C)CCC[C@H]1CN(C(=O)C(=O)N2CCNCC[NH2+]CC2)CCO1 ZINC000926386071 658797164 /nfs/dbraw/zinc/79/71/64/658797164.db2.gz BHPHGUYGPINTMD-HNNXBMFYSA-N 2 0 355.483 -1.423 20 0 FAADRP C[NH+](C)CCC[C@@H]1CN(C(=O)C(=O)N2CCNCC[NH2+]CC2)CCO1 ZINC000926386073 658797246 /nfs/dbraw/zinc/79/72/46/658797246.db2.gz BHPHGUYGPINTMD-OAHLLOKOSA-N 2 0 355.483 -1.423 20 0 FAADRP C[NH+](C)CCC[C@@H]1CN(C(=O)C(=O)N2CCC[C@@]([NH3+])(CO)C2)CCO1 ZINC000926388433 658796945 /nfs/dbraw/zinc/79/69/45/658796945.db2.gz QZPFYAAWIBBCRI-PBHICJAKSA-N 2 0 356.467 -1.132 20 0 FAADRP C[NH+](C)CCC[C@@H]1CN(C(=O)C(=O)N2CCC[C@]([NH3+])(CO)C2)CCO1 ZINC000926388434 658797022 /nfs/dbraw/zinc/79/70/22/658797022.db2.gz QZPFYAAWIBBCRI-RHSMWYFYSA-N 2 0 356.467 -1.132 20 0 FAADRP C[NH+](C)CCC[C@H]1CN(C(=O)C(=O)N2CCC[C@]([NH3+])(CO)C2)CCO1 ZINC000926388435 657270202 /nfs/dbraw/zinc/27/02/02/657270202.db2.gz QZPFYAAWIBBCRI-WMLDXEAASA-N 2 0 356.467 -1.132 20 0 FAADRP C[NH+](C)CCC[C@H]1CN(C(=O)C(=O)N2CCC[C@@]([NH3+])(CO)C2)CCO1 ZINC000926388436 657270306 /nfs/dbraw/zinc/27/03/06/657270306.db2.gz QZPFYAAWIBBCRI-YOEHRIQHSA-N 2 0 356.467 -1.132 20 0 FAADRP CN(C)CC[N@H+](C)CCCN(C)C(=O)C(=O)N1CCC[C@@]([NH3+])(CO)C1 ZINC000926410719 658797902 /nfs/dbraw/zinc/79/79/02/658797902.db2.gz AOCBPRRTMCJBDF-KRWDZBQOSA-N 2 0 357.499 -1.360 20 0 FAADRP CN(C)CC[N@H+](C)CCCN(C)C(=O)C(=O)N1CCC[C@]([NH3+])(CO)C1 ZINC000926410757 658798098 /nfs/dbraw/zinc/79/80/98/658798098.db2.gz AOCBPRRTMCJBDF-QGZVFWFLSA-N 2 0 357.499 -1.360 20 0 FAADRP COCC[N@H+](C)CCNC(=O)C(=O)N1CC[C@@H]2[C@@H]1CCC[NH+]2CCO ZINC000929892193 658803637 /nfs/dbraw/zinc/80/36/37/658803637.db2.gz AUNSFWSGGFXRPV-CABCVRRESA-N 2 0 356.467 -1.262 20 0 FAADRP COCC[N@H+](C)CCNC(=O)C(=O)N1CC[C@H]2[C@@H]1CCC[NH+]2CCO ZINC000929892194 658804134 /nfs/dbraw/zinc/80/41/34/658804134.db2.gz AUNSFWSGGFXRPV-GJZGRUSLSA-N 2 0 356.467 -1.262 20 0 FAADRP COCC[N@H+](C)CCNC(=O)C(=O)N1CC[C@@H]2[C@H]1CCC[NH+]2CCO ZINC000929892195 658802597 /nfs/dbraw/zinc/80/25/97/658802597.db2.gz AUNSFWSGGFXRPV-HUUCEWRRSA-N 2 0 356.467 -1.262 20 0 FAADRP COCC[N@H+](C)CCNC(=O)C(=O)N1CC[C@H]2[C@H]1CCC[NH+]2CCO ZINC000929892196 658803045 /nfs/dbraw/zinc/80/30/45/658803045.db2.gz AUNSFWSGGFXRPV-LSDHHAIUSA-N 2 0 356.467 -1.262 20 0 FAADRP CNC(=O)[C@@H]1CC[NH+]([C@@H](C)CNC(=O)C[N@H+]2CC[C@@H](C(=O)NC)C2)C1 ZINC000930750406 658805639 /nfs/dbraw/zinc/80/56/39/658805639.db2.gz LGBDSMUMTUKEEY-BFHYXJOUSA-N 2 0 353.467 -1.373 20 0 FAADRP CNC(=O)[C@@H]1CC[N@H+](CC(=O)NC[C@@H](C)[NH+]2CC[C@H](C(=O)NC)C2)C1 ZINC000930750409 658806693 /nfs/dbraw/zinc/80/66/93/658806693.db2.gz LGBDSMUMTUKEEY-MCIONIFRSA-N 2 0 353.467 -1.373 20 0 FAADRP CNC(=O)[C@@H]1CC[NH+]([C@H](C)CNC(=O)C[N@H+]2CC[C@@H](C(=O)NC)C2)C1 ZINC000930750411 658806034 /nfs/dbraw/zinc/80/60/34/658806034.db2.gz LGBDSMUMTUKEEY-MGPQQGTHSA-N 2 0 353.467 -1.373 20 0 FAADRP CNC(=O)[C@@H]1CC[N@H+](CC(=O)NC[C@H](C)[NH+]2CC[C@H](C(=O)NC)C2)C1 ZINC000930750413 658806371 /nfs/dbraw/zinc/80/63/71/658806371.db2.gz LGBDSMUMTUKEEY-MJBXVCDLSA-N 2 0 353.467 -1.373 20 0 FAADRP CN1C[C@@H](CCNC(=O)C(=O)N(CC[NH+](C)C)CC[NH+](C)C)CC1=O ZINC000931647442 658810298 /nfs/dbraw/zinc/81/02/98/658810298.db2.gz GRPBMFRPXBGPTB-AWEZNQCLSA-N 2 0 355.483 -1.077 20 0 FAADRP CN1C[C@H](CCNC(=O)C(=O)N(CC[NH+](C)C)CC[NH+](C)C)CC1=O ZINC000931647443 658810896 /nfs/dbraw/zinc/81/08/96/658810896.db2.gz GRPBMFRPXBGPTB-CQSZACIVSA-N 2 0 355.483 -1.077 20 0 FAADRP C[NH+](C)CCN(CC[NH+](C)C)C(=O)C(=O)NC[C@@H]1C[C@@H]2COC[C@@H]2O1 ZINC000932394132 658813677 /nfs/dbraw/zinc/81/36/77/658813677.db2.gz KVFSWYWONVKIKK-ILXRZTDVSA-N 2 0 356.467 -1.142 20 0 FAADRP C[NH+](C)CCN(CC[NH+](C)C)C(=O)C(=O)NC[C@H]1C[C@@H]2COC[C@@H]2O1 ZINC000932394134 658815009 /nfs/dbraw/zinc/81/50/09/658815009.db2.gz KVFSWYWONVKIKK-KFWWJZLASA-N 2 0 356.467 -1.142 20 0 FAADRP C[NH+](C)CCCN(CCC[NH+](C)C)C(=O)[C@@H]1CS(=O)(=O)CC(=O)N1 ZINC000932684336 658815999 /nfs/dbraw/zinc/81/59/99/658815999.db2.gz ILGJRQPBAFDTSI-ZDUSSCGKSA-N 2 0 362.496 -1.368 20 0 FAADRP COc1nn(C)cc1CNC(=O)C(=O)N(CC[NH+](C)C)CC[NH+](C)C ZINC000933818108 657264724 /nfs/dbraw/zinc/26/47/24/657264724.db2.gz QGFXBNNKQDEPSU-UHFFFAOYSA-N 2 0 354.455 -1.003 20 0 FAADRP C[C@@H]1[C@H](C(=O)N2CC[C@@H]([NH2+]CC(=O)N3CCNC(=O)C3)C2)CC[N@@H+]1C ZINC000968728334 659171582 /nfs/dbraw/zinc/17/15/82/659171582.db2.gz JJOKGJDYVQGDFG-MGPQQGTHSA-N 2 0 351.451 -1.525 20 0 FAADRP C[C@@H]1CN(C)C[C@H](C(=O)N2CC[C@@H]([NH2+]CC(=O)N3CCOCC3)C2)O1 ZINC000969071725 659197478 /nfs/dbraw/zinc/19/74/78/659197478.db2.gz BYUICZNMEZQSFS-RBSFLKMASA-N 2 0 354.451 -1.245 20 0 FAADRP C[C@@H]1CN(C)C[C@H](C(=O)N2CC[C@@H]([NH2+]CCN3C(=O)CNC3=O)C2)O1 ZINC000969071891 659197352 /nfs/dbraw/zinc/19/73/52/659197352.db2.gz LZNYFBNZACVCPX-JHJVBQTASA-N 2 0 353.423 -1.552 20 0 FAADRP C[C@@H]1[C@H](C(=O)N2CC[C@H]([NH2+]CC(=O)N3CCNC(=O)C3)C2)CC[N@@H+]1C ZINC001018865579 659219008 /nfs/dbraw/zinc/21/90/08/659219008.db2.gz JJOKGJDYVQGDFG-HZSPNIEDSA-N 2 0 351.451 -1.525 20 0 FAADRP C[C@@H]1[C@H](C(=O)N[C@H]2C[C@H]([NH2+]CC(=O)N3CCNC(=O)C3)C2)CC[N@@H+]1C ZINC001020171336 659222371 /nfs/dbraw/zinc/22/23/71/659222371.db2.gz XRSCNUWSZZGKBN-AAVRWANBSA-N 2 0 351.451 -1.478 20 0 FAADRP C[C@@H]1[C@H](C(=O)N[C@H]2C[C@@H]([NH2+]CC(=O)N3CCNC(=O)C3)C2)CC[N@@H+]1C ZINC001022105274 657260443 /nfs/dbraw/zinc/26/04/43/657260443.db2.gz XRSCNUWSZZGKBN-YIYPIFLZSA-N 2 0 351.451 -1.478 20 0 FAADRP C[C@@H]1CN(C)C[C@H](C(=O)NC[C@@H]2CCN2CCN2C(=O)CNC2=O)O1 ZINC001038397885 657850466 /nfs/dbraw/zinc/85/04/66/657850466.db2.gz DIQFKQNUBHTFLY-FRRDWIJNSA-N 2 0 353.423 -1.552 20 0 FAADRP C[C@@H]1CN(C)C[C@H](C(=O)NC[C@H]2CCN2CCN2C(=O)CNC2=O)O1 ZINC001038397889 657850725 /nfs/dbraw/zinc/85/07/25/657850725.db2.gz DIQFKQNUBHTFLY-JHJVBQTASA-N 2 0 353.423 -1.552 20 0 FAADRP C[C@@H]1[C@H](C(=O)NCC2(O)CN(C(=O)COCC[NH+](C)C)C2)CC[N@@H+]1C ZINC001043261477 659262677 /nfs/dbraw/zinc/26/26/77/659262677.db2.gz LHRJJANEGSAFMQ-ZIAGYGMSSA-N 2 0 356.467 -1.406 20 0 FAADRP C[C@@H]1[C@H](C(=O)N2CC(O)(CNC(=O)COCC[NH+](C)C)C2)CC[N@@H+]1C ZINC001044000275 659282068 /nfs/dbraw/zinc/28/20/68/659282068.db2.gz DSSNIUFCRGRWHB-ZIAGYGMSSA-N 2 0 356.467 -1.406 20 0 FAADRP C[C@@H]1[C@H](C(=O)NC2CC[NH+](CCNC(=O)CC(N)=O)CC2)CC[N@@H+]1C ZINC001055548000 659337518 /nfs/dbraw/zinc/33/75/18/659337518.db2.gz AHSFGELQYMXUBZ-TZMCWYRMSA-N 2 0 353.467 -1.101 20 0 FAADRP C[C@@H]1[C@H](C(=O)NCC[NH+]2CCC(NC(=O)CC(N)=O)CC2)CC[N@@H+]1C ZINC001055583223 659338117 /nfs/dbraw/zinc/33/81/17/659338117.db2.gz DYIRTNNMDJJZCS-TZMCWYRMSA-N 2 0 353.467 -1.101 20 0 FAADRP CC[C@@H]1[C@@H](C(=O)NCC[NH+]2CCC(NC(=O)C(N)=O)CC2)CC[N@@H+]1C ZINC001055583592 659337468 /nfs/dbraw/zinc/33/74/68/659337468.db2.gz UCDIDMMHGRXEPH-UONOGXRCSA-N 2 0 353.467 -1.101 20 0 FAADRP C[NH+](C)CCC(=O)NCC[NH+]1CCC(NC(=O)[C@H]2C[C@H]2C(N)=O)CC1 ZINC001055633481 659338782 /nfs/dbraw/zinc/33/87/82/659338782.db2.gz PIPOLLPEPMLMDY-KGLIPLIRSA-N 2 0 353.467 -1.244 20 0 FAADRP C[NH+](C)CCC(=O)NC1CC[NH+](CCNC(=O)[C@H]2C[C@H]2C(N)=O)CC1 ZINC001055645054 659338383 /nfs/dbraw/zinc/33/83/83/659338383.db2.gz FCESBVLMSHNXFI-KGLIPLIRSA-N 2 0 353.467 -1.244 20 0 FAADRP C[C@@H]1[C@H](C(=O)NCCN(CCO)C(=O)[C@@H]2CN(C)CCO2)CC[N@@H+]1C ZINC001057265252 659350356 /nfs/dbraw/zinc/35/03/56/659350356.db2.gz SRLQDRSXHAOLAR-KFWWJZLASA-N 2 0 356.467 -1.406 20 0 FAADRP C[C@@H]1[C@H](C(=O)NCCN(CCO)C(=O)[C@H]2CN(C)CCO2)CC[N@@H+]1C ZINC001057265253 659350610 /nfs/dbraw/zinc/35/06/10/659350610.db2.gz SRLQDRSXHAOLAR-RBSFLKMASA-N 2 0 356.467 -1.406 20 0 FAADRP C[C@@H]1[C@H](C(=O)N(CCO)CCNC(=O)COCC[NH+](C)C)CC[N@@H+]1C ZINC001057741576 659365622 /nfs/dbraw/zinc/36/56/22/659365622.db2.gz UXCLAFBBABFWBI-HUUCEWRRSA-N 2 0 358.483 -1.158 20 0 FAADRP C[C@@H]1[C@H](C(=O)NCCN(CCO)C(=O)COCC[NH+](C)C)CC[N@@H+]1C ZINC001058157705 659376744 /nfs/dbraw/zinc/37/67/44/659376744.db2.gz GGQJYXMHBCEVTN-HUUCEWRRSA-N 2 0 358.483 -1.158 20 0 FAADRP CC[N@H+](C)CCC(=O)N(CCO)CCNC(=O)[C@H]1CN(C)C[C@@H](C)O1 ZINC001058817763 679512308 /nfs/dbraw/zinc/51/23/08/679512308.db2.gz QYGVZIDXVANHGA-HUUCEWRRSA-N 2 0 358.483 -1.016 20 0 FAADRP C[NH+]1CCC(OCC(=O)N2C[C@@H]([NH2+]CCO)[C@@H](n3ccnn3)C2)CC1 ZINC001070304347 680092181 /nfs/dbraw/zinc/09/21/81/680092181.db2.gz XNUKONHNJZTTMV-CABCVRRESA-N 2 0 352.439 -1.277 20 0 FAADRP C[C@H](C[NH+]1CCOCC1)C(=O)N1C[C@@H]([NH2+]CCO)[C@@H](n2ccnn2)C1 ZINC001070328226 680092832 /nfs/dbraw/zinc/09/28/32/680092832.db2.gz RGQCMHRJDIPEFW-KFWWJZLASA-N 2 0 352.439 -1.420 20 0 FAADRP C[C@@H](C[NH+]1CCOCC1)C(=O)N1C[C@@H]([NH2+]CCO)[C@@H](n2ccnn2)C1 ZINC001070328227 680092567 /nfs/dbraw/zinc/09/25/67/680092567.db2.gz RGQCMHRJDIPEFW-ZNMIVQPWSA-N 2 0 352.439 -1.420 20 0 FAADRP CN1CCO[C@@H](C(=O)N2CC[C@H]3C[N@H+](CCN4CCNC4=O)C[C@H]32)C1 ZINC001075643703 679520579 /nfs/dbraw/zinc/52/05/79/679520579.db2.gz IKTADTLVLNLSKF-RRFJBIMHSA-N 2 0 351.451 -1.125 20 0 FAADRP CN1CCO[C@H](C(=O)N2CC[C@H]3C[N@H+](CCN4CCNC4=O)C[C@H]32)C1 ZINC001075643704 679520446 /nfs/dbraw/zinc/52/04/46/679520446.db2.gz IKTADTLVLNLSKF-ZNMIVQPWSA-N 2 0 351.451 -1.125 20 0 FAADRP C[NH+]1CCC(C(=O)N[C@@H]2C[N@H+](C[C@H](O)Cn3cccn3)C[C@H]2O)CC1 ZINC001077618458 679897410 /nfs/dbraw/zinc/89/74/10/679897410.db2.gz IZYGWKOYWSMWPZ-ARFHVFGLSA-N 2 0 351.451 -1.253 20 0 FAADRP C[NH+]1CCC(C(=O)N[C@@H]2C[N@H+](C[C@@H](O)Cn3cccn3)C[C@H]2O)CC1 ZINC001077618461 679897378 /nfs/dbraw/zinc/89/73/78/679897378.db2.gz IZYGWKOYWSMWPZ-BZUAXINKSA-N 2 0 351.451 -1.253 20 0 FAADRP C[N@@H+]1CC[C@@H](C(=O)N[C@@H]2C[NH+](CCCN3C(=O)CNC3=O)C[C@H]2O)C1 ZINC001078174437 679933714 /nfs/dbraw/zinc/93/37/14/679933714.db2.gz LHELFELWBVACNX-JHJVBQTASA-N 2 0 353.423 -1.959 20 0 FAADRP C[N@@H+]1CC[C@H](C(=O)N[C@@H]2C[NH+](CCCN3C(=O)CNC3=O)C[C@H]2O)C1 ZINC001078174438 679933941 /nfs/dbraw/zinc/93/39/41/679933941.db2.gz LHELFELWBVACNX-YNEHKIRRSA-N 2 0 353.423 -1.959 20 0 FAADRP C[C@@H]1CN(C(=O)[C@@H]2CCC[N@@H+]2C)C[C@H]1[NH2+]CC(=O)N1CCNC(=O)C1 ZINC001082448431 680039919 /nfs/dbraw/zinc/03/99/19/680039919.db2.gz PSYKAOMFYVHBKS-MCIONIFRSA-N 2 0 351.451 -1.525 20 0 FAADRP C[C@@H]1CN(C(=O)[C@H]2CCC[N@@H+]2C)C[C@H]1[NH2+]CC(=O)N1CCNC(=O)C1 ZINC001082448432 680039866 /nfs/dbraw/zinc/03/98/66/680039866.db2.gz PSYKAOMFYVHBKS-MGPQQGTHSA-N 2 0 351.451 -1.525 20 0 FAADRP CC[C@H](C(=O)N1C[C@@H](C)[C@H]([NH2+]CC(=O)N2CCNC(=O)C2)C1)[NH+](C)C ZINC001082589279 680042756 /nfs/dbraw/zinc/04/27/56/680042756.db2.gz SZACWQWKNPJTGU-MGPQQGTHSA-N 2 0 353.467 -1.279 20 0 FAADRP CC[C@@H](C(=O)N1C[C@@H](C)[C@H]([NH2+]CC(=O)N2CCNC(=O)C2)C1)[NH+](C)C ZINC001082747443 680044308 /nfs/dbraw/zinc/04/43/08/680044308.db2.gz SZACWQWKNPJTGU-MCIONIFRSA-N 2 0 353.467 -1.279 20 0 FAADRP C[C@@H]1CN(C(=O)[C@H]2CC[N@H+](C)C2)C[C@H]1[NH2+]CC(=O)N1CCNC(=O)C1 ZINC001082920300 680048689 /nfs/dbraw/zinc/04/86/89/680048689.db2.gz YMEQXXYZUZZDFQ-HZSPNIEDSA-N 2 0 351.451 -1.667 20 0 FAADRP C[C@@H]1CN(C(=O)[C@@H]2CC[N@H+](C)C2)C[C@H]1[NH2+]CC(=O)N1CCNC(=O)C1 ZINC001082920301 680048567 /nfs/dbraw/zinc/04/85/67/680048567.db2.gz YMEQXXYZUZZDFQ-MGPQQGTHSA-N 2 0 351.451 -1.667 20 0 FAADRP C[C@@H]1CN(C(=O)C[NH+]2CCCC2)C[C@H]1[NH2+]CC(=O)N1CCNC(=O)C1 ZINC001082921794 680048797 /nfs/dbraw/zinc/04/87/97/680048797.db2.gz JWORWOLZBRYTGZ-ZIAGYGMSSA-N 2 0 351.451 -1.523 20 0 FAADRP CC[C@H](C(N)=O)N1C[C@@H](NC(=O)c2ccn(CC[NH+](C)C)n2)[C@@H](O)C1 ZINC001083470217 679538454 /nfs/dbraw/zinc/53/84/54/679538454.db2.gz FWVQDQOUVRWVGN-MCIONIFRSA-N 2 0 352.439 -1.517 20 0 FAADRP CC[C@@H](C(N)=O)N1C[C@@H](NC(=O)c2ccn(CC[NH+](C)C)n2)[C@@H](O)C1 ZINC001083470218 679538663 /nfs/dbraw/zinc/53/86/63/679538663.db2.gz FWVQDQOUVRWVGN-RDBSUJKOSA-N 2 0 352.439 -1.517 20 0 FAADRP C[C@H]1C[C@@H](C(=O)N[C@@H]2CN(CCN3CCNC3=O)C[C@@H]2O)CC[N@@H+]1C ZINC001083726945 679622953 /nfs/dbraw/zinc/62/29/53/679622953.db2.gz CRNWZNYCAWJZRD-XQLPTFJDSA-N 2 0 353.467 -1.097 20 0 FAADRP C[NH+]1CCC(C(=O)N[C@@H]2C[N@H+](C[C@@H](O)Cn3cccn3)C[C@@H]2O)CC1 ZINC001083750180 679625910 /nfs/dbraw/zinc/62/59/10/679625910.db2.gz IZYGWKOYWSMWPZ-OAGGEKHMSA-N 2 0 351.451 -1.253 20 0 FAADRP C[NH+]1CCC(C(=O)N[C@@H]2C[N@H+](C[C@H](O)Cn3cccn3)C[C@@H]2O)CC1 ZINC001083750181 679625862 /nfs/dbraw/zinc/62/58/62/679625862.db2.gz IZYGWKOYWSMWPZ-XHSDSOJGSA-N 2 0 351.451 -1.253 20 0 FAADRP C[C@@H]1CCC[N@@H+]1CC(=O)N[C@@H]1CN(CCN2C(=O)CNC2=O)C[C@@H]1O ZINC001083779360 679894977 /nfs/dbraw/zinc/89/49/77/679894977.db2.gz YCAAAAUMDZDHJN-UPJWGTAASA-N 2 0 353.423 -1.816 20 0 FAADRP C[C@H]1CCC[N@@H+]1CC(=O)N[C@@H]1CN(CCN2C(=O)CNC2=O)C[C@@H]1O ZINC001083779361 679895023 /nfs/dbraw/zinc/89/50/23/679895023.db2.gz YCAAAAUMDZDHJN-XQQFMLRXSA-N 2 0 353.423 -1.816 20 0 FAADRP CC[C@H](C(N)=O)N1C[C@@H](NC(=O)c2cnn(CC[NH+](C)C)c2)[C@@H](O)C1 ZINC001083850884 679955840 /nfs/dbraw/zinc/95/58/40/679955840.db2.gz AGAZGJRWQZZHGT-MCIONIFRSA-N 2 0 352.439 -1.517 20 0 FAADRP CC[C@@H](C(N)=O)N1C[C@@H](NC(=O)c2cnn(CC[NH+](C)C)c2)[C@@H](O)C1 ZINC001083850885 679955972 /nfs/dbraw/zinc/95/59/72/679955972.db2.gz AGAZGJRWQZZHGT-RDBSUJKOSA-N 2 0 352.439 -1.517 20 0 FAADRP C[N@@H+]1CC[C@@H](C(=O)N[C@@H]2C[NH+](CCCN3C(=O)CNC3=O)C[C@@H]2O)C1 ZINC001084053792 790605010 /nfs/dbraw/zinc/60/50/10/790605010.db2.gz LHELFELWBVACNX-UPJWGTAASA-N 2 0 353.423 -1.959 20 0 FAADRP C[N@@H+]1CC[C@H](C(=O)N[C@@H]2C[NH+](CCCN3C(=O)CNC3=O)C[C@@H]2O)C1 ZINC001084053793 790605270 /nfs/dbraw/zinc/60/52/70/790605270.db2.gz LHELFELWBVACNX-XQQFMLRXSA-N 2 0 353.423 -1.959 20 0 FAADRP C[NH+](C)CCOCC(=O)N1C[C@H]2C[N@H+](CC(=O)NC(N)=O)C[C@@]2(C)C1 ZINC001101432444 792606183 /nfs/dbraw/zinc/60/61/83/792606183.db2.gz RYIIFBHXHFXSLV-WBMJQRKESA-N 2 0 355.439 -1.460 20 0 FAADRP C[C@@H]1C[N@H+](CC(=O)N2CCNC(=O)C2)C[C@H]1CNC(=O)CC[NH+](C)C ZINC001102318633 792630967 /nfs/dbraw/zinc/63/09/67/792630967.db2.gz BTHJWXIKTPLTKZ-ZIAGYGMSSA-N 2 0 353.467 -1.419 20 0 FAADRP C[C@@H]1C[N@H+](Cc2nc(=O)n(C)[nH]2)C[C@H]1CNC(=O)COCC[NH+](C)C ZINC001102511194 792637180 /nfs/dbraw/zinc/63/71/80/792637180.db2.gz NFQGCJHAGLDQKQ-CHWSQXEVSA-N 2 0 354.455 -1.129 20 0 FAADRP CNC(=O)NC(=O)C[N@H+]1C[C@@H](CNC(=O)COCC[NH+](C)C)[C@H](C)C1 ZINC001102511406 792637990 /nfs/dbraw/zinc/63/79/90/792637990.db2.gz WBZQRJPETOYULF-CHWSQXEVSA-N 2 0 357.455 -1.296 20 0 FAADRP C[C@@H]1C[N@H+](CCNS(C)(=O)=O)C[C@H]1CNC(=O)COCC[NH+](C)C ZINC001102513467 792638053 /nfs/dbraw/zinc/63/80/53/792638053.db2.gz LWHDQZXYPOEMST-ZIAGYGMSSA-N 2 0 364.512 -1.202 20 0 FAADRP C[C@@H](C(=O)NC(N)=O)[N@H+]1C[C@@H](CNC(=O)COCC[NH+](C)C)[C@H](C)C1 ZINC001102514306 792637887 /nfs/dbraw/zinc/63/78/87/792637887.db2.gz TVUSKHAYMOMWFN-FRRDWIJNSA-N 2 0 357.455 -1.168 20 0 FAADRP C[C@H](C(=O)NC(N)=O)[N@H+]1C[C@@H](CNC(=O)COCC[NH+](C)C)[C@H](C)C1 ZINC001102514307 792637797 /nfs/dbraw/zinc/63/77/97/792637797.db2.gz TVUSKHAYMOMWFN-JHJVBQTASA-N 2 0 357.455 -1.168 20 0 FAADRP C[C@@H]1C[N@H+](CC(=O)NC(N)=O)C[C@H]1CCNC(=O)COCC[NH+](C)C ZINC001103641837 792652550 /nfs/dbraw/zinc/65/25/50/792652550.db2.gz GGWFFDQAAYOCSZ-CHWSQXEVSA-N 2 0 357.455 -1.166 20 0 FAADRP C[C@@H]1CN(C(=O)COCC[NH+](C)C)C[C@H]1CC[NH2+]CC(=O)NC(N)=O ZINC001104908494 789667910 /nfs/dbraw/zinc/66/79/10/789667910.db2.gz ZFNBIYTZVDUCOF-CHWSQXEVSA-N 2 0 357.455 -1.166 20 0 FAADRP C[C@@H]1CN(C(=O)[C@H]2CN(C)C[C@@H](C)O2)C[C@H]1C[NH2+]CC(=O)NC(N)=O ZINC001106310784 790453038 /nfs/dbraw/zinc/45/30/38/790453038.db2.gz YJSPEYIBVHOLLZ-FDYHWXHSSA-N 2 0 355.439 -1.416 20 0 FAADRP C[C@@H]1CN(C(=O)CC[NH+](C)C)C[C@H]1C[NH2+]CC(=O)N1CCNC(=O)C1 ZINC001106622744 790461936 /nfs/dbraw/zinc/46/19/36/790461936.db2.gz OGVDVHPQUCZRRI-ZIAGYGMSSA-N 2 0 353.467 -1.419 20 0 FAADRP CNC(=O)NC(=O)C[NH2+]C[C@@H]1CN(C(=O)COCC[NH+](C)C)C[C@H]1C ZINC001106878091 790471456 /nfs/dbraw/zinc/47/14/56/790471456.db2.gz FLCWVXGHDHLGLB-CHWSQXEVSA-N 2 0 357.455 -1.296 20 0 FAADRP C[C@@H]1CN(C(=O)COCC[NH+](C)C)C[C@H]1C[NH2+]Cc1nc(=O)n(C)[nH]1 ZINC001106878389 790471296 /nfs/dbraw/zinc/47/12/96/790471296.db2.gz OSZHTHULAIESCN-CHWSQXEVSA-N 2 0 354.455 -1.129 20 0 FAADRP C[C@@H]1CN(C(=O)COCC[NH+](C)C)C[C@H]1C[NH2+]CCNS(C)(=O)=O ZINC001106880415 790471670 /nfs/dbraw/zinc/47/16/70/790471670.db2.gz IZEACBMURADLBE-ZIAGYGMSSA-N 2 0 364.512 -1.202 20 0 FAADRP C[C@H]([NH2+]C[C@@H]1CN(C(=O)COCC[NH+](C)C)C[C@H]1C)C(=O)NC(N)=O ZINC001106882430 790471617 /nfs/dbraw/zinc/47/16/17/790471617.db2.gz VRQLQSFJELLVQZ-FRRDWIJNSA-N 2 0 357.455 -1.168 20 0 FAADRP C[C@@H]([NH2+]C[C@@H]1CN(C(=O)COCC[NH+](C)C)C[C@H]1C)C(=O)NC(N)=O ZINC001106882432 790471009 /nfs/dbraw/zinc/47/10/09/790471009.db2.gz VRQLQSFJELLVQZ-JHJVBQTASA-N 2 0 357.455 -1.168 20 0 FAADRP COCCOC[C@H](O)CN1CCN(C(=O)[C@H]2CN(C)C[C@@H](C)O2)CC1 ZINC001113007532 790751346 /nfs/dbraw/zinc/75/13/46/790751346.db2.gz UCKGXJBPNSIHRW-BZUAXINKSA-N 2 0 359.467 -1.126 20 0 FAADRP COCCOC[C@@H](O)CN1CCN(C(=O)[C@H]2CN(C)C[C@@H](C)O2)CC1 ZINC001113007533 790751311 /nfs/dbraw/zinc/75/13/11/790751311.db2.gz UCKGXJBPNSIHRW-OWCLPIDISA-N 2 0 359.467 -1.126 20 0 FAADRP CNC(=O)NC(=O)CN1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)[C@H]1CN(C)C[C@@H](C)O1 ZINC001114454292 792491239 /nfs/dbraw/zinc/49/12/39/792491239.db2.gz ZUSKHZVWOVLDGA-DIACKHNESA-N 2 0 353.423 -1.793 20 0 FAADRP COC(=O)[C@H]1CN(C(=O)C(=O)N(CC[NH+](C)C)CC[NH+](C)C)CCO1 ZINC001117858348 792743130 /nfs/dbraw/zinc/74/31/30/792743130.db2.gz JYVNOTHSDUOACZ-CYBMUJFWSA-N 2 0 358.439 -1.661 20 0 FAADRP COC(=O)[C@@H]1CN(C(=O)C(=O)N(CC[NH+](C)C)CC[NH+](C)C)CCO1 ZINC001117858349 792743211 /nfs/dbraw/zinc/74/32/11/792743211.db2.gz JYVNOTHSDUOACZ-ZDUSSCGKSA-N 2 0 358.439 -1.661 20 0 FAADRP C[NH+](C)CCN(CC[NH+](C)C)C(=O)C(=O)N1CC[C@]2(CNC(=O)C2)C1 ZINC001117858881 792742985 /nfs/dbraw/zinc/74/29/85/792742985.db2.gz SCIUROJMFYFEIR-KRWDZBQOSA-N 2 0 353.467 -1.323 20 0 FAADRP C[NH+](C)CCN(CC[NH+](C)C)C(=O)C(=O)N1CC[C@@]2(CNC(=O)C2)C1 ZINC001117858882 792742891 /nfs/dbraw/zinc/74/28/91/792742891.db2.gz SCIUROJMFYFEIR-QGZVFWFLSA-N 2 0 353.467 -1.323 20 0 FAADRP CN(CCNS(C)(=O)=O)C(=O)C(=O)N(CC[NH+](C)C)CC[NH+](C)C ZINC001117859069 792743276 /nfs/dbraw/zinc/74/32/76/792743276.db2.gz VIRZVTZGEOJCSN-UHFFFAOYSA-N 2 0 365.500 -2.054 20 0 FAADRP C[NH2+][C@@H](C)CCNC(=O)C(=O)N1CCN(C(=O)[C@@H]2CCC[N@@H+]2C)CC1 ZINC001117980621 792746125 /nfs/dbraw/zinc/74/61/25/792746125.db2.gz JQVPCJPLGGGQIX-KBPBESRZSA-N 2 0 353.467 -1.134 20 0 FAADRP C[NH2+][C@H](C)CCNC(=O)C(=O)N1CCN(C(=O)[C@@H]2CCC[N@@H+]2C)CC1 ZINC001117980622 792746060 /nfs/dbraw/zinc/74/60/60/792746060.db2.gz JQVPCJPLGGGQIX-KGLIPLIRSA-N 2 0 353.467 -1.134 20 0 FAADRP C[NH2+][C@@H](C)CCNC(=O)C(=O)N1CCN(C(=O)[C@H]2CCC[N@@H+]2C)CC1 ZINC001117980623 792745833 /nfs/dbraw/zinc/74/58/33/792745833.db2.gz JQVPCJPLGGGQIX-UONOGXRCSA-N 2 0 353.467 -1.134 20 0 FAADRP C[NH2+][C@H](C)CCNC(=O)C(=O)N1CCN(C(=O)[C@H]2CCC[N@@H+]2C)CC1 ZINC001117980624 792745959 /nfs/dbraw/zinc/74/59/59/792745959.db2.gz JQVPCJPLGGGQIX-ZIAGYGMSSA-N 2 0 353.467 -1.134 20 0 FAADRP C[NH2+][C@@H](C)CCNC(=O)C(=O)N1CCN(C(=O)C[NH+]2CCCC2)CC1 ZINC001118045778 792746101 /nfs/dbraw/zinc/74/61/01/792746101.db2.gz VXOYRDIAQMWZDU-AWEZNQCLSA-N 2 0 353.467 -1.133 20 0 FAADRP C[NH2+][C@H](C)CCNC(=O)C(=O)N1CCN(C(=O)C[NH+]2CCCC2)CC1 ZINC001118045779 792745772 /nfs/dbraw/zinc/74/57/72/792745772.db2.gz VXOYRDIAQMWZDU-CQSZACIVSA-N 2 0 353.467 -1.133 20 0 FAADRP O=C(CNC(=O)[C@@H]1CCC[NH2+]1)N[C@@H]1CC[N@H+](CCN2CCOCC2)C1 ZINC001118134386 792748493 /nfs/dbraw/zinc/74/84/93/792748493.db2.gz QPEKGZREIAUYLV-CABCVRRESA-N 2 0 353.467 -1.623 20 0 FAADRP O=C(CNC(=O)[C@@H]1CCC[NH2+]1)N[C@H]1CC[N@H+](CCN2CCOCC2)C1 ZINC001118134387 792748463 /nfs/dbraw/zinc/74/84/63/792748463.db2.gz QPEKGZREIAUYLV-GJZGRUSLSA-N 2 0 353.467 -1.623 20 0 FAADRP O=C(CNC(=O)[C@H]1CCC[NH2+]1)N[C@@H]1CC[N@H+](CCN2CCOCC2)C1 ZINC001118134388 792748816 /nfs/dbraw/zinc/74/88/16/792748816.db2.gz QPEKGZREIAUYLV-HUUCEWRRSA-N 2 0 353.467 -1.623 20 0 FAADRP O=C(CNC(=O)[C@H]1CCC[NH2+]1)N[C@H]1CC[N@H+](CCN2CCOCC2)C1 ZINC001118134389 792748620 /nfs/dbraw/zinc/74/86/20/792748620.db2.gz QPEKGZREIAUYLV-LSDHHAIUSA-N 2 0 353.467 -1.623 20 0 FAADRP C[NH+](C)CCN1CCN(C(=O)C(=O)N2CC[C@@H](C[NH+](C)C)C2)CC1=O ZINC001118321399 792762561 /nfs/dbraw/zinc/76/25/61/792762561.db2.gz LISGCKBFYPOYSR-AWEZNQCLSA-N 2 0 353.467 -1.371 20 0 FAADRP C[NH+](C)CCN1CCN(C(=O)C(=O)N2CC[C@H](C[NH+](C)C)C2)CC1=O ZINC001118321400 792762485 /nfs/dbraw/zinc/76/24/85/792762485.db2.gz LISGCKBFYPOYSR-CQSZACIVSA-N 2 0 353.467 -1.371 20 0 FAADRP NC(=O)[C@@H]1CCC[N@H+](CCCNC(=O)C(=O)NCCC2(C[NH3+])CC2)C1 ZINC001118327666 792762504 /nfs/dbraw/zinc/76/25/04/792762504.db2.gz CRBFBYRPYGGYBC-CYBMUJFWSA-N 2 0 353.467 -1.065 20 0 FAADRP NC(=O)[C@H]1CCC[N@H+](CCCNC(=O)C(=O)NCCC2(C[NH3+])CC2)C1 ZINC001118327670 792762363 /nfs/dbraw/zinc/76/23/63/792762363.db2.gz CRBFBYRPYGGYBC-ZDUSSCGKSA-N 2 0 353.467 -1.065 20 0 FAADRP CO[C@@]1(CO)CCCN(C(=O)C(=O)N(CC[NH+](C)C)CC[NH+](C)C)C1 ZINC001118444165 792768391 /nfs/dbraw/zinc/76/83/91/792768391.db2.gz IRFBWEYBCWJMTQ-KRWDZBQOSA-N 2 0 358.483 -1.062 20 0 FAADRP CO[C@]1(CO)CCCN(C(=O)C(=O)N(CC[NH+](C)C)CC[NH+](C)C)C1 ZINC001118444166 792768749 /nfs/dbraw/zinc/76/87/49/792768749.db2.gz IRFBWEYBCWJMTQ-QGZVFWFLSA-N 2 0 358.483 -1.062 20 0 FAADRP CN(CC(C)(C)[NH3+])C(=O)C(=O)N[C@H]1CC[N@H+](CCN2CCOCC2)C1 ZINC001118485679 792771071 /nfs/dbraw/zinc/77/10/71/792771071.db2.gz FZLUYTVQMPFSMI-AWEZNQCLSA-N 2 0 355.483 -1.295 20 0 FAADRP CN(CC(C)(C)[NH3+])C(=O)C(=O)N[C@@H]1CC[N@H+](CCN2CCOCC2)C1 ZINC001118485680 792771480 /nfs/dbraw/zinc/77/14/80/792771480.db2.gz FZLUYTVQMPFSMI-CQSZACIVSA-N 2 0 355.483 -1.295 20 0 FAADRP C[NH2+]C[C@@H](C)NC(=O)C(=O)Nc1cnn(CC(=O)NCC[NH+](C)C)c1 ZINC001118542779 792774800 /nfs/dbraw/zinc/77/48/00/792774800.db2.gz XORICESLXHBNQK-LLVKDONJSA-N 2 0 353.427 -1.777 20 0 FAADRP C[NH2+]C[C@H](C)NC(=O)C(=O)Nc1cnn(CC(=O)NCC[NH+](C)C)c1 ZINC001118542781 792774926 /nfs/dbraw/zinc/77/49/26/792774926.db2.gz XORICESLXHBNQK-NSHDSACASA-N 2 0 353.427 -1.777 20 0 FAADRP COCCN(CC[NH+](C)C)C(=O)C(=O)NCc1nc(C[NH3+])cc(=O)[nH]1 ZINC001118554546 792775722 /nfs/dbraw/zinc/77/57/22/792775722.db2.gz WRACCNAPEIHEBD-UHFFFAOYSA-N 2 0 354.411 -1.706 20 0 FAADRP [NH3+]C[C@@H]1CC(C(=O)N2CC[C@@H]3[C@H](C2)NC(=O)N3C2CC[NH2+]CC2)=NO1 ZINC001118571492 792777588 /nfs/dbraw/zinc/77/75/88/792777588.db2.gz DOMUHMLZAIIYQU-FPMFFAJLSA-N 2 0 350.423 -1.163 20 0 FAADRP [NH3+]C[C@@H]1CC(C(=O)N2CC[C@@H]3[C@@H](C2)NC(=O)N3C2CC[NH2+]CC2)=NO1 ZINC001118571496 792777335 /nfs/dbraw/zinc/77/73/35/792777335.db2.gz DOMUHMLZAIIYQU-IACUBPJLSA-N 2 0 350.423 -1.163 20 0 FAADRP [NH3+]C[C@@H]1CC(C(=O)N2CC[C@H]3[C@H](C2)NC(=O)N3C2CC[NH2+]CC2)=NO1 ZINC001118571499 792777519 /nfs/dbraw/zinc/77/75/19/792777519.db2.gz DOMUHMLZAIIYQU-UBHSHLNASA-N 2 0 350.423 -1.163 20 0 FAADRP [NH3+]C[C@@H]1CC(C(=O)N2CC[C@H]3[C@@H](C2)NC(=O)N3C2CC[NH2+]CC2)=NO1 ZINC001118571500 792777793 /nfs/dbraw/zinc/77/77/93/792777793.db2.gz DOMUHMLZAIIYQU-YUTCNCBUSA-N 2 0 350.423 -1.163 20 0 FAADRP C[C@@H]1[NH2+]CC[C@H]1NC(=O)C(=O)NC1CC[NH+](CCC(=O)N(C)C)CC1 ZINC001118920384 792796304 /nfs/dbraw/zinc/79/63/04/792796304.db2.gz XRZPECBSNHTTKI-GXTWGEPZSA-N 2 0 353.467 -1.088 20 0 FAADRP O=C(CCCC(=O)NCC[N@H+]1CC[C@H](O)C1)NCC[NH+]1CC[C@H](O)C1 ZINC001118963779 792800937 /nfs/dbraw/zinc/80/09/37/792800937.db2.gz XGBTZTCZQCFBDD-GJZGRUSLSA-N 2 0 356.467 -1.478 20 0 FAADRP C[C@H]([NH3+])CCNC(=O)C(=O)Nc1cnn(CC(=O)NCC[NH+](C)C)c1 ZINC001119010896 792802096 /nfs/dbraw/zinc/80/20/96/792802096.db2.gz SODXQXCNWWHWLI-NSHDSACASA-N 2 0 353.427 -1.647 20 0 FAADRP C[NH+](C)C[C@@H]1CN(C(=O)C(=O)N2CCS(=O)(=O)CC2)C[C@H]1C[NH+](C)C ZINC001119023863 792802758 /nfs/dbraw/zinc/80/27/58/792802758.db2.gz VYSIWEVSRFBVFZ-ZIAGYGMSSA-N 2 0 374.507 -1.559 20 0 FAADRP Cn1cc(C(=O)N2C[C@@H](C[NH+](C)C)[C@H](C[NH+](C)C)C2)c(=O)n(C)c1=O ZINC001119044725 792803272 /nfs/dbraw/zinc/80/32/72/792803272.db2.gz JRYYPIOQOLNEOB-CHWSQXEVSA-N 2 0 351.451 -1.105 20 0 FAADRP CN(C)C(=O)CCNC(=O)C(=O)N1C[C@@H](C[NH+](C)C)[C@H](C[NH+](C)C)C1 ZINC001119106136 792805671 /nfs/dbraw/zinc/80/56/71/792805671.db2.gz OVJHOPYAVHXSSX-ZIAGYGMSSA-N 2 0 355.483 -1.221 20 0 FAADRP C[C@H](NC(=O)C(=O)N1C[C@@H](C[NH+](C)C)[C@H](C[NH+](C)C)C1)C(=O)N(C)C ZINC001119144874 792806119 /nfs/dbraw/zinc/80/61/19/792806119.db2.gz ASNOSOZDMXIPJW-BFHYXJOUSA-N 2 0 355.483 -1.223 20 0 FAADRP CNC(=O)CCCNC(=O)C(=O)N1C[C@@H](C[NH+](C)C)[C@H](C[NH+](C)C)C1 ZINC001119169771 792806788 /nfs/dbraw/zinc/80/67/88/792806788.db2.gz YFENGAPKXZHMNI-ZIAGYGMSSA-N 2 0 355.483 -1.173 20 0 FAADRP CC(=O)NCC(=O)N1CCCN(CC(=O)NC2CC[NH+](C)CC2)CC1 ZINC001119260206 792808539 /nfs/dbraw/zinc/80/85/39/792808539.db2.gz ZWSAWJMHQJBBKS-UHFFFAOYSA-N 2 0 353.467 -1.133 20 0 FAADRP CC[N@H+](C)C[C@H](O)Cn1cc(CNC(=O)CN2CCC[NH2+]CC2)nn1 ZINC001119281152 792808007 /nfs/dbraw/zinc/80/80/07/792808007.db2.gz BOGQWFDEHWJKQU-HNNXBMFYSA-N 2 0 353.471 -1.498 20 0 FAADRP CC[N@H+](C)C[C@@H](O)Cn1cc(CNC(=O)CN2CCC[NH2+]CC2)nn1 ZINC001119281153 792808509 /nfs/dbraw/zinc/80/85/09/792808509.db2.gz BOGQWFDEHWJKQU-OAHLLOKOSA-N 2 0 353.471 -1.498 20 0 FAADRP C[C@@H]1C[C@@H]([NH3+])CN1C(=O)C(=O)NC1CC[NH+](CCC(=O)N(C)C)CC1 ZINC001119343395 792809001 /nfs/dbraw/zinc/80/90/01/792809001.db2.gz HCJZJAFWIPTGPR-CHWSQXEVSA-N 2 0 353.467 -1.007 20 0 FAADRP C[C@@H]1C[C@H]([NH3+])CN1C(=O)C(=O)NC1CC[NH+](CCC(=O)N(C)C)CC1 ZINC001119343396 792809157 /nfs/dbraw/zinc/80/91/57/792809157.db2.gz HCJZJAFWIPTGPR-OLZOCXBDSA-N 2 0 353.467 -1.007 20 0 FAADRP C[C@H]1C[C@@H]([NH3+])CN1C(=O)C(=O)NC1CC[NH+](CCC(=O)N(C)C)CC1 ZINC001119343398 792808973 /nfs/dbraw/zinc/80/89/73/792808973.db2.gz HCJZJAFWIPTGPR-QWHCGFSZSA-N 2 0 353.467 -1.007 20 0 FAADRP C[C@H]1C[C@H]([NH3+])CN1C(=O)C(=O)NC1CC[NH+](CCC(=O)N(C)C)CC1 ZINC001119343399 792809290 /nfs/dbraw/zinc/80/92/90/792809290.db2.gz HCJZJAFWIPTGPR-STQMWFEESA-N 2 0 353.467 -1.007 20 0 FAADRP NC(=O)C1([NH+]2CCCCC2)CCN(C(=O)C(=O)N2CC[NH2+]CC2)CC1 ZINC001119347812 792809384 /nfs/dbraw/zinc/80/93/84/792809384.db2.gz SOBHDDBPQORMRN-UHFFFAOYSA-N 2 0 351.451 -1.249 20 0 FAADRP C[NH+](C)CCN(CC[NH+](C)C)C(=O)NCc1nnc2n1CCNC2=O ZINC001119454226 792811057 /nfs/dbraw/zinc/81/10/57/792811057.db2.gz VNXNTOKSKAVOAJ-UHFFFAOYSA-N 2 0 352.443 -1.344 20 0 FAADRP C[NH+](C)CCOC1CCN(C(=O)C(=O)N2CCC[C@@]([NH3+])(CO)C2)CC1 ZINC001119703860 792812867 /nfs/dbraw/zinc/81/28/67/792812867.db2.gz WVLWNHKQCVIECW-KRWDZBQOSA-N 2 0 356.467 -1.132 20 0 FAADRP C[NH+](C)CCOC1CCN(C(=O)C(=O)N2CCC[C@]([NH3+])(CO)C2)CC1 ZINC001119703864 792812898 /nfs/dbraw/zinc/81/28/98/792812898.db2.gz WVLWNHKQCVIECW-QGZVFWFLSA-N 2 0 356.467 -1.132 20 0 FAADRP CN1CC[C@H]1CNC(=O)C(=O)N[C@@H]1CC[N@H+](CCN2CCOCC2)C1 ZINC001119724166 792813990 /nfs/dbraw/zinc/81/39/90/792813990.db2.gz SSNKCLFXHHZKGX-CABCVRRESA-N 2 0 353.467 -1.671 20 0 FAADRP CN1CC[C@H]1CNC(=O)C(=O)N[C@H]1CC[N@H+](CCN2CCOCC2)C1 ZINC001119724168 792813501 /nfs/dbraw/zinc/81/35/01/792813501.db2.gz SSNKCLFXHHZKGX-GJZGRUSLSA-N 2 0 353.467 -1.671 20 0 FAADRP CN1CC[C@@H]1CNC(=O)C(=O)N[C@@H]1CC[N@H+](CCN2CCOCC2)C1 ZINC001119724169 792813679 /nfs/dbraw/zinc/81/36/79/792813679.db2.gz SSNKCLFXHHZKGX-HUUCEWRRSA-N 2 0 353.467 -1.671 20 0 FAADRP CN1CC[C@@H]1CNC(=O)C(=O)N[C@H]1CC[N@H+](CCN2CCOCC2)C1 ZINC001119724171 792814195 /nfs/dbraw/zinc/81/41/95/792814195.db2.gz SSNKCLFXHHZKGX-LSDHHAIUSA-N 2 0 353.467 -1.671 20 0 FAADRP C[NH+](C)CCN(CC[NH+](C)C)C(=O)C(=O)N1C[C@@H]2CS(=O)(=O)C[C@@H]2C1 ZINC001120331997 792819062 /nfs/dbraw/zinc/81/90/62/792819062.db2.gz AJNATBRLWWARQT-OKILXGFUSA-N 2 0 374.507 -1.559 20 0 FAADRP C[C@@H](CNC(=O)C(=O)N1CCNCC[NH2+]CC1)C[NH+]1CCN(C)CC1 ZINC001120429409 792823096 /nfs/dbraw/zinc/82/30/96/792823096.db2.gz SGTYRWKYSQYGJZ-HNNXBMFYSA-N 2 0 354.499 -1.993 20 0 FAADRP C[C@H](CNC(=O)C(=O)N1CCNCC[NH2+]CC1)C[NH+]1CCN(C)CC1 ZINC001120429410 792823325 /nfs/dbraw/zinc/82/33/25/792823325.db2.gz SGTYRWKYSQYGJZ-OAHLLOKOSA-N 2 0 354.499 -1.993 20 0 FAADRP [NH3+][C@H]1CCCN(C(=O)C(=O)N[C@H]2CC[N@H+](CCN3CCOCC3)C2)C1 ZINC001120515892 792825206 /nfs/dbraw/zinc/82/52/06/792825206.db2.gz WCLUUCXSVVMIBF-GJZGRUSLSA-N 2 0 353.467 -1.541 20 0 FAADRP [NH3+][C@H]1CCCN(C(=O)C(=O)N[C@@H]2CC[N@H+](CCN3CCOCC3)C2)C1 ZINC001120515893 792824587 /nfs/dbraw/zinc/82/45/87/792824587.db2.gz WCLUUCXSVVMIBF-LSDHHAIUSA-N 2 0 353.467 -1.541 20 0 FAADRP COCC[NH+]1CCC(NC(=O)C(=O)NCCN2CCC([NH3+])CC2)CC1 ZINC001120518045 792825084 /nfs/dbraw/zinc/82/50/84/792825084.db2.gz ZBKOBAZGAPKQGO-UHFFFAOYSA-N 2 0 355.483 -1.247 20 0 FAADRP CC[NH+]1CCN([C@@H](C)CNC(=O)[C@]23C[NH2+]C[C@H]2CS(=O)(=O)C3)CC1 ZINC001121928840 792827555 /nfs/dbraw/zinc/82/75/55/792827555.db2.gz VDDFLUCOTNOHMH-DZKIICNBSA-N 2 0 358.508 -1.237 20 0 FAADRP CC[NH+]1CCN([C@H](C)CNC(=O)[C@]23C[NH2+]C[C@H]2CS(=O)(=O)C3)CC1 ZINC001121928842 792827242 /nfs/dbraw/zinc/82/72/42/792827242.db2.gz VDDFLUCOTNOHMH-YCPHGPKFSA-N 2 0 358.508 -1.237 20 0 FAADRP CN(CCCN1CC[NH+](C)CC1)C(=O)[C@]12C[NH2+]C[C@H]1CS(=O)(=O)C2 ZINC001121952967 792827770 /nfs/dbraw/zinc/82/77/70/792827770.db2.gz OJFSPKWFGUGUJM-HOCLYGCPSA-N 2 0 358.508 -1.284 20 0 FAADRP O=C(N1CC[NH2+]CC1)N1CCN(C(=O)[C@]23C[NH2+]C[C@H]2CCOC3)CC1 ZINC001122088132 792828465 /nfs/dbraw/zinc/82/84/65/792828465.db2.gz SKOLTMKAVXORFC-PBHICJAKSA-N 2 0 351.451 -1.218 20 0 FAADRP O=C([C@@H]1C[NH2+]CCO1)N1CCNCCN(C(=O)[C@@H]2C[NH2+]CCO2)CC1 ZINC001122180157 792828572 /nfs/dbraw/zinc/82/85/72/792828572.db2.gz OMJRTMWHRTVLLH-KBPBESRZSA-N 2 0 355.439 -2.776 20 0 FAADRP O=C([C@H]1C[NH2+]CCO1)N1CCNCCN(C(=O)[C@@H]2C[NH2+]CCO2)CC1 ZINC001122180158 792828371 /nfs/dbraw/zinc/82/83/71/792828371.db2.gz OMJRTMWHRTVLLH-OKILXGFUSA-N 2 0 355.439 -2.776 20 0 FAADRP O=C([C@H]1C[NH2+]CCO1)N1CCNCCN(C(=O)[C@H]2C[NH2+]CCO2)CC1 ZINC001122180159 792828668 /nfs/dbraw/zinc/82/86/68/792828668.db2.gz OMJRTMWHRTVLLH-ZIAGYGMSSA-N 2 0 355.439 -2.776 20 0 FAADRP C[NH+]1CCC([C@@H]2OCC[C@H]2C(=O)NCC[NH2+]CC(=O)NC(N)=O)CC1 ZINC001127570652 790476776 /nfs/dbraw/zinc/47/67/76/790476776.db2.gz ANTSAIRXZSXXSP-OCCSQVGLSA-N 2 0 355.439 -1.366 20 0 FAADRP CC[C@@H]1[C@@H](C(=O)NCC[NH2+]C[C@@H](O)CN2C(=O)CCC2=O)CC[N@@H+]1C ZINC001127701254 790489016 /nfs/dbraw/zinc/48/90/16/790489016.db2.gz LVTGGLGEVFDOMD-HZSPNIEDSA-N 2 0 354.451 -1.068 20 0 FAADRP CC[C@@H]1[C@@H](C(=O)NCC[NH2+]C[C@H](O)CN2C(=O)CCC2=O)CC[N@@H+]1C ZINC001127701255 790489066 /nfs/dbraw/zinc/48/90/66/790489066.db2.gz LVTGGLGEVFDOMD-MELADBBJSA-N 2 0 354.451 -1.068 20 0 FAADRP CCOCCN1C[C@@H](NC(=O)[C@@H]2CN(C)CCO2)[C@@H](n2ccnn2)C1 ZINC001128851263 790557534 /nfs/dbraw/zinc/55/75/34/790557534.db2.gz FPPYTWBQJCWBEQ-ILXRZTDVSA-N 2 0 352.439 -1.013 20 0 FAADRP CCOCCN1C[C@@H](NC(=O)[C@H]2CN(C)CCO2)[C@@H](n2ccnn2)C1 ZINC001128851264 790557217 /nfs/dbraw/zinc/55/72/17/790557217.db2.gz FPPYTWBQJCWBEQ-QLFBSQMISA-N 2 0 352.439 -1.013 20 0 FAADRP COCCC[N@@H+]1C[C@@H](NC(=O)[C@@H]2CN(C)CCO2)[C@@H](n2ccnn2)C1 ZINC001128851435 790557339 /nfs/dbraw/zinc/55/73/39/790557339.db2.gz MYRSTRYRKNHJPN-ILXRZTDVSA-N 2 0 352.439 -1.013 20 0 FAADRP COCCC[N@@H+]1C[C@@H](NC(=O)[C@H]2CN(C)CCO2)[C@@H](n2ccnn2)C1 ZINC001128851436 790557269 /nfs/dbraw/zinc/55/72/69/790557269.db2.gz MYRSTRYRKNHJPN-QLFBSQMISA-N 2 0 352.439 -1.013 20 0 FAADRP COC[C@H](O)C[N@@H+]1C[C@@H](NC(=O)CCC[NH+](C)C)[C@@H](n2ccnn2)C1 ZINC001129205645 790569971 /nfs/dbraw/zinc/56/99/71/790569971.db2.gz ZOIODHDPQGWKFT-KFWWJZLASA-N 2 0 354.455 -1.031 20 0 FAADRP COC[C@@H](O)C[N@@H+]1C[C@@H](NC(=O)CCC[NH+](C)C)[C@@H](n2ccnn2)C1 ZINC001129205646 790570140 /nfs/dbraw/zinc/57/01/40/790570140.db2.gz ZOIODHDPQGWKFT-ZNMIVQPWSA-N 2 0 354.455 -1.031 20 0 FAADRP CC[C@@H](C(=O)N[C@@H]1CN(CCOCCO)C[C@@H]1n1ccnn1)[NH+](C)C ZINC001129271827 790572095 /nfs/dbraw/zinc/57/20/95/790572095.db2.gz QTIUGLRSYIHZNP-ILXRZTDVSA-N 2 0 354.455 -1.031 20 0 FAADRP CC[C@@H](C(=O)N[C@@H]1CN(C[C@@H](O)COC)C[C@@H]1n1ccnn1)[NH+](C)C ZINC001129272136 790572065 /nfs/dbraw/zinc/57/20/65/790572065.db2.gz YJNZZYRXSHDTFD-KBXIAJHMSA-N 2 0 354.455 -1.033 20 0 FAADRP CC[C@@H](C(=O)N[C@@H]1CN(C[C@H](O)COC)C[C@@H]1n1ccnn1)[NH+](C)C ZINC001129272140 790572241 /nfs/dbraw/zinc/57/22/41/790572241.db2.gz YJNZZYRXSHDTFD-XGUBFFRZSA-N 2 0 354.455 -1.033 20 0 FAADRP CC[N@H+](C)CCC(=O)N[C@@H]1C[NH+](C[C@@H](O)COC)C[C@@H]1n1ccnn1 ZINC001129370404 790706101 /nfs/dbraw/zinc/70/61/01/790706101.db2.gz RTOOCLIEEYOBOR-KFWWJZLASA-N 2 0 354.455 -1.031 20 0 FAADRP CC[N@H+](C)CCC(=O)N[C@@H]1C[NH+](C[C@H](O)COC)C[C@@H]1n1ccnn1 ZINC001129370405 790706483 /nfs/dbraw/zinc/70/64/83/790706483.db2.gz RTOOCLIEEYOBOR-ZNMIVQPWSA-N 2 0 354.455 -1.031 20 0 FAADRP C[N@@H+]1CCC[C@H]1C(=O)N1C[C@@H]([NH2+]CCOCCO)[C@@H](n2ccnn2)C1 ZINC001129685031 790768855 /nfs/dbraw/zinc/76/88/55/790768855.db2.gz LXMLHUJLWCRENV-ILXRZTDVSA-N 2 0 352.439 -1.277 20 0 FAADRP C[N@@H+]1CCC[C@@H]1C(=O)N1C[C@@H]([NH2+]CCOCCO)[C@@H](n2ccnn2)C1 ZINC001129685037 790770510 /nfs/dbraw/zinc/77/05/10/790770510.db2.gz LXMLHUJLWCRENV-KFWWJZLASA-N 2 0 352.439 -1.277 20 0 FAADRP CC[NH+](CC)C[C@@H](F)C(=O)N1C[C@@H]([NH2+]CC(N)=O)[C@@H](n2ccnn2)C1 ZINC001129878912 790777354 /nfs/dbraw/zinc/77/73/54/790777354.db2.gz KRTBLMZDQJBVDL-UPJWGTAASA-N 2 0 355.418 -1.215 20 0 FAADRP CC[NH+](CC)C[C@H](F)C(=O)N1C[C@@H]([NH2+]CC(N)=O)[C@@H](n2ccnn2)C1 ZINC001129878913 790777332 /nfs/dbraw/zinc/77/73/32/790777332.db2.gz KRTBLMZDQJBVDL-XQQFMLRXSA-N 2 0 355.418 -1.215 20 0 FAADRP CNC(=O)C[NH2+][C@@H]1CN(C(=O)[C@H](C(C)C)[NH+](C)C)C[C@@H]1n1ccnn1 ZINC001129899950 790780342 /nfs/dbraw/zinc/78/03/42/790780342.db2.gz TTXCKTRDJQHIPF-IPYPFGDCSA-N 2 0 351.455 -1.048 20 0 FAADRP CC[C@H](C(=O)N1C[C@@H]([NH2+]CCOCCO)[C@@H](n2ccnn2)C1)[NH+](C)C ZINC001129910308 790779326 /nfs/dbraw/zinc/77/93/26/790779326.db2.gz NBWIMCXBZPDWBC-KFWWJZLASA-N 2 0 354.455 -1.031 20 0 FAADRP CC[C@H](C(=O)N1C[C@@H]([NH2+]C[C@@H](O)COC)[C@@H](n2ccnn2)C1)[NH+](C)C ZINC001129910355 790779242 /nfs/dbraw/zinc/77/92/42/790779242.db2.gz PIBFLMLWVTXHFG-TUVASFSCSA-N 2 0 354.455 -1.033 20 0 FAADRP CC[C@H](C(=O)N1C[C@@H]([NH2+]C[C@H](O)COC)[C@@H](n2ccnn2)C1)[NH+](C)C ZINC001129910356 790779588 /nfs/dbraw/zinc/77/95/88/790779588.db2.gz PIBFLMLWVTXHFG-YJNKXOJESA-N 2 0 354.455 -1.033 20 0 FAADRP COC[C@H](O)C[NH2+][C@@H]1CN(C(=O)[C@H]2CCC[N@@H+]2C)C[C@@H]1n1ccnn1 ZINC001129959195 790781905 /nfs/dbraw/zinc/78/19/05/790781905.db2.gz MDFNIDQDNFOXAH-TUVASFSCSA-N 2 0 352.439 -1.279 20 0 FAADRP COC[C@@H](O)C[NH2+][C@@H]1CN(C(=O)[C@H]2CCC[N@@H+]2C)C[C@@H]1n1ccnn1 ZINC001129959196 790782249 /nfs/dbraw/zinc/78/22/49/790782249.db2.gz MDFNIDQDNFOXAH-YJNKXOJESA-N 2 0 352.439 -1.279 20 0 FAADRP C[NH+](C)CCCC(=O)N1C[C@@H]([NH2+]CCOCCO)[C@@H](n2ccnn2)C1 ZINC001129982986 790783693 /nfs/dbraw/zinc/78/36/93/790783693.db2.gz LUSOZWLQAKVKDT-CABCVRRESA-N 2 0 354.455 -1.030 20 0 FAADRP COC[C@H](O)C[NH2+][C@@H]1CN(C(=O)CCC[NH+](C)C)C[C@@H]1n1ccnn1 ZINC001129985051 790786081 /nfs/dbraw/zinc/78/60/81/790786081.db2.gz NGPFSKQMZXQECX-KFWWJZLASA-N 2 0 354.455 -1.031 20 0 FAADRP COC[C@@H](O)C[NH2+][C@@H]1CN(C(=O)CCC[NH+](C)C)C[C@@H]1n1ccnn1 ZINC001129985052 790785224 /nfs/dbraw/zinc/78/52/24/790785224.db2.gz NGPFSKQMZXQECX-ZNMIVQPWSA-N 2 0 354.455 -1.031 20 0 FAADRP C[NH+](C)CCC(=O)N1C[C@@H]([NH2+]CCS(C)(=O)=O)[C@@H](n2ccnn2)C1 ZINC001129992197 790787107 /nfs/dbraw/zinc/78/71/07/790787107.db2.gz QEPZYTBDELQTGD-OLZOCXBDSA-N 2 0 358.468 -1.384 20 0 FAADRP C[NH+](C)CCC(=O)N1C[C@@H]([NH2+]CC(=O)NC(N)=O)[C@@H](n2ccnn2)C1 ZINC001129992347 790786903 /nfs/dbraw/zinc/78/69/03/790786903.db2.gz ZMEICOKXAANGAI-MNOVXSKESA-N 2 0 352.399 -2.234 20 0 FAADRP CNC(=O)C[NH2+][C@@H]1CN(C(=O)[C@@H](C(C)C)[NH+](C)C)C[C@@H]1n1ccnn1 ZINC001129994530 790785815 /nfs/dbraw/zinc/78/58/15/790785815.db2.gz TTXCKTRDJQHIPF-VNHYZAJKSA-N 2 0 351.455 -1.048 20 0 FAADRP CC[C@@H](C(=O)N1C[C@@H]([NH2+]CCOCCO)[C@@H](n2ccnn2)C1)[NH+](C)C ZINC001130007612 790786812 /nfs/dbraw/zinc/78/68/12/790786812.db2.gz NBWIMCXBZPDWBC-ILXRZTDVSA-N 2 0 354.455 -1.031 20 0 FAADRP CC[C@@H](C(=O)N1C[C@@H]([NH2+]C[C@@H](O)COC)[C@@H](n2ccnn2)C1)[NH+](C)C ZINC001130007659 790786949 /nfs/dbraw/zinc/78/69/49/790786949.db2.gz PIBFLMLWVTXHFG-KBXIAJHMSA-N 2 0 354.455 -1.033 20 0 FAADRP CC[C@@H](C(=O)N1C[C@@H]([NH2+]C[C@H](O)COC)[C@@H](n2ccnn2)C1)[NH+](C)C ZINC001130007660 790787246 /nfs/dbraw/zinc/78/72/46/790787246.db2.gz PIBFLMLWVTXHFG-XGUBFFRZSA-N 2 0 354.455 -1.033 20 0 FAADRP CC[NH+](CC)CC(=O)N1C[C@@H]([NH2+]CCOCCO)[C@@H](n2ccnn2)C1 ZINC001130047513 790789587 /nfs/dbraw/zinc/78/95/87/790789587.db2.gz FEQHALLLIIVUHE-CABCVRRESA-N 2 0 354.455 -1.030 20 0 FAADRP CC[NH+](CC)CC(=O)N1C[C@@H]([NH2+]C[C@@H](O)COC)[C@@H](n2ccnn2)C1 ZINC001130047705 790789074 /nfs/dbraw/zinc/78/90/74/790789074.db2.gz OOBCTEFGYGNCDL-KFWWJZLASA-N 2 0 354.455 -1.031 20 0 FAADRP CC[NH+](CC)CC(=O)N1C[C@@H]([NH2+]C[C@H](O)COC)[C@@H](n2ccnn2)C1 ZINC001130047706 790789827 /nfs/dbraw/zinc/78/98/27/790789827.db2.gz OOBCTEFGYGNCDL-ZNMIVQPWSA-N 2 0 354.455 -1.031 20 0 FAADRP CC[N@H+](C)CCC(=O)N1C[C@@H]([NH2+]CCOCCO)[C@@H](n2ccnn2)C1 ZINC001130074857 790790716 /nfs/dbraw/zinc/79/07/16/790790716.db2.gz IDKPGIWXMPSVRK-CABCVRRESA-N 2 0 354.455 -1.030 20 0 FAADRP CC[N@H+](C)CCC(=O)N1C[C@@H]([NH2+]C[C@@H](O)COC)[C@@H](n2ccnn2)C1 ZINC001130081574 790790488 /nfs/dbraw/zinc/79/04/88/790790488.db2.gz WKNFFGXKXGCSOB-KFWWJZLASA-N 2 0 354.455 -1.031 20 0 FAADRP CC[N@H+](C)CCC(=O)N1C[C@@H]([NH2+]C[C@H](O)COC)[C@@H](n2ccnn2)C1 ZINC001130081575 790790229 /nfs/dbraw/zinc/79/02/29/790790229.db2.gz WKNFFGXKXGCSOB-ZNMIVQPWSA-N 2 0 354.455 -1.031 20 0 FAADRP CNC(=O)C[NH2+][C@@H]1CN(C(=O)COCC[NH+](C)C)C[C@@H]1n1ccnn1 ZINC001130085844 790790962 /nfs/dbraw/zinc/79/09/62/790790962.db2.gz ALGXPAMVTRFYNU-OLZOCXBDSA-N 2 0 353.427 -2.056 20 0 FAADRP C[C@@H]([NH2+][C@@H]1CN(C(=O)COCC[NH+](C)C)C[C@@H]1n1ccnn1)C(N)=O ZINC001130086360 790791074 /nfs/dbraw/zinc/79/10/74/790791074.db2.gz XQEDEDOVQZNMGI-UPJWGTAASA-N 2 0 353.427 -1.928 20 0 FAADRP C[C@H]([NH2+][C@@H]1CN(C(=O)COCC[NH+](C)C)C[C@@H]1n1ccnn1)C(N)=O ZINC001130086361 790790618 /nfs/dbraw/zinc/79/06/18/790790618.db2.gz XQEDEDOVQZNMGI-XQQFMLRXSA-N 2 0 353.427 -1.928 20 0 FAADRP CCC[N@H+](C)CC(=O)N1C[C@@H]([NH2+]C[C@@H](O)COC)[C@@H](n2ccnn2)C1 ZINC001130107185 790792029 /nfs/dbraw/zinc/79/20/29/790792029.db2.gz IEJIALJQDTYMFE-KFWWJZLASA-N 2 0 354.455 -1.031 20 0 FAADRP CCC[N@H+](C)CC(=O)N1C[C@@H]([NH2+]C[C@H](O)COC)[C@@H](n2ccnn2)C1 ZINC001130107186 790792255 /nfs/dbraw/zinc/79/22/55/790792255.db2.gz IEJIALJQDTYMFE-ZNMIVQPWSA-N 2 0 354.455 -1.031 20 0 FAADRP CCC[N@H+](C)CC(=O)N1C[C@@H]([NH2+]CCOCCO)[C@@H](n2ccnn2)C1 ZINC001130107684 790791600 /nfs/dbraw/zinc/79/16/00/790791600.db2.gz VNPOPQYCEPCQGF-CABCVRRESA-N 2 0 354.455 -1.030 20 0 FAADRP C[N@@H+]1CC[C@@H](C(=O)N2C[C@@H]([NH2+]CCS(C)(=O)=O)[C@@H](n3ccnn3)C2)C1 ZINC001130123400 790792866 /nfs/dbraw/zinc/79/28/66/790792866.db2.gz PTGBNUNBJOKMRJ-MCIONIFRSA-N 2 0 370.479 -1.384 20 0 FAADRP C[N@@H+]1CC[C@H](C(=O)N2C[C@@H]([NH2+]CCS(C)(=O)=O)[C@@H](n3ccnn3)C2)C1 ZINC001130123401 790792609 /nfs/dbraw/zinc/79/26/09/790792609.db2.gz PTGBNUNBJOKMRJ-MJBXVCDLSA-N 2 0 370.479 -1.384 20 0 FAADRP C[N@@H+]1CC[C@@H](C(=O)N2C[C@@H]([NH2+]CCOCCO)[C@@H](n3ccnn3)C2)C1 ZINC001130123627 790793212 /nfs/dbraw/zinc/79/32/12/790793212.db2.gz WNDJXKJMXFCESP-KFWWJZLASA-N 2 0 352.439 -1.420 20 0 FAADRP C[N@@H+]1CC[C@H](C(=O)N2C[C@@H]([NH2+]CCOCCO)[C@@H](n3ccnn3)C2)C1 ZINC001130123628 790792972 /nfs/dbraw/zinc/79/29/72/790792972.db2.gz WNDJXKJMXFCESP-ZNMIVQPWSA-N 2 0 352.439 -1.420 20 0 FAADRP O=C(C[NH+]1CCCC1)N1C[C@@H]([NH2+]CCOCCO)[C@@H](n2ccnn2)C1 ZINC001130125242 790792196 /nfs/dbraw/zinc/79/21/96/790792196.db2.gz DGOZUYPWVNDFEX-CABCVRRESA-N 2 0 352.439 -1.276 20 0 FAADRP COC[C@H](O)C[NH2+][C@@H]1CN(C(=O)C[NH+]2CCCC2)C[C@@H]1n1ccnn1 ZINC001130125658 790791675 /nfs/dbraw/zinc/79/16/75/790791675.db2.gz ZERVCWFZZTZWEZ-KFWWJZLASA-N 2 0 352.439 -1.277 20 0 FAADRP COC[C@@H](O)C[NH2+][C@@H]1CN(C(=O)C[NH+]2CCCC2)C[C@@H]1n1ccnn1 ZINC001130125659 790792822 /nfs/dbraw/zinc/79/28/22/790792822.db2.gz ZERVCWFZZTZWEZ-ZNMIVQPWSA-N 2 0 352.439 -1.277 20 0 FAADRP COC[C@H](O)C[NH2+][C@@H]1CN(C(=O)C[N@H+](C)C(C)C)C[C@@H]1n1ccnn1 ZINC001130137143 790794340 /nfs/dbraw/zinc/79/43/40/790794340.db2.gz LKWRYSYHIXUIGP-KFWWJZLASA-N 2 0 354.455 -1.033 20 0 FAADRP COC[C@@H](O)C[NH2+][C@@H]1CN(C(=O)C[N@H+](C)C(C)C)C[C@@H]1n1ccnn1 ZINC001130137144 790794301 /nfs/dbraw/zinc/79/43/01/790794301.db2.gz LKWRYSYHIXUIGP-ZNMIVQPWSA-N 2 0 354.455 -1.033 20 0 FAADRP CC(C)[N@H+](C)CC(=O)N1C[C@@H]([NH2+]CCOCCO)[C@@H](n2ccnn2)C1 ZINC001130137422 790795606 /nfs/dbraw/zinc/79/56/06/790795606.db2.gz YOKJKJLYNJDKHU-CABCVRRESA-N 2 0 354.455 -1.031 20 0 FAADRP C[NH+](C)CCC(=O)NCc1nc([C@H]2CCO[C@H]2C[NH2+]CC(N)=O)n[nH]1 ZINC001130234757 790803472 /nfs/dbraw/zinc/80/34/72/790803472.db2.gz JWAXSLDUKPQVTI-QWRGUYRKSA-N 2 0 353.427 -1.680 20 0 FAADRP C[N@@H+]1CC[C@@H](C(=O)NCc2nnc([C@H]3CCO[C@H]3C[NH2+]CCO)[nH]2)C1 ZINC001130249338 790805129 /nfs/dbraw/zinc/80/51/29/790805129.db2.gz YNBSPPRQBOIPAJ-AGIUHOORSA-N 2 0 352.439 -1.173 20 0 FAADRP C[N@@H+]1CC[C@H](C(=O)NCc2nnc([C@H]3CCO[C@H]3C[NH2+]CCO)[nH]2)C1 ZINC001130249339 790805552 /nfs/dbraw/zinc/80/55/52/790805552.db2.gz YNBSPPRQBOIPAJ-AVGNSLFASA-N 2 0 352.439 -1.173 20 0 FAADRP Cn1cnc([C@@H]2CN(C(=O)COCC[NH+](C)C)C[C@H]2[NH2+]CC(N)=O)c1 ZINC001130712780 790812993 /nfs/dbraw/zinc/81/29/93/790812993.db2.gz LKEISWVCCCJTIH-GXTWGEPZSA-N 2 0 352.439 -1.632 20 0 FAADRP Cn1cncc1[C@@H]1CN(C(=O)COCC[NH+](C)C)C[C@H]1[NH2+]CC(N)=O ZINC001131107887 790822807 /nfs/dbraw/zinc/82/28/07/790822807.db2.gz FDMWZHRREJWROF-CHWSQXEVSA-N 2 0 352.439 -1.632 20 0 FAADRP Cn1c2ncn(CC(=O)N(CCCC[NH3+])C(N)=[NH2+])c2c(=O)n(C)c1=O ZINC001142391003 792846879 /nfs/dbraw/zinc/84/68/79/792846879.db2.gz CHXAFSPDKTZKHW-UHFFFAOYSA-N 2 0 350.383 -2.105 20 0 FAADRP C[NH+](C)[C@H](O)[C@H]1CC[C@H]([NH3+])[C@@H](N(C(=O)C(N)=O)[C@H](O)OC(C)(C)C)C1 ZINC001142942599 792848850 /nfs/dbraw/zinc/84/88/50/792848850.db2.gz VFYKEUDRTRIECG-AQUXLQGKSA-N 2 0 360.455 -1.233 20 0 FAADRP C[NH+](C)[C@@H](O)[C@H]1CC[C@H]([NH3+])[C@@H](N(C(=O)C(N)=O)[C@H](O)OC(C)(C)C)C1 ZINC001142942603 792849453 /nfs/dbraw/zinc/84/94/53/792849453.db2.gz VFYKEUDRTRIECG-MAWRTODSSA-N 2 0 360.455 -1.233 20 0 FAADRP C[NH+](C)[C@H](O)[C@H]1CC[C@H]([NH3+])[C@@H](N(C(=O)C(N)=O)[C@@H](O)OC(C)(C)C)C1 ZINC001142942606 792849240 /nfs/dbraw/zinc/84/92/40/792849240.db2.gz VFYKEUDRTRIECG-QGJZQDQRSA-N 2 0 360.455 -1.233 20 0 FAADRP C[NH+](C)[C@@H](O)[C@H]1CC[C@H]([NH3+])[C@@H](N(C(=O)C(N)=O)[C@@H](O)OC(C)(C)C)C1 ZINC001142942609 792849430 /nfs/dbraw/zinc/84/94/30/792849430.db2.gz VFYKEUDRTRIECG-SFUXALCOSA-N 2 0 360.455 -1.233 20 0 FAADRP CN(CC(=O)N1CCc2onc(C(=O)NCC[NH+](C)C)c2C1)C(N)=[NH2+] ZINC001144130742 790865752 /nfs/dbraw/zinc/86/57/52/790865752.db2.gz PNYMZFKOBJHOLV-UHFFFAOYSA-N 2 0 351.411 -1.324 20 0 FAADRP CN(CC(=O)NCc1cc(N2CCS(=O)(=O)CC2)cc[nH+]1)C(N)=[NH2+] ZINC001144142846 790864753 /nfs/dbraw/zinc/86/47/53/790864753.db2.gz PAXVTLJOKPCIDE-UHFFFAOYSA-N 2 0 354.436 -1.242 20 0 FAADRP C[NH+](C)CCCN(CCC[NH+](C)C)C(=O)C(=O)[C@H](O)[C@H](O)[C@@H](O)CO ZINC001144900938 790890754 /nfs/dbraw/zinc/89/07/54/790890754.db2.gz WYMGXKOFPCXYOG-BFHYXJOUSA-N 2 0 363.455 -2.638 20 0 FAADRP C[NH+](C)CCCN(CCC[NH+](C)C)C(=O)C(=O)[C@H](O)[C@@H](O)[C@H](O)CO ZINC001144900939 790890156 /nfs/dbraw/zinc/89/01/56/790890156.db2.gz WYMGXKOFPCXYOG-HZSPNIEDSA-N 2 0 363.455 -2.638 20 0 FAADRP C[NH+](C)CCCN(CCC[NH+](C)C)C(=O)C(=O)[C@H](O)[C@@H](O)[C@@H](O)CO ZINC001144900940 790890832 /nfs/dbraw/zinc/89/08/32/790890832.db2.gz WYMGXKOFPCXYOG-MELADBBJSA-N 2 0 363.455 -2.638 20 0 FAADRP C[NH+](C)CCCN(CCC[NH+](C)C)C(=O)C(=O)[C@H](O)[C@H](O)[C@H](O)CO ZINC001144900941 790890855 /nfs/dbraw/zinc/89/08/55/790890855.db2.gz WYMGXKOFPCXYOG-MGPQQGTHSA-N 2 0 363.455 -2.638 20 0 FAADRP CS(=O)(=O)c1nc2c(c(N(CC[NH3+])S(C)(=O)=O)n1)CC[NH2+]CC2 ZINC001154764580 792865065 /nfs/dbraw/zinc/86/50/65/792865065.db2.gz BRHLKULUHUVMGY-UHFFFAOYSA-N 2 0 363.465 -1.707 20 0 FAADRP CS(=O)(=O)c1nc2c(c(N[C@@H]3C[NH2+][C@@H]4COC[C@H]34)n1)CC[NH2+]CC2 ZINC001155502311 792867148 /nfs/dbraw/zinc/86/71/48/792867148.db2.gz RKTKZBWJDBBQMF-RAIGVLPGSA-N 2 0 353.448 -1.033 20 0 FAADRP CS(=O)(=O)c1nc2c(c(N[C@@]34CC[NH2+][C@@H]3CC(=O)N4)n1)CC[NH2+]CC2 ZINC001155571505 792868106 /nfs/dbraw/zinc/86/81/06/792868106.db2.gz UKQOCPFXDPKLDQ-ABAIWWIYSA-N 2 0 366.447 -1.442 20 0 FAADRP CS(=O)(=O)c1nc2c(c(N[C@]34CC[NH2+][C@@H]3CC(=O)N4)n1)CC[NH2+]CC2 ZINC001155571506 792868646 /nfs/dbraw/zinc/86/86/46/792868646.db2.gz UKQOCPFXDPKLDQ-IAQYHMDHSA-N 2 0 366.447 -1.442 20 0 FAADRP CS(=O)(=O)c1nc2c(c(N[C@@]34CC[NH2+][C@H]3CC(=O)N4)n1)CC[NH2+]CC2 ZINC001155571707 792868519 /nfs/dbraw/zinc/86/85/19/792868519.db2.gz UKQOCPFXDPKLDQ-NHYWBVRUSA-N 2 0 366.447 -1.442 20 0 FAADRP CS(=O)(=O)c1nc2c(c(N[C@]34CC[NH2+][C@H]3CC(=O)N4)n1)CC[NH2+]CC2 ZINC001155571708 792868338 /nfs/dbraw/zinc/86/83/38/792868338.db2.gz UKQOCPFXDPKLDQ-XHDPSFHLSA-N 2 0 366.447 -1.442 20 0 FAADRP CN(c1nc(S(C)(=O)=O)nc2c1CC[NH2+]CC2)S(=O)(=O)CC[NH3+] ZINC001156231827 790670465 /nfs/dbraw/zinc/67/04/65/790670465.db2.gz OEYCMJSVKJWMIK-UHFFFAOYSA-N 2 0 363.465 -1.707 20 0 FAADRP CCOC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]([NH3+])CN1CCC([NH3+])CC1 ZINC001157304026 792873220 /nfs/dbraw/zinc/87/32/20/792873220.db2.gz RKGRQZPKYYAOTN-KBPBESRZSA-N 2 0 352.439 -1.250 20 0 FAADRP CCOC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H]([NH3+])CN1CCC([NH3+])CC1 ZINC001157304027 792873284 /nfs/dbraw/zinc/87/32/84/792873284.db2.gz RKGRQZPKYYAOTN-KGLIPLIRSA-N 2 0 352.439 -1.250 20 0 FAADRP NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H]([NH3+])CSCC[NH3+] ZINC001157304506 792873811 /nfs/dbraw/zinc/87/38/11/792873811.db2.gz ZGPRXLLWWSADSP-STQMWFEESA-N 2 0 367.475 -1.665 20 0 FAADRP CNC(=O)[C@H](CCCC[NH3+])NC(=O)[C@@H]1C[N@H+](C)CC2(CC[NH2+]CC2)O1 ZINC001157322905 792874738 /nfs/dbraw/zinc/87/47/38/792874738.db2.gz CRUBVYZJQZAXLX-KBPBESRZSA-N 3 0 355.483 -1.201 20 0 FAADRP CNC(=O)[C@H](CCCC[NH3+])NC(=O)[C@H]1C[N@H+](C)CC2(CC[NH2+]CC2)O1 ZINC001157322906 792874352 /nfs/dbraw/zinc/87/43/52/792874352.db2.gz CRUBVYZJQZAXLX-UONOGXRCSA-N 3 0 355.483 -1.201 20 0 FAADRP CNC(=O)[C@H](CCCC[NH3+])NC(=O)[C@H]1C[NH2+]CC12CCS(=O)(=O)CC2 ZINC001157323388 792874604 /nfs/dbraw/zinc/87/46/04/792874604.db2.gz PANRDCSHKSQMSF-OLZOCXBDSA-N 2 0 374.507 -1.239 20 0 FAADRP CNC(=O)[C@H](CCCC[NH3+])NC(=O)[C@@H]1C[NH2+]CC12CCS(=O)(=O)CC2 ZINC001157323398 792874517 /nfs/dbraw/zinc/87/45/17/792874517.db2.gz PANRDCSHKSQMSF-STQMWFEESA-N 2 0 374.507 -1.239 20 0 FAADRP CNC(=O)[C@H](CCCC[NH3+])NC(=O)[C@@H]1COC(C)(C)N1C(=O)[C@H](C)[NH3+] ZINC001157337892 792874633 /nfs/dbraw/zinc/87/46/33/792874633.db2.gz YCMIGXPYOQXFDE-SRVKXCTJSA-N 2 0 357.455 -1.343 20 0 FAADRP CNC(=O)[C@H](CCCC[NH3+])NC(=O)CNC(=O)[C@@H]([NH3+])COC(C)(C)C ZINC001157344084 792874696 /nfs/dbraw/zinc/87/46/96/792874696.db2.gz DNWYCPHEKKDUAU-RYUDHWBXSA-N 2 0 359.471 -1.395 20 0 FAADRP NC(=O)NCCC[C@@H]([NH3+])C(=O)N[C@@H](CCCC[NH3+])C(=O)N1CCCC1 ZINC001157368098 792874314 /nfs/dbraw/zinc/87/43/14/792874314.db2.gz CKHOMZDGAIVHJB-OLZOCXBDSA-N 2 0 356.471 -1.002 20 0 FAADRP NC(=O)NCCC[C@H]([NH3+])C(=O)N[C@@H](CCCC[NH3+])C(=O)N1CCCC1 ZINC001157368099 792874257 /nfs/dbraw/zinc/87/42/57/792874257.db2.gz CKHOMZDGAIVHJB-STQMWFEESA-N 2 0 356.471 -1.002 20 0 FAADRP [NH3+]CCCC[C@H](NC(=O)[C@@H]1COC2(C[NH2+]C2)CN1)C(=O)N1CCCC1 ZINC001157370425 792874764 /nfs/dbraw/zinc/87/47/64/792874764.db2.gz AYLNJTFWFKHVJC-KBPBESRZSA-N 2 0 353.467 -1.447 20 0 FAADRP [NH3+]CCCC[C@H](NC(=O)[C@H]1COC2(C[NH2+]C2)CN1)C(=O)N1CCCC1 ZINC001157370426 792874049 /nfs/dbraw/zinc/87/40/49/792874049.db2.gz AYLNJTFWFKHVJC-UONOGXRCSA-N 2 0 353.467 -1.447 20 0 FAADRP [NH3+]CCCC[C@H](NC(=O)[C@H]1NC(=O)CC12C[NH2+]C2)C(=O)N1CCCC1 ZINC001157371729 792874617 /nfs/dbraw/zinc/87/46/17/792874617.db2.gz YIBSEUBPDCJLOI-GXTWGEPZSA-N 2 0 351.451 -1.299 20 0 FAADRP [NH3+]CCCC[C@H](NC(=O)[C@@H]1NC(=O)CC12C[NH2+]C2)C(=O)N1CCCC1 ZINC001157371731 792874627 /nfs/dbraw/zinc/87/46/27/792874627.db2.gz YIBSEUBPDCJLOI-JSGCOSHPSA-N 2 0 351.451 -1.299 20 0 FAADRP C[C@H](NC(=O)[C@@H]([NH3+])CO)C(=O)N[C@@H](CCCC[NH3+])C(=O)N1CCCC1 ZINC001157387209 792874593 /nfs/dbraw/zinc/87/45/93/792874593.db2.gz ZEYAUTFMYMIORU-AVGNSLFASA-N 2 0 357.455 -1.953 20 0 FAADRP C[C@@H]1O[C@@H](OCCNC(=O)[C@@H]([NH3+])CCCC[NH+](C)C)[C@@H](O)[C@H](O)[C@@H]1O ZINC001157421711 792874096 /nfs/dbraw/zinc/87/40/96/792874096.db2.gz AQYYZUOTZRCVLE-FCUGXXHSSA-N 2 0 363.455 -1.994 20 0 FAADRP CCOC(=O)CC1([NH3+])CCN(C(=O)CN(CC[NH3+])S(C)(=O)=O)CC1 ZINC001157448767 790751088 /nfs/dbraw/zinc/75/10/88/790751088.db2.gz JHAQXYOUKPUKOD-UHFFFAOYSA-N 2 0 364.468 -1.520 20 0 FAADRP [NH3+][C@H](CN1CCC([NH3+])CC1)C(=O)N1CCN(C(=O)[C@@H]2CCCO2)CC1 ZINC001157497664 792875730 /nfs/dbraw/zinc/87/57/30/792875730.db2.gz RHRHEMPRSVGBBT-CABCVRRESA-N 2 0 353.467 -1.413 20 0 FAADRP [NH3+][C@@H](CN1CCC([NH3+])CC1)C(=O)N1CCN(C(=O)[C@@H]2CCCO2)CC1 ZINC001157497665 792875294 /nfs/dbraw/zinc/87/52/94/792875294.db2.gz RHRHEMPRSVGBBT-GJZGRUSLSA-N 2 0 353.467 -1.413 20 0 FAADRP [NH3+][C@H](CN1CCC([NH3+])CC1)C(=O)N1CCN(C(=O)[C@H]2CCCO2)CC1 ZINC001157497666 792875050 /nfs/dbraw/zinc/87/50/50/792875050.db2.gz RHRHEMPRSVGBBT-HUUCEWRRSA-N 2 0 353.467 -1.413 20 0 FAADRP [NH3+][C@@H](CN1CCC([NH3+])CC1)C(=O)N1CCN(C(=O)[C@H]2CCCO2)CC1 ZINC001157497667 792875774 /nfs/dbraw/zinc/87/57/74/792875774.db2.gz RHRHEMPRSVGBBT-LSDHHAIUSA-N 2 0 353.467 -1.413 20 0 FAADRP CC(C)C[C@H](NC(=O)[C@@H]1CCC[NH2+]1)C(=O)NCC(=O)N1CC(C)([NH3+])C1 ZINC001157651641 792875345 /nfs/dbraw/zinc/87/53/45/792875345.db2.gz PNDQVTXAFCQSPM-STQMWFEESA-N 2 0 353.467 -1.055 20 0 FAADRP C[NH+](C)C1CN(C(=O)[C@H](CO)NC(=O)[C@@H]([NH3+])Cc2ccc(O)cc2)C1 ZINC001157689815 792876809 /nfs/dbraw/zinc/87/68/09/792876809.db2.gz ZTDDKRVIQXBVMX-GJZGRUSLSA-N 2 0 350.419 -1.489 20 0 FAADRP CN(C[C@@H]1C[NH2+]CCO1)C(=O)CNC(=O)CNC(=O)CNC(=O)C[NH3+] ZINC001157716968 790754933 /nfs/dbraw/zinc/75/49/33/790754933.db2.gz VJLAPIBAKPIYBP-JTQLQIEISA-N 2 0 358.399 -4.260 20 0 FAADRP CN(C[C@H]1C[NH2+]CCO1)C(=O)CNC(=O)CNC(=O)CNC(=O)C[NH3+] ZINC001157716969 790754416 /nfs/dbraw/zinc/75/44/16/790754416.db2.gz VJLAPIBAKPIYBP-SNVBAGLBSA-N 2 0 358.399 -4.260 20 0 FAADRP CN(C[C@H]1C[NH2+]CCO1)C(=O)[C@@H]([NH3+])CCCNC(=O)c1cnccn1 ZINC001157717192 792876901 /nfs/dbraw/zinc/87/69/01/792876901.db2.gz YDSNASUGOVOUCV-OLZOCXBDSA-N 2 0 350.423 -1.239 20 0 FAADRP CN(C[C@@H]1C[NH2+]CCO1)C(=O)[C@@H]([NH3+])CCCNC(=O)c1cnccn1 ZINC001157717193 792876562 /nfs/dbraw/zinc/87/65/62/792876562.db2.gz YDSNASUGOVOUCV-STQMWFEESA-N 2 0 350.423 -1.239 20 0 FAADRP C[C@H](NC(=O)[C@@H]1CCCN1C(=O)C[NH3+])C(=O)N(C)C[C@@H]1C[NH2+]CCO1 ZINC001157720585 792876790 /nfs/dbraw/zinc/87/67/90/792876790.db2.gz MEARIRHKUFSBEO-AVGNSLFASA-N 2 0 355.439 -2.112 20 0 FAADRP C[C@H](NC(=O)[C@@H]1CCCN1C(=O)C[NH3+])C(=O)N(C)C[C@H]1C[NH2+]CCO1 ZINC001157720586 792876745 /nfs/dbraw/zinc/87/67/45/792876745.db2.gz MEARIRHKUFSBEO-XQQFMLRXSA-N 2 0 355.439 -2.112 20 0 FAADRP CN(C[C@H]1C[NH2+]CCO1)C(=O)[C@@H]1CCCN1C(=O)[C@@H]([NH3+])CCCC[NH3+] ZINC001157720660 792876128 /nfs/dbraw/zinc/87/61/28/792876128.db2.gz NSEJKSZNJFEZFE-ILXRZTDVSA-N 3 0 355.483 -1.120 20 0 FAADRP CN(C[C@@H]1C[NH2+]CCO1)C(=O)[C@@H]1CCCN1C(=O)[C@@H]([NH3+])CCCC[NH3+] ZINC001157720661 792876590 /nfs/dbraw/zinc/87/65/90/792876590.db2.gz NSEJKSZNJFEZFE-KKUMJFAQSA-N 3 0 355.483 -1.120 20 0 FAADRP [NH3+]CCCC[C@H]([NH3+])C(=O)N1CCC[C@H]1C(=O)N1CC[C@@H](CO)[C@@H](O)C1 ZINC001157904791 792877540 /nfs/dbraw/zinc/87/75/40/792877540.db2.gz NTCDZWQPAMFOGU-AJNGGQMLSA-N 2 0 356.467 -1.365 20 0 FAADRP [NH3+]CCCC[C@H]([NH3+])C(=O)N1CCC[C@H]1C(=O)N1CC[C@H](CO)[C@H](O)C1 ZINC001157904792 792877354 /nfs/dbraw/zinc/87/73/54/792877354.db2.gz NTCDZWQPAMFOGU-CBBWQLFWSA-N 2 0 356.467 -1.365 20 0 FAADRP [NH3+]CCCC[C@H]([NH3+])C(=O)N1CCC[C@H]1C(=O)N1CC[C@H](CO)[C@@H](O)C1 ZINC001157904793 792877523 /nfs/dbraw/zinc/87/75/23/792877523.db2.gz NTCDZWQPAMFOGU-QPSCCSFWSA-N 2 0 356.467 -1.365 20 0 FAADRP [NH3+]CCCC[C@H]([NH3+])C(=O)N1CCC[C@H]1C(=O)N1CC[C@@H](CO)[C@H](O)C1 ZINC001157904794 792877379 /nfs/dbraw/zinc/87/73/79/792877379.db2.gz NTCDZWQPAMFOGU-ZQDZILKHSA-N 2 0 356.467 -1.365 20 0 FAADRP [NH3+]CCCC[C@H]([NH3+])C(=O)N1CCC[C@H]1C(=O)N1CC[C@H](O)[C@H](CO)C1 ZINC001157934749 792878485 /nfs/dbraw/zinc/87/84/85/792878485.db2.gz OKWHSSKNNACIRS-AJNGGQMLSA-N 2 0 356.467 -1.365 20 0 FAADRP [NH3+]CCCC[C@H]([NH3+])C(=O)N1CCC[C@H]1C(=O)N1CC[C@@H](O)[C@@H](CO)C1 ZINC001157934750 792878244 /nfs/dbraw/zinc/87/82/44/792878244.db2.gz OKWHSSKNNACIRS-CBBWQLFWSA-N 2 0 356.467 -1.365 20 0 FAADRP [NH3+]CCCC[C@H]([NH3+])C(=O)N1CCC[C@H]1C(=O)N1CC[C@H](O)[C@@H](CO)C1 ZINC001157934751 792878327 /nfs/dbraw/zinc/87/83/27/792878327.db2.gz OKWHSSKNNACIRS-QPSCCSFWSA-N 2 0 356.467 -1.365 20 0 FAADRP [NH3+]CCCC[C@H]([NH3+])C(=O)N1CCC[C@H]1C(=O)N1CC[C@@H](O)[C@H](CO)C1 ZINC001157934752 792878915 /nfs/dbraw/zinc/87/89/15/792878915.db2.gz OKWHSSKNNACIRS-ZQDZILKHSA-N 2 0 356.467 -1.365 20 0 FAADRP [NH3+][C@H](CN1CCC([NH3+])CC1)C(=O)N1CCN(C(=O)C(F)(F)F)CC1 ZINC001157981403 792878967 /nfs/dbraw/zinc/87/89/67/792878967.db2.gz DCWDMGQATCYNQU-LLVKDONJSA-N 2 0 351.373 -1.030 20 0 FAADRP [NH3+][C@@H](CN1CCC([NH3+])CC1)C(=O)N1CCN(C(=O)C(F)(F)F)CC1 ZINC001157981604 792878550 /nfs/dbraw/zinc/87/85/50/792878550.db2.gz DCWDMGQATCYNQU-NSHDSACASA-N 2 0 351.373 -1.030 20 0 FAADRP CCOC(=O)[C@@H]1CNCCN1C(=O)[C@@H]1C[N@H+](C)CC2(CC[NH2+]CC2)O1 ZINC001157998482 792879040 /nfs/dbraw/zinc/87/90/40/792879040.db2.gz GBZWHEOTNKDQIK-KBPBESRZSA-N 2 0 354.451 -1.197 20 0 FAADRP CCOC(=O)[C@H]1CNCCN1C(=O)[C@@H]1C[N@H+](C)CC2(CC[NH2+]CC2)O1 ZINC001157998483 792878435 /nfs/dbraw/zinc/87/84/35/792878435.db2.gz GBZWHEOTNKDQIK-KGLIPLIRSA-N 2 0 354.451 -1.197 20 0 FAADRP CCOC(=O)[C@@H]1CNCCN1C(=O)[C@H]1C[N@H+](C)CC2(CC[NH2+]CC2)O1 ZINC001157998484 792878937 /nfs/dbraw/zinc/87/89/37/792878937.db2.gz GBZWHEOTNKDQIK-UONOGXRCSA-N 2 0 354.451 -1.197 20 0 FAADRP CCOC(=O)[C@H]1CNCCN1C(=O)[C@H]1C[N@H+](C)CC2(CC[NH2+]CC2)O1 ZINC001157998485 792878882 /nfs/dbraw/zinc/87/88/82/792878882.db2.gz GBZWHEOTNKDQIK-ZIAGYGMSSA-N 2 0 354.451 -1.197 20 0 FAADRP C[C@H]([NH3+])C(=O)N[C@H](CCC(=O)N1CCOC2(CC[NH2+]CC2)C1)C(N)=O ZINC001158076539 792879316 /nfs/dbraw/zinc/87/93/16/792879316.db2.gz IRAFFFMUAOBSLT-NWDGAFQWSA-N 2 0 355.439 -1.935 20 0 FAADRP O=C([C@@H]1C[NH2+]CC12CCS(=O)(=O)CC2)N1CC(=O)NC[C@]12CC[NH2+]C2 ZINC001158091304 792879342 /nfs/dbraw/zinc/87/93/42/792879342.db2.gz ADHYJMNJJWBSRG-BLLLJJGKSA-N 2 0 370.475 -1.909 20 0 FAADRP O=C([C@@H]1C[NH2+]CC12CCS(=O)(=O)CC2)N1CC(=O)NC[C@@]12CC[NH2+]C2 ZINC001158091306 792879809 /nfs/dbraw/zinc/87/98/09/792879809.db2.gz ADHYJMNJJWBSRG-LRDDRELGSA-N 2 0 370.475 -1.909 20 0 FAADRP O=C([C@H]1C[NH2+]CC12CCS(=O)(=O)CC2)N1CC(=O)NC[C@]12CC[NH2+]C2 ZINC001158091308 792879708 /nfs/dbraw/zinc/87/97/08/792879708.db2.gz ADHYJMNJJWBSRG-MLGOLLRUSA-N 2 0 370.475 -1.909 20 0 FAADRP O=C([C@H]1C[NH2+]CC12CCS(=O)(=O)CC2)N1CC(=O)NC[C@@]12CC[NH2+]C2 ZINC001158091309 792879821 /nfs/dbraw/zinc/87/98/21/792879821.db2.gz ADHYJMNJJWBSRG-WBMJQRKESA-N 2 0 370.475 -1.909 20 0 FAADRP C[N@@H+]1C[C@@H](C(=O)N2CC(=O)NC[C@@]23CC[NH2+]C3)OC2(CC[NH2+]CC2)C1 ZINC001158093017 792879555 /nfs/dbraw/zinc/87/95/55/792879555.db2.gz QWMFNDRYCYATEF-BBRMVZONSA-N 3 0 351.451 -1.870 20 0 FAADRP C[N@@H+]1C[C@H](C(=O)N2CC(=O)NC[C@@]23CC[NH2+]C3)OC2(CC[NH2+]CC2)C1 ZINC001158093023 792880036 /nfs/dbraw/zinc/88/00/36/792880036.db2.gz QWMFNDRYCYATEF-CJNGLKHVSA-N 3 0 351.451 -1.870 20 0 FAADRP C[N@@H+]1C[C@H](C(=O)N2CC(=O)NC[C@]23CC[NH2+]C3)OC2(CC[NH2+]CC2)C1 ZINC001158093025 792879857 /nfs/dbraw/zinc/87/98/57/792879857.db2.gz QWMFNDRYCYATEF-CZUORRHYSA-N 3 0 351.451 -1.870 20 0 FAADRP C[N@@H+]1C[C@@H](C(=O)N2CC(=O)NC[C@]23CC[NH2+]C3)OC2(CC[NH2+]CC2)C1 ZINC001158093028 792879995 /nfs/dbraw/zinc/87/99/95/792879995.db2.gz QWMFNDRYCYATEF-XJKSGUPXSA-N 3 0 351.451 -1.870 20 0 FAADRP CC(C)(C)OC[C@H]([NH3+])C(=O)NCC(=O)N1CC(=O)NC[C@]12CC[NH2+]C2 ZINC001158100934 792880097 /nfs/dbraw/zinc/88/00/97/792880097.db2.gz CZHBZTHKLMZNGC-MEDUHNTESA-N 2 0 355.439 -2.065 20 0 FAADRP CC(C)(C)OC[C@H]([NH3+])C(=O)NCC(=O)N1CC(=O)NC[C@@]12CC[NH2+]C2 ZINC001158100935 792879592 /nfs/dbraw/zinc/87/95/92/792879592.db2.gz CZHBZTHKLMZNGC-ZBEGNZNMSA-N 2 0 355.439 -2.065 20 0 FAADRP O=C(c1csc(N2CC[NH2+]CC2)n1)N1CC(=O)NC[C@@]12CC[NH2+]C2 ZINC001158101666 792879539 /nfs/dbraw/zinc/87/95/39/792879539.db2.gz LENUXZRAXLHUOR-HNNXBMFYSA-N 2 0 350.448 -1.143 20 0 FAADRP O=C(c1csc(N2CC[NH2+]CC2)n1)N1CC(=O)NC[C@]12CC[NH2+]C2 ZINC001158101667 792879298 /nfs/dbraw/zinc/87/92/98/792879298.db2.gz LENUXZRAXLHUOR-OAHLLOKOSA-N 2 0 350.448 -1.143 20 0 FAADRP [NH3+][C@@H](C(=O)N1CC(=O)NC[C@]12CC[NH2+]C2)C1CCC2(CC1)OCCO2 ZINC001158102407 792879670 /nfs/dbraw/zinc/87/96/70/792879670.db2.gz ROPPSTJRYXCUEY-GDBMZVCRSA-N 2 0 352.435 -1.063 20 0 FAADRP [NH3+][C@H](C(=O)N1CC(=O)NC[C@]12CC[NH2+]C2)C1CCC2(CC1)OCCO2 ZINC001158102408 792879933 /nfs/dbraw/zinc/87/99/33/792879933.db2.gz ROPPSTJRYXCUEY-GOEBONIOSA-N 2 0 352.435 -1.063 20 0 FAADRP [NH3+][C@H](C(=O)N1CC(=O)NC[C@@]12CC[NH2+]C2)C1CCC2(CC1)OCCO2 ZINC001158102409 792879982 /nfs/dbraw/zinc/87/99/82/792879982.db2.gz ROPPSTJRYXCUEY-HOCLYGCPSA-N 2 0 352.435 -1.063 20 0 FAADRP [NH3+][C@@H](C(=O)N1CC(=O)NC[C@@]12CC[NH2+]C2)C1CCC2(CC1)OCCO2 ZINC001158102410 792879878 /nfs/dbraw/zinc/87/98/78/792879878.db2.gz ROPPSTJRYXCUEY-ZBFHGGJFSA-N 2 0 352.435 -1.063 20 0 FAADRP C[C@H]([NH3+])C(=O)N[C@H](CCC(=O)N1CC(=O)NC[C@]12CC[NH2+]C2)C(N)=O ZINC001158102532 792879958 /nfs/dbraw/zinc/87/99/58/792879958.db2.gz UCIXHZRGSFPHNG-FEUHOPSXSA-N 2 0 354.411 -3.226 20 0 FAADRP C[C@H]([NH3+])C(=O)N[C@H](CCC(=O)N1CC(=O)NC[C@@]12CC[NH2+]C2)C(N)=O ZINC001158102535 792879491 /nfs/dbraw/zinc/87/94/91/792879491.db2.gz UCIXHZRGSFPHNG-WMFXKJRFSA-N 2 0 354.411 -3.226 20 0 FAADRP C[C@H]([NH3+])C(=O)N1[C@H](C(=O)N2CC(=O)NC[C@@]23CC[NH2+]C3)COC1(C)C ZINC001158102875 792879911 /nfs/dbraw/zinc/87/99/11/792879911.db2.gz XCTAAMNLWWGRDP-MMPTUQATSA-N 2 0 353.423 -2.012 20 0 FAADRP C[C@H]([NH3+])C(=O)N1[C@H](C(=O)N2CC(=O)NC[C@]23CC[NH2+]C3)COC1(C)C ZINC001158102876 792879776 /nfs/dbraw/zinc/87/97/76/792879776.db2.gz XCTAAMNLWWGRDP-XMZIXOGTSA-N 2 0 353.423 -2.012 20 0 FAADRP O=C([C@H]1CCS(=O)(=O)C12C[NH2+]C2)N1CC2(C[NH2+]C2)[C@@]2(CCNC2=O)C1 ZINC001158118591 792879650 /nfs/dbraw/zinc/87/96/50/792879650.db2.gz BBTUPQWFBISBAB-ABAIWWIYSA-N 2 0 368.459 -2.299 20 0 FAADRP O=C([C@H]1CCS(=O)(=O)C12C[NH2+]C2)N1CC2(C[NH2+]C2)[C@]2(CCNC2=O)C1 ZINC001158118592 792879759 /nfs/dbraw/zinc/87/97/59/792879759.db2.gz BBTUPQWFBISBAB-IAQYHMDHSA-N 2 0 368.459 -2.299 20 0 FAADRP O=C([C@@H]1CCS(=O)(=O)C12C[NH2+]C2)N1CC2(C[NH2+]C2)[C@@]2(CCNC2=O)C1 ZINC001158118593 792880064 /nfs/dbraw/zinc/88/00/64/792880064.db2.gz BBTUPQWFBISBAB-NHYWBVRUSA-N 2 0 368.459 -2.299 20 0 FAADRP O=C([C@@H]1CCS(=O)(=O)C12C[NH2+]C2)N1CC2(C[NH2+]C2)[C@]2(CCNC2=O)C1 ZINC001158118594 792879394 /nfs/dbraw/zinc/87/93/94/792879394.db2.gz BBTUPQWFBISBAB-XHDPSFHLSA-N 2 0 368.459 -2.299 20 0 FAADRP CC(=O)N[C@@H](CCCC[NH3+])C(=O)N1CC2(C[NH2+]C2)[C@@]2(CCNC2=O)C1 ZINC001158118601 792879829 /nfs/dbraw/zinc/87/98/29/792879829.db2.gz BHARSIYPEFCOOP-GUYCJALGSA-N 2 0 351.451 -1.442 20 0 FAADRP CC(=O)N[C@@H](CCCC[NH3+])C(=O)N1CC2(C[NH2+]C2)[C@]2(CCNC2=O)C1 ZINC001158118602 792879925 /nfs/dbraw/zinc/87/99/25/792879925.db2.gz BHARSIYPEFCOOP-SUMWQHHRSA-N 2 0 351.451 -1.442 20 0 FAADRP CC(C)C[C@H]([NH3+])C(=O)NCC(=O)N1CC2(C[NH2+]C2)[C@@]2(CCNC2=O)C1 ZINC001158118605 792879714 /nfs/dbraw/zinc/87/97/14/792879714.db2.gz BISGGGWRKISDRW-SJCJKPOMSA-N 2 0 351.451 -1.586 20 0 FAADRP CC(C)C[C@H]([NH3+])C(=O)NCC(=O)N1CC2(C[NH2+]C2)[C@]2(CCNC2=O)C1 ZINC001158118606 792879521 /nfs/dbraw/zinc/87/95/21/792879521.db2.gz BISGGGWRKISDRW-YVEFUNNKSA-N 2 0 351.451 -1.586 20 0 FAADRP [NH3+][C@H](CN1CCC([NH3+])CC1)C(=O)N1CC2(C[NH2+]C2)[C@]2(CCNC2=O)C1 ZINC001158120331 792879792 /nfs/dbraw/zinc/87/97/92/792879792.db2.gz OLCPPDKFDYMUTI-CXAGYDPISA-N 3 0 350.467 -2.325 20 0 FAADRP [NH3+][C@H](CN1CCC([NH3+])CC1)C(=O)N1CC2(C[NH2+]C2)[C@@]2(CCNC2=O)C1 ZINC001158120332 792879688 /nfs/dbraw/zinc/87/96/88/792879688.db2.gz OLCPPDKFDYMUTI-DYVFJYSZSA-N 3 0 350.467 -2.325 20 0 FAADRP [NH3+][C@@H](CN1CCC([NH3+])CC1)C(=O)N1CC2(C[NH2+]C2)[C@@]2(CCNC2=O)C1 ZINC001158120333 792879442 /nfs/dbraw/zinc/87/94/42/792879442.db2.gz OLCPPDKFDYMUTI-GUYCJALGSA-N 3 0 350.467 -2.325 20 0 FAADRP [NH3+][C@@H](CN1CCC([NH3+])CC1)C(=O)N1CC2(C[NH2+]C2)[C@]2(CCNC2=O)C1 ZINC001158120334 792879469 /nfs/dbraw/zinc/87/94/69/792879469.db2.gz OLCPPDKFDYMUTI-SUMWQHHRSA-N 3 0 350.467 -2.325 20 0 FAADRP CC[C@H](C)[C@H]([NH3+])C(=O)NCC(=O)N1CC2(C[NH2+]C2)[C@@]2(CCNC2=O)C1 ZINC001158120391 792880084 /nfs/dbraw/zinc/88/00/84/792880084.db2.gz LXBHBBZJNCEITM-BNLOLNQZSA-N 2 0 351.451 -1.586 20 0 FAADRP CC[C@H](C)[C@H]([NH3+])C(=O)NCC(=O)N1CC2(C[NH2+]C2)[C@]2(CCNC2=O)C1 ZINC001158120392 792880680 /nfs/dbraw/zinc/88/06/80/792880680.db2.gz LXBHBBZJNCEITM-PLQHRBFRSA-N 2 0 351.451 -1.586 20 0 FAADRP CC(C)C[C@H](NC(=O)C[NH3+])C(=O)N1CC2(C[NH2+]C2)[C@@]2(CCNC2=O)C1 ZINC001158120450 792881047 /nfs/dbraw/zinc/88/10/47/792881047.db2.gz MVHRAMOAGIHOFA-SJCJKPOMSA-N 2 0 351.451 -1.586 20 0 FAADRP CC(C)C[C@H](NC(=O)C[NH3+])C(=O)N1CC2(C[NH2+]C2)[C@]2(CCNC2=O)C1 ZINC001158120452 792880333 /nfs/dbraw/zinc/88/03/33/792880333.db2.gz MVHRAMOAGIHOFA-YVEFUNNKSA-N 2 0 351.451 -1.586 20 0 FAADRP CCOC(=O)[C@@H]1C[NH2+]C[C@H]1C(=O)N1CC2(C[NH2+]C2)[C@]2(CCNC2=O)C1 ZINC001158121473 792880856 /nfs/dbraw/zinc/88/08/56/792880856.db2.gz USNABKPBJRFVLB-PSTGCABASA-N 2 0 350.419 -1.677 20 0 FAADRP CCOC(=O)[C@@H]1C[NH2+]C[C@H]1C(=O)N1CC2(C[NH2+]C2)[C@@]2(CCNC2=O)C1 ZINC001158121474 792880628 /nfs/dbraw/zinc/88/06/28/792880628.db2.gz USNABKPBJRFVLB-QFSBIZTOSA-N 2 0 350.419 -1.677 20 0 FAADRP CC(=O)NCSC[C@H]([NH3+])C(=O)N1CC2(C[NH2+]C2)[C@@]2(CCNC2=O)C1 ZINC001158121617 792880658 /nfs/dbraw/zinc/88/06/58/792880658.db2.gz VIMGOACSUBECBS-NHYWBVRUSA-N 2 0 355.464 -1.921 20 0 FAADRP CC(=O)NCSC[C@H]([NH3+])C(=O)N1CC2(C[NH2+]C2)[C@]2(CCNC2=O)C1 ZINC001158121618 792880547 /nfs/dbraw/zinc/88/05/47/792880547.db2.gz VIMGOACSUBECBS-XHDPSFHLSA-N 2 0 355.464 -1.921 20 0 FAADRP CS(=O)(=O)N(CC[NH3+])CC(=O)N1CC2(C[NH2+]C2)[C@@]2(CCNC2=O)C1 ZINC001158121629 792881158 /nfs/dbraw/zinc/88/11/58/792881158.db2.gz VOJJNGKGYPTGLW-AWEZNQCLSA-N 2 0 359.452 -2.855 20 0 FAADRP CS(=O)(=O)N(CC[NH3+])CC(=O)N1CC2(C[NH2+]C2)[C@]2(CCNC2=O)C1 ZINC001158121654 792880965 /nfs/dbraw/zinc/88/09/65/792880965.db2.gz VOJJNGKGYPTGLW-CQSZACIVSA-N 2 0 359.452 -2.855 20 0 FAADRP CC(=O)NCCCC[C@H]([NH3+])C(=O)N1CC2(C[NH2+]C2)[C@@]2(CCNC2=O)C1 ZINC001158121657 792880890 /nfs/dbraw/zinc/88/08/90/792880890.db2.gz VSDXAORUJMFCKP-GUYCJALGSA-N 2 0 351.451 -1.442 20 0 FAADRP CC(=O)NCCCC[C@H]([NH3+])C(=O)N1CC2(C[NH2+]C2)[C@]2(CCNC2=O)C1 ZINC001158121659 792880754 /nfs/dbraw/zinc/88/07/54/792880754.db2.gz VSDXAORUJMFCKP-SUMWQHHRSA-N 2 0 351.451 -1.442 20 0 FAADRP Cc1nc(CC[NH3+])nn1-c1nc(S(C)(=O)=O)nc2c1CC[NH2+]CC2 ZINC001158126683 792880739 /nfs/dbraw/zinc/88/07/39/792880739.db2.gz XLFRCJYZRHVNRN-UHFFFAOYSA-N 2 0 351.436 -1.041 20 0 FAADRP O=C([C@@H]1C[NH2+]CC12CCS(=O)(=O)CC2)N1CCO[C@@H]2C[NH2+]C[C@@H]2C1 ZINC001158166668 792880385 /nfs/dbraw/zinc/88/03/85/792880385.db2.gz BTBKPKNAINIQPB-HZSPNIEDSA-N 2 0 357.476 -1.152 20 0 FAADRP O=C([C@H]1C[NH2+]CC12CCS(=O)(=O)CC2)N1CCO[C@@H]2C[NH2+]C[C@@H]2C1 ZINC001158166680 792880975 /nfs/dbraw/zinc/88/09/75/792880975.db2.gz BTBKPKNAINIQPB-MGPQQGTHSA-N 2 0 357.476 -1.152 20 0 FAADRP CS(=O)(=O)c1nc2c(c(-n3cncc3C[C@@H]([NH3+])CO)n1)CC[NH2+]CC2 ZINC001158203074 792881074 /nfs/dbraw/zinc/88/10/74/792881074.db2.gz DOSSACLRLRSNRE-SNVBAGLBSA-N 2 0 366.447 -1.384 20 0 FAADRP NC(=O)NCCC[C@@H]([NH3+])C(=O)N1Cc2ncnn2C2(CC[NH2+]CC2)C1 ZINC001158260478 792880929 /nfs/dbraw/zinc/88/09/29/792880929.db2.gz DGWGVWJFOSFWNR-LLVKDONJSA-N 2 0 350.427 -1.525 20 0 FAADRP NC(=O)NCCC[C@H]([NH3+])C(=O)N1Cc2ncnn2C2(CC[NH2+]CC2)C1 ZINC001158260479 792880485 /nfs/dbraw/zinc/88/04/85/792880485.db2.gz DGWGVWJFOSFWNR-NSHDSACASA-N 2 0 350.427 -1.525 20 0 FAADRP CC(=O)NCSC[C@H]([NH3+])C(=O)N1Cc2ncnn2C2(CC[NH2+]CC2)C1 ZINC001158276633 792882057 /nfs/dbraw/zinc/88/20/57/792882057.db2.gz BLYQSWNMQQUZNV-LBPRGKRZSA-N 2 0 367.479 -1.147 20 0 FAADRP C[C@H](NC(=O)[C@@H]([NH3+])CO)C(=O)N1Cc2ncnn2C2(CC[NH2+]CC2)C1 ZINC001158277535 792881938 /nfs/dbraw/zinc/88/19/38/792881938.db2.gz PSRRUBQQBXGQEQ-QWRGUYRKSA-N 2 0 351.411 -2.477 20 0 FAADRP CS(=O)(=O)N(CC[NH3+])CC(=O)N1Cc2ncnn2C2(CC[NH2+]CC2)C1 ZINC001158277938 792881524 /nfs/dbraw/zinc/88/15/24/792881524.db2.gz YAVDZXHQMFAIGM-UHFFFAOYSA-N 2 0 371.467 -2.081 20 0 FAADRP [NH3+]CCCC[C@H]([NH3+])C(=O)N1CCC[C@H]1C(=O)N1CCS(=O)(=O)CC1 ZINC001158367956 792881664 /nfs/dbraw/zinc/88/16/64/792881664.db2.gz CTESWEKXKCZZMG-STQMWFEESA-N 2 0 360.480 -1.309 20 0 FAADRP C[C@@H]1[C@H](C(=O)NCCC[NH2+]C[C@H](O)CN2C(=O)CCC2=O)CC[N@@H+]1C ZINC001158379823 792882039 /nfs/dbraw/zinc/88/20/39/792882039.db2.gz IQKBGXZCHNPTCT-HZSPNIEDSA-N 2 0 354.451 -1.068 20 0 FAADRP C[C@@H]1[C@H](C(=O)NCCC[NH2+]C[C@@H](O)CN2C(=O)CCC2=O)CC[N@@H+]1C ZINC001158379824 792881955 /nfs/dbraw/zinc/88/19/55/792881955.db2.gz IQKBGXZCHNPTCT-MGPQQGTHSA-N 2 0 354.451 -1.068 20 0 FAADRP CCOC(=O)[C@]12C[NH2+]C[C@@]1(C(F)(F)F)CN(C(=O)CNC(=O)C[NH3+])C2 ZINC001158383622 792881971 /nfs/dbraw/zinc/88/19/71/792881971.db2.gz OCCZSHKKETVNNN-CHWSQXEVSA-N 2 0 366.340 -1.395 20 0 FAADRP CCOC(=O)[C@]12C[NH2+]C[C@]1(C(F)(F)F)CN(C(=O)CNC(=O)C[NH3+])C2 ZINC001158383623 792881862 /nfs/dbraw/zinc/88/18/62/792881862.db2.gz OCCZSHKKETVNNN-OLZOCXBDSA-N 2 0 366.340 -1.395 20 0 FAADRP CCOC(=O)[C@@]12C[NH2+]C[C@@]1(C(F)(F)F)CN(C(=O)CNC(=O)C[NH3+])C2 ZINC001158383624 792882015 /nfs/dbraw/zinc/88/20/15/792882015.db2.gz OCCZSHKKETVNNN-QWHCGFSZSA-N 2 0 366.340 -1.395 20 0 FAADRP CCOC(=O)[C@@]12C[NH2+]C[C@]1(C(F)(F)F)CN(C(=O)CNC(=O)C[NH3+])C2 ZINC001158383625 792881920 /nfs/dbraw/zinc/88/19/20/792881920.db2.gz OCCZSHKKETVNNN-STQMWFEESA-N 2 0 366.340 -1.395 20 0 FAADRP CC[C@@H]1[C@@H](C(=O)NCCC[NH2+]CC(=O)N2CCNC(=O)C2)CC[N@@H+]1C ZINC001158403246 792881433 /nfs/dbraw/zinc/88/14/33/792881433.db2.gz BWDPKEFERFCLKB-UONOGXRCSA-N 2 0 353.467 -1.229 20 0 FAADRP CCOC(=O)[C@@H]1C[C@H]2C[NH2+]C[C@H]2N1C(=O)[C@H]1CCS(=O)(=O)C12C[NH2+]C2 ZINC001158496429 792882587 /nfs/dbraw/zinc/88/25/87/792882587.db2.gz NBFJCOWRRLMHJO-QNWHQSFQSA-N 2 0 371.459 -1.485 20 0 FAADRP CCOC(=O)[C@@H]1C[C@H]2C[NH2+]C[C@H]2N1C(=O)[C@@H]1CCS(=O)(=O)C12C[NH2+]C2 ZINC001158496430 792882957 /nfs/dbraw/zinc/88/29/57/792882957.db2.gz NBFJCOWRRLMHJO-ZDEQEGDKSA-N 2 0 371.459 -1.485 20 0 FAADRP CCOC(=O)[C@@H]1C[C@H]2C[NH2+]C[C@H]2N1C(=O)[C@@H]([NH3+])CSCNC(C)=O ZINC001158498450 792882564 /nfs/dbraw/zinc/88/25/64/792882564.db2.gz PRNNTQBBKFGVQS-ZDEQEGDKSA-N 2 0 358.464 -1.108 20 0 FAADRP CCOC(=O)[C@@H]1C[C@H]2C[NH2+]C[C@H]2N1C(=O)CN(CC[NH3+])S(C)(=O)=O ZINC001158498746 792883009 /nfs/dbraw/zinc/88/30/09/792883009.db2.gz UOXHHRLEOCHLKX-SDDRHHMPSA-N 2 0 362.452 -2.041 20 0 FAADRP CCOC(=O)[C@@H]1C[C@H]2C[NH2+]C[C@H]2N1C(=O)[C@@H]([NH3+])CN1CCC([NH3+])CC1 ZINC001158506345 792882925 /nfs/dbraw/zinc/88/29/25/792882925.db2.gz MYOOWFHIRYUKHQ-CYUUQNCZSA-N 3 0 353.467 -1.511 20 0 FAADRP CCOC(=O)[C@@H]1C[C@H]2C[NH2+]C[C@H]2N1C(=O)[C@H]([NH3+])CN1CCC([NH3+])CC1 ZINC001158506346 792883015 /nfs/dbraw/zinc/88/30/15/792883015.db2.gz MYOOWFHIRYUKHQ-PMOUVXMZSA-N 3 0 353.467 -1.511 20 0 FAADRP O=C([C@@H]1CCS(=O)(=O)C12C[NH2+]C2)N1CC[C@@]23C[NH2+]C[C@@H](C[C@@H]2C1)O3 ZINC001158532425 792882477 /nfs/dbraw/zinc/88/24/77/792882477.db2.gz BRUNKKRAYDBOLH-GUIRCDHDSA-N 2 0 355.460 -1.258 20 0 FAADRP O=C([C@H]1CCS(=O)(=O)C12C[NH2+]C2)N1CC[C@@]23C[NH2+]C[C@@H](C[C@H]2C1)O3 ZINC001158532426 792882804 /nfs/dbraw/zinc/88/28/04/792882804.db2.gz BRUNKKRAYDBOLH-KYEXWDHISA-N 2 0 355.460 -1.258 20 0 FAADRP O=C([C@H]1CCS(=O)(=O)C12C[NH2+]C2)N1CC[C@@]23C[NH2+]C[C@@H](C[C@@H]2C1)O3 ZINC001158532427 792882940 /nfs/dbraw/zinc/88/29/40/792882940.db2.gz BRUNKKRAYDBOLH-RGCMKSIDSA-N 2 0 355.460 -1.258 20 0 FAADRP O=C([C@@H]1CCS(=O)(=O)C12C[NH2+]C2)N1CC[C@@]23C[NH2+]C[C@@H](C[C@H]2C1)O3 ZINC001158532428 792884290 /nfs/dbraw/zinc/88/42/90/792884290.db2.gz BRUNKKRAYDBOLH-SFDCQRBFSA-N 2 0 355.460 -1.258 20 0 FAADRP C[C@H]([NH3+])C(=O)N[C@@H](CC(N)=O)C(=O)N1CC[C@@]23C[NH2+]C[C@@H](C[C@H]2C1)O3 ZINC001158546347 792883762 /nfs/dbraw/zinc/88/37/62/792883762.db2.gz LFVUKYMGJYAEJH-DKQGBHPVSA-N 2 0 353.423 -2.327 20 0 FAADRP C[C@H]([NH3+])C(=O)N[C@@H](CC(N)=O)C(=O)N1CC[C@@]23C[NH2+]C[C@@H](C[C@@H]2C1)O3 ZINC001158546348 792884115 /nfs/dbraw/zinc/88/41/15/792884115.db2.gz LFVUKYMGJYAEJH-WUZDVNQZSA-N 2 0 353.423 -2.327 20 0 FAADRP C[C@H]([NH3+])C(=O)N[C@H](CCC(=O)N1C[C@H](CF)[C@@H](C2([NH3+])CC2)C1)C(N)=O ZINC001158577513 792883745 /nfs/dbraw/zinc/88/37/45/792883745.db2.gz ILPDORWLTXRWRK-FIQHERPVSA-N 2 0 357.430 -1.381 20 0 FAADRP C[C@H]([NH3+])C(=O)N[C@H](CCC(=O)N1C[C@@H](CF)[C@H](C2([NH3+])CC2)C1)C(N)=O ZINC001158577514 792884133 /nfs/dbraw/zinc/88/41/33/792884133.db2.gz ILPDORWLTXRWRK-IRCOFANPSA-N 2 0 357.430 -1.381 20 0 FAADRP C[C@H]([NH3+])C(=O)N[C@H](CCC(=O)N1C[C@H](CF)[C@H](C2([NH3+])CC2)C1)C(N)=O ZINC001158577515 792884075 /nfs/dbraw/zinc/88/40/75/792884075.db2.gz ILPDORWLTXRWRK-NNYUYHANSA-N 2 0 357.430 -1.381 20 0 FAADRP C[C@H]([NH3+])C(=O)N[C@H](CCC(=O)N1C[C@H](C2([NH3+])CC2)[C@H](CF)C1)C(N)=O ZINC001158577516 792883650 /nfs/dbraw/zinc/88/36/50/792883650.db2.gz ILPDORWLTXRWRK-WHOHXGKFSA-N 2 0 357.430 -1.381 20 0 FAADRP C[C@@H]1C[N@H+](C)[C@@H](C)CN1C(=O)CNC(=O)CNC(=O)CNC(=O)C[NH3+] ZINC001158626673 792883962 /nfs/dbraw/zinc/88/39/62/792883962.db2.gz XVSZPJXWCOUWAB-WDEREUQCSA-N 2 0 356.427 -3.155 20 0 FAADRP C[C@H](NC(=O)[C@@H]1CCCN1C(=O)C[NH3+])C(=O)N1C[C@H](C)[N@H+](C)C[C@H]1C ZINC001158630889 792884236 /nfs/dbraw/zinc/88/42/36/792884236.db2.gz ZFVWAFCUWQAOOP-CRWXNKLISA-N 2 0 353.467 -1.008 20 0 FAADRP CS(=O)(=O)N(Cc1noc2c1C[NH2+]CC2)C(=O)CNC1CC[NH2+]CC1 ZINC001158734515 792883908 /nfs/dbraw/zinc/88/39/08/792883908.db2.gz AWDFIGISTBTEKF-UHFFFAOYSA-N 2 0 371.463 -1.050 20 0 FAADRP CS(=O)(=O)N(Cc1noc2c1C[NH2+]CC2)C(=O)[C@H]1C[NH2+]CC12C[NH2+]C2 ZINC001158734789 792883698 /nfs/dbraw/zinc/88/36/98/792883698.db2.gz FJEYFMPVCREHQI-LLVKDONJSA-N 3 0 369.447 -1.583 20 0 FAADRP CS(=O)(=O)N(Cc1noc2c1C[NH2+]CC2)C(=O)[C@@H]1C[NH2+]CC12C[NH2+]C2 ZINC001158734790 792883567 /nfs/dbraw/zinc/88/35/67/792883567.db2.gz FJEYFMPVCREHQI-NSHDSACASA-N 3 0 369.447 -1.583 20 0 FAADRP CS(=O)(=O)N(Cc1noc2c1C[NH2+]CC2)C(=O)[C@]12C[NH2+]C[C@H]1CCN2 ZINC001158734980 792884331 /nfs/dbraw/zinc/88/43/31/792884331.db2.gz IWNYHNRPEDJYHL-BMIGLBTASA-N 2 0 369.447 -1.440 20 0 FAADRP CS(=O)(=O)N(Cc1noc2c1C[NH2+]CC2)C(=O)[C@]12C[NH2+]C[C@@H]1CCN2 ZINC001158734981 792883586 /nfs/dbraw/zinc/88/35/86/792883586.db2.gz IWNYHNRPEDJYHL-BONVTDFDSA-N 2 0 369.447 -1.440 20 0 FAADRP CS(=O)(=O)N(Cc1noc2c1C[NH2+]CC2)C(=O)[C@@]12C[NH2+]C[C@H]1CCN2 ZINC001158734982 792883380 /nfs/dbraw/zinc/88/33/80/792883380.db2.gz IWNYHNRPEDJYHL-MEBBXXQBSA-N 2 0 369.447 -1.440 20 0 FAADRP CS(=O)(=O)N(Cc1noc2c1C[NH2+]CC2)C(=O)[C@@]12C[NH2+]C[C@@H]1CCN2 ZINC001158734983 792883486 /nfs/dbraw/zinc/88/34/86/792883486.db2.gz IWNYHNRPEDJYHL-ZUZCIYMTSA-N 2 0 369.447 -1.440 20 0 FAADRP CS(=O)(=O)N(Cc1noc2c1C[NH2+]CC2)C(=O)[C@]1(N)CCC[NH2+]C1 ZINC001158734994 792884098 /nfs/dbraw/zinc/88/40/98/792884098.db2.gz JEDPOCFHMKSOKO-AWEZNQCLSA-N 2 0 357.436 -1.311 20 0 FAADRP CS(=O)(=O)N(Cc1noc2c1C[NH2+]CC2)C(=O)[C@@]1(N)CCC[NH2+]C1 ZINC001158734995 792883674 /nfs/dbraw/zinc/88/36/74/792883674.db2.gz JEDPOCFHMKSOKO-CQSZACIVSA-N 2 0 357.436 -1.311 20 0 FAADRP CS(=O)(=O)N(Cc1noc2c1C[NH2+]CC2)C(=O)[C@@H](N)C1CC[NH2+]CC1 ZINC001158735023 792883344 /nfs/dbraw/zinc/88/33/44/792883344.db2.gz KHCXLKRCBOLOSM-AWEZNQCLSA-N 2 0 371.463 -1.065 20 0 FAADRP CS(=O)(=O)N(Cc1noc2c1C[NH2+]CC2)C(=O)[C@H](N)C1CC[NH2+]CC1 ZINC001158735024 792883306 /nfs/dbraw/zinc/88/33/06/792883306.db2.gz KHCXLKRCBOLOSM-CQSZACIVSA-N 2 0 371.463 -1.065 20 0 FAADRP CS(=O)(=O)N(Cc1noc2c1C[NH2+]CC2)C(=O)C1(N)CC[NH2+]CC1 ZINC001158735148 792883872 /nfs/dbraw/zinc/88/38/72/792883872.db2.gz PFXBVDFQBXTYIK-UHFFFAOYSA-N 2 0 357.436 -1.311 20 0 FAADRP CS(=O)(=O)N(Cc1noc2c1C[NH2+]CC2)C(=O)[C@@H]1C[C@H]2C[NH2+]C[C@H]2N1 ZINC001158735180 792884219 /nfs/dbraw/zinc/88/42/19/792884219.db2.gz QNNNJNOINKWVAE-ZMLRMANQSA-N 2 0 369.447 -1.442 20 0 FAADRP CS(=O)(=O)N(Cc1noc2c1C[NH2+]CC2)C(=O)[C@@]12CC[C@@H](N1)[C@H]([NH3+])C2 ZINC001158735521 792884281 /nfs/dbraw/zinc/88/42/81/792884281.db2.gz VEDBJUKMTLZBDB-HFAKWTLXSA-N 2 0 369.447 -1.170 20 0 FAADRP CS(=O)(=O)N(Cc1noc2c1C[NH2+]CC2)C(=O)CN1CC[NH2+]CC1 ZINC001158735965 792884007 /nfs/dbraw/zinc/88/40/07/792884007.db2.gz XGBFEDJPNSHKQY-UHFFFAOYSA-N 2 0 357.436 -1.486 20 0 FAADRP CS(=O)(=O)c1nc2c(c(N3C[C@@H]([NH3+])C4(COC4)C3)n1)CC[NH2+]CC2 ZINC001158765218 792884543 /nfs/dbraw/zinc/88/45/43/792884543.db2.gz WHCDHRFHMKJLCI-GFCCVEGCSA-N 2 0 353.448 -1.268 20 0 FAADRP CS(=O)(=O)c1nc2c(c(N3C[C@H]([NH3+])C4(COC4)C3)n1)CC[NH2+]CC2 ZINC001158765219 792884837 /nfs/dbraw/zinc/88/48/37/792884837.db2.gz WHCDHRFHMKJLCI-LBPRGKRZSA-N 2 0 353.448 -1.268 20 0 FAADRP CNC(=O)CO[C@H]1COC2(C1)CCN(C(=O)[C@@H]([NH3+])CSCC[NH3+])CC2 ZINC001158814416 792885200 /nfs/dbraw/zinc/88/52/00/792885200.db2.gz NCIFBBUUAQINFE-OLZOCXBDSA-N 2 0 374.507 -1.082 20 0 FAADRP CNC(=O)CO[C@@H]1COC2(C1)CCN(C(=O)[C@@H]([NH3+])CSCC[NH3+])CC2 ZINC001158814427 792884678 /nfs/dbraw/zinc/88/46/78/792884678.db2.gz NCIFBBUUAQINFE-STQMWFEESA-N 2 0 374.507 -1.082 20 0 FAADRP [NH3+]CCSC[C@H]([NH3+])C(=O)N1CCn2c(CN3CCOCC3)nnc2C1 ZINC001158821208 792885895 /nfs/dbraw/zinc/88/58/95/792885895.db2.gz CQRFIPZLBBHEEO-LBPRGKRZSA-N 2 0 369.495 -1.528 20 0 FAADRP [NH3+]CCCC[C@H]([NH3+])C(=O)N1CCn2c(CN3CCOCC3)nnc2C1 ZINC001158821411 792885690 /nfs/dbraw/zinc/88/56/90/792885690.db2.gz KWVHHGZYQMBHEN-ZDUSSCGKSA-N 2 0 351.455 -1.091 20 0 FAADRP [NH3+]CCSC[C@H]([NH3+])C(=O)N1C[C@@H]2[C@H](C1)OCCN2c1ncccn1 ZINC001158968015 792885866 /nfs/dbraw/zinc/88/58/66/792885866.db2.gz IVKDSVQYPAQSJA-XQQFMLRXSA-N 2 0 352.464 -1.088 20 0 FAADRP COCCNC(=O)[C@@H]1Cn2nccc2CN(C(=O)[C@H]([NH3+])CCC[NH3+])C1 ZINC001158991219 792888742 /nfs/dbraw/zinc/88/87/42/792888742.db2.gz KTGAHGOYFWUDFC-GXTWGEPZSA-N 2 0 352.439 -1.330 20 0 FAADRP COCCNC(=O)[C@@H]1Cn2nccc2CN(C(=O)[C@@H]([NH3+])CCC[NH3+])C1 ZINC001158991220 792888979 /nfs/dbraw/zinc/88/89/79/792888979.db2.gz KTGAHGOYFWUDFC-JSGCOSHPSA-N 2 0 352.439 -1.330 20 0 FAADRP COCCNC(=O)[C@H]1Cn2nccc2CN(C(=O)[C@@H]([NH3+])CCC[NH3+])C1 ZINC001158991221 792888195 /nfs/dbraw/zinc/88/81/95/792888195.db2.gz KTGAHGOYFWUDFC-OCCSQVGLSA-N 2 0 352.439 -1.330 20 0 FAADRP COCCNC(=O)[C@H]1Cn2nccc2CN(C(=O)[C@H]([NH3+])CCC[NH3+])C1 ZINC001158991222 792888149 /nfs/dbraw/zinc/88/81/49/792888149.db2.gz KTGAHGOYFWUDFC-TZMCWYRMSA-N 2 0 352.439 -1.330 20 0 FAADRP COCCNC(=O)[C@H]1Cn2nccc2CN(C(=O)C[NH2+]CCC[NH3+])C1 ZINC001158992349 792888512 /nfs/dbraw/zinc/88/85/12/792888512.db2.gz VTRHMSMBLZOYSW-CYBMUJFWSA-N 2 0 352.439 -1.458 20 0 FAADRP COCCNC(=O)[C@@H]1Cn2nccc2CN(C(=O)C[NH2+]CCC[NH3+])C1 ZINC001158992353 792888620 /nfs/dbraw/zinc/88/86/20/792888620.db2.gz VTRHMSMBLZOYSW-ZDUSSCGKSA-N 2 0 352.439 -1.458 20 0 FAADRP Cn1nnc2c1CCN(C(=O)[C@@H](N)C[NH3+])[C@@H]2COCC[NH+]1CCCC1 ZINC001159122788 792889732 /nfs/dbraw/zinc/88/97/32/792889732.db2.gz AEJSXYFPLLFOKN-GXTWGEPZSA-N 2 0 351.455 -1.361 20 0 FAADRP Cn1nnc2c1CCN(C(=O)[C@@H](N)C[NH3+])[C@H]2COCC[NH+]1CCCC1 ZINC001159122789 792889712 /nfs/dbraw/zinc/88/97/12/792889712.db2.gz AEJSXYFPLLFOKN-JSGCOSHPSA-N 2 0 351.455 -1.361 20 0 FAADRP CNC(=O)CN1CCOC[C@@]2(CCCN(C(=O)C[NH2+]CCC[NH3+])C2)C1 ZINC001159127898 792890449 /nfs/dbraw/zinc/89/04/49/792890449.db2.gz VCUDVMXALFAYCQ-KRWDZBQOSA-N 2 0 355.483 -1.388 20 0 FAADRP CNC(=O)CN1CCOC[C@]2(CCCN(C(=O)C[NH2+]CCC[NH3+])C2)C1 ZINC001159127899 792891502 /nfs/dbraw/zinc/89/15/02/792891502.db2.gz VCUDVMXALFAYCQ-QGZVFWFLSA-N 2 0 355.483 -1.388 20 0 FAADRP C[C@H](NC(=O)[C@@H]([NH3+])CO)C(=O)N1Cc2nccn2C[C@H](C[NH+](C)C)C1 ZINC001159135467 792891273 /nfs/dbraw/zinc/89/12/73/792891273.db2.gz VZTCISZRLQDZQN-AVGNSLFASA-N 2 0 352.439 -1.773 20 0 FAADRP C[C@H](NC(=O)[C@@H]([NH3+])CO)C(=O)N1Cc2nccn2C[C@@H](C[NH+](C)C)C1 ZINC001159135468 792890794 /nfs/dbraw/zinc/89/07/94/792890794.db2.gz VZTCISZRLQDZQN-XQQFMLRXSA-N 2 0 352.439 -1.773 20 0 FAADRP C[NH+](C)CCNC(=O)c1noc2c1CN(C(=O)[C@H]([NH3+])CCC[NH3+])CC2 ZINC001159190933 792892160 /nfs/dbraw/zinc/89/21/60/792892160.db2.gz NZFYMGORPWGOMK-GFCCVEGCSA-N 3 0 352.439 -1.083 20 0 FAADRP C[NH+](C)CCNC(=O)c1noc2c1CN(C(=O)[C@@H]([NH3+])CCC[NH3+])CC2 ZINC001159190934 792891944 /nfs/dbraw/zinc/89/19/44/792891944.db2.gz NZFYMGORPWGOMK-LBPRGKRZSA-N 3 0 352.439 -1.083 20 0 FAADRP C[NH+](C)CCNC(=O)c1noc2c1CN(C(=O)[C@@H]1C[C@H](O)C[NH2+]1)CC2 ZINC001159190942 792892555 /nfs/dbraw/zinc/89/25/55/792892555.db2.gz OFXNWGGDQPWABU-JQWIXIFHSA-N 2 0 351.407 -1.427 20 0 FAADRP C[NH+](C)CCNC(=O)c1noc2c1CN(C(=O)[C@H]1C[C@@H](O)C[NH2+]1)CC2 ZINC001159190943 792892166 /nfs/dbraw/zinc/89/21/66/792892166.db2.gz OFXNWGGDQPWABU-ZYHUDNBSSA-N 2 0 351.407 -1.427 20 0 FAADRP C[NH+](C)CCNC(=O)c1noc2c1CN(C(=O)[C@H]1C[NH2+]C[C@H]1O)CC2 ZINC001159191373 792892383 /nfs/dbraw/zinc/89/23/83/792892383.db2.gz UKNORJVEIOYXIW-CMPLNLGQSA-N 2 0 351.407 -1.569 20 0 FAADRP C[NH+](C)CCNC(=O)c1noc2c1CN(C(=O)[C@H]1C[NH2+]C[C@@H]1O)CC2 ZINC001159191374 792892320 /nfs/dbraw/zinc/89/23/20/792892320.db2.gz UKNORJVEIOYXIW-JQWIXIFHSA-N 2 0 351.407 -1.569 20 0 FAADRP C[NH+](C)CCNC(=O)c1noc2c1CN(C(=O)[C@@H]1C[NH2+]C[C@@H]1O)CC2 ZINC001159191375 792892444 /nfs/dbraw/zinc/89/24/44/792892444.db2.gz UKNORJVEIOYXIW-PWSUYJOCSA-N 2 0 351.407 -1.569 20 0 FAADRP C[NH+](C)CCNC(=O)c1noc2c1CN(C(=O)[C@@H]1C[NH2+]C[C@H]1O)CC2 ZINC001159191376 792892495 /nfs/dbraw/zinc/89/24/95/792892495.db2.gz UKNORJVEIOYXIW-ZYHUDNBSSA-N 2 0 351.407 -1.569 20 0 FAADRP C[NH+](C)CCNC(=O)c1noc2c1CN(C(=O)[C@H]1C[NH2+]C[C@@H]1N)CC2 ZINC001159191649 792892524 /nfs/dbraw/zinc/89/25/24/792892524.db2.gz IZWMFNOMMJLPBW-JQWIXIFHSA-N 2 0 350.423 -1.603 20 0 FAADRP C[NH+](C)CCNC(=O)c1noc2c1CN(C(=O)[C@@H]1C[NH2+]CCN1)CC2 ZINC001159191741 792892457 /nfs/dbraw/zinc/89/24/57/792892457.db2.gz XRQPQLMBBHUDKO-LBPRGKRZSA-N 2 0 350.423 -1.588 20 0 FAADRP C[NH+](C)CCNC(=O)c1noc2c1CN(C(=O)[C@H]1[NH2+]CC[C@@H]1O)CC2 ZINC001159191742 792892565 /nfs/dbraw/zinc/89/25/65/792892565.db2.gz JIUYXOQZRPBFRG-FZMZJTMJSA-N 2 0 351.407 -1.427 20 0 FAADRP C[NH+](C)CCNC(=O)c1noc2c1CN(C(=O)[C@H]1[NH2+]CC[C@H]1O)CC2 ZINC001159191744 792892127 /nfs/dbraw/zinc/89/21/27/792892127.db2.gz JIUYXOQZRPBFRG-RISCZKNCSA-N 2 0 351.407 -1.427 20 0 FAADRP C[NH+](C)CCNC(=O)c1noc2c1CN(C(=O)[C@]1(N)CC[NH2+]C1)CC2 ZINC001159191832 792891915 /nfs/dbraw/zinc/89/19/15/792891915.db2.gz YQLDABHDUMGRFG-INIZCTEOSA-N 2 0 350.423 -1.459 20 0 FAADRP C[NH+](C)CCNC(=O)c1noc2c1CN(C(=O)[C@@]1(N)CC[NH2+]C1)CC2 ZINC001159191835 792891979 /nfs/dbraw/zinc/89/19/79/792891979.db2.gz YQLDABHDUMGRFG-MRXNPFEDSA-N 2 0 350.423 -1.459 20 0 FAADRP C[NH+](C)CCNC(=O)c1noc2c1CN(C(=O)[C@@H]1C[C@@H]([NH3+])CN1)CC2 ZINC001159191884 792892334 /nfs/dbraw/zinc/89/23/34/792892334.db2.gz ZILTVERLONUPBS-PWSUYJOCSA-N 2 0 350.423 -1.460 20 0 FAADRP [NH3+]CCSC[C@H]([NH3+])C(=O)N1C[C@@H]2[C@H](C1)OCCN2c1cnccn1 ZINC001159271616 792892421 /nfs/dbraw/zinc/89/24/21/792892421.db2.gz FRTHYPZEIBLOIJ-XQQFMLRXSA-N 2 0 352.464 -1.088 20 0 FAADRP C[C@H]([NH3+])C(=O)N[C@@H](CC(N)=O)C(=O)N1CC2(C1)CC[N@H+](CC1CC1)C2 ZINC001159291519 792891839 /nfs/dbraw/zinc/89/18/39/792891839.db2.gz PJXVTAVDBBAQDI-AAEUAGOBSA-N 2 0 351.451 -1.362 20 0 FAADRP CS(=O)(=O)c1nc2c(c(NCCOCCOCC[NH3+])n1)CC[NH2+]CC2 ZINC001159443156 792892900 /nfs/dbraw/zinc/89/29/00/792892900.db2.gz LDZSHAUFSLJRDK-UHFFFAOYSA-N 2 0 373.479 -1.028 20 0 FAADRP CN(C)C(=O)CN1CC[C@]2(CCCN(C(=O)C[NH2+]CCC[NH3+])C2)C1=O ZINC001159491551 792892713 /nfs/dbraw/zinc/89/27/13/792892713.db2.gz DXXAIZMGBSTTFB-KRWDZBQOSA-N 2 0 353.467 -1.146 20 0 FAADRP CN(C)C(=O)CN1CC[C@@]2(CCCN(C(=O)C[NH2+]CCC[NH3+])C2)C1=O ZINC001159491552 792893443 /nfs/dbraw/zinc/89/34/43/792893443.db2.gz DXXAIZMGBSTTFB-QGZVFWFLSA-N 2 0 353.467 -1.146 20 0 FAADRP [NH3+]CCSC[C@H]([NH3+])C(=O)N1Cc2[nH]nc(C(=O)N3CCOCC3)c2C1 ZINC001159492346 792893111 /nfs/dbraw/zinc/89/31/11/792893111.db2.gz HMNHUPWAPNDVKH-NSHDSACASA-N 2 0 368.463 -1.257 20 0 FAADRP CN(C)C(=O)CN1CC[C@@]2(CCCN(C(=O)[C@H]([NH3+])CCC[NH3+])C2)C1=O ZINC001159493862 792894200 /nfs/dbraw/zinc/89/42/00/792894200.db2.gz XKFZMXKCPFNODW-CXAGYDPISA-N 2 0 353.467 -1.018 20 0 FAADRP CN(C)C(=O)CN1CC[C@]2(CCCN(C(=O)[C@H]([NH3+])CCC[NH3+])C2)C1=O ZINC001159493863 792894535 /nfs/dbraw/zinc/89/45/35/792894535.db2.gz XKFZMXKCPFNODW-DYVFJYSZSA-N 2 0 353.467 -1.018 20 0 FAADRP CN(C)C(=O)CN1CC[C@]2(CCCN(C(=O)[C@@H]([NH3+])CCC[NH3+])C2)C1=O ZINC001159493864 792894257 /nfs/dbraw/zinc/89/42/57/792894257.db2.gz XKFZMXKCPFNODW-GUYCJALGSA-N 2 0 353.467 -1.018 20 0 FAADRP CN(C)C(=O)CN1CC[C@@]2(CCCN(C(=O)[C@@H]([NH3+])CCC[NH3+])C2)C1=O ZINC001159493865 792894728 /nfs/dbraw/zinc/89/47/28/792894728.db2.gz XKFZMXKCPFNODW-SUMWQHHRSA-N 2 0 353.467 -1.018 20 0 FAADRP CN1CCN(CC[NH+](C)C)C(=O)C12CCN(C(=O)C[C@H](O)C[NH3+])CC2 ZINC001159608031 792894359 /nfs/dbraw/zinc/89/43/59/792894359.db2.gz FNOCCWZZZWRNEJ-AWEZNQCLSA-N 2 0 355.483 -1.607 20 0 FAADRP CN1CCN(CC[NH+](C)C)C(=O)C12CCN(C(=O)C[C@@H](O)C[NH3+])CC2 ZINC001159608032 792894133 /nfs/dbraw/zinc/89/41/33/792894133.db2.gz FNOCCWZZZWRNEJ-CQSZACIVSA-N 2 0 355.483 -1.607 20 0 FAADRP CN1CCN(CC[NH+](C)C)C(=O)C12CCN(C(=O)[C@@H](N)CC[NH3+])CC2 ZINC001159609287 792894393 /nfs/dbraw/zinc/89/43/93/792894393.db2.gz HFBJZWZOADQDSY-AWEZNQCLSA-N 2 0 354.499 -1.641 20 0 FAADRP COCC[N@@H+]1CCO[C@@H]2CN(C(=O)[C@H]3C[NH2+]CC34C[NH2+]C4)CC[C@@H]2C1 ZINC001159636560 792894410 /nfs/dbraw/zinc/89/44/10/792894410.db2.gz UVOPRUNOFXPEBM-BZUAXINKSA-N 3 0 352.479 -1.009 20 0 FAADRP COCC[N@@H+]1CCO[C@@H]2CN(C(=O)[C@@H]3C[NH2+]CC34C[NH2+]C4)CC[C@@H]2C1 ZINC001159636562 792894582 /nfs/dbraw/zinc/89/45/82/792894582.db2.gz UVOPRUNOFXPEBM-OWCLPIDISA-N 3 0 352.479 -1.009 20 0 FAADRP [NH3+]CCC[C@H]([NH3+])Nc1nc(N2CCOCC2)nc(N2CCOCC2)n1 ZINC001159779984 792893765 /nfs/dbraw/zinc/89/37/65/792893765.db2.gz MOEGQOOTEVTZPE-GFCCVEGCSA-N 2 0 352.443 -1.598 20 0 FAADRP [NH3+]CCC[C@@H]([NH3+])Nc1nc(N2CCOCC2)nc(N2CCOCC2)n1 ZINC001159779985 792894100 /nfs/dbraw/zinc/89/41/00/792894100.db2.gz MOEGQOOTEVTZPE-LBPRGKRZSA-N 2 0 352.443 -1.598 20 0 FAADRP CCOC(=O)CN(CC[NH3+])c1nc(S(C)(=O)=O)nc2c1CC[NH2+]CC2 ZINC001159860793 792895920 /nfs/dbraw/zinc/89/59/20/792895920.db2.gz HBGDVNCTKZQTPR-UHFFFAOYSA-N 2 0 371.463 -1.104 20 0 FAADRP C[NH+](C)CCN1CC[C@@H]2[C@@H]1CCN2C(=O)CN(CC[NH3+])S(C)(=O)=O ZINC001159929526 792895816 /nfs/dbraw/zinc/89/58/16/792895816.db2.gz GJHDKTPBUCRQDH-UONOGXRCSA-N 2 0 361.512 -1.557 20 0 FAADRP C[NH+](C)CCN1CC[C@@H]2[C@@H]1CCN2C(=O)[C@H]([NH3+])CN1CCC([NH3+])CC1 ZINC001159930968 792895719 /nfs/dbraw/zinc/89/57/19/792895719.db2.gz ZWEXYFARFILJIJ-IXDOHACOSA-N 3 0 352.527 -1.026 20 0 FAADRP C[NH+](C)CCN1CC[C@@H]2[C@@H]1CCN2C(=O)[C@@H]([NH3+])CN1CCC([NH3+])CC1 ZINC001159930971 792895333 /nfs/dbraw/zinc/89/53/33/792895333.db2.gz ZWEXYFARFILJIJ-YESZJQIVSA-N 3 0 352.527 -1.026 20 0 FAADRP CS(=O)(=O)N1C[C@H]2CCCN(C(=O)[C@@H]([NH3+])CN3CCC([NH3+])CC3)[C@H]2C1 ZINC001159997906 792895353 /nfs/dbraw/zinc/89/53/53/792895353.db2.gz CANHNTNJNWHHHH-SNPRPXQTSA-N 2 0 373.523 -1.381 20 0 FAADRP CS(=O)(=O)N1C[C@H]2CCCN(C(=O)[C@H]([NH3+])CN3CCC([NH3+])CC3)[C@H]2C1 ZINC001159997907 792895674 /nfs/dbraw/zinc/89/56/74/792895674.db2.gz CANHNTNJNWHHHH-YUELXQCFSA-N 2 0 373.523 -1.381 20 0 FAADRP CS(=O)(=O)N1C[C@H]2CCCN(C(=O)[C@@H]([NH3+])CSCC[NH3+])[C@H]2C1 ZINC001159999754 792895573 /nfs/dbraw/zinc/89/55/73/792895573.db2.gz SQYAEVHGVJJKNQ-WOPDTQHZSA-N 2 0 350.510 -1.112 20 0 FAADRP CN(C)S(=O)(=O)N1CC[C@@H]2CN(C(=O)[C@@H]([NH3+])C3CC[NH2+]CC3)C[C@H]2C1 ZINC001160007030 792895449 /nfs/dbraw/zinc/89/54/49/792895449.db2.gz BGFHVAQZHVZRJO-ILXRZTDVSA-N 2 0 373.523 -1.100 20 0 FAADRP CN(C)S(=O)(=O)N1CC[C@@H]2CN(C(=O)[C@H]([NH3+])C3CC[NH2+]CC3)C[C@H]2C1 ZINC001160007031 792895114 /nfs/dbraw/zinc/89/51/14/792895114.db2.gz BGFHVAQZHVZRJO-QLFBSQMISA-N 2 0 373.523 -1.100 20 0 FAADRP CN(C)S(=O)(=O)N1CC[C@@H]2CN(C(=O)[C@H]3C[NH2+]CC34C[NH2+]C4)C[C@H]2C1 ZINC001160007253 792897096 /nfs/dbraw/zinc/89/70/96/792897096.db2.gz HLJYNUPAFDWMIN-HZSPNIEDSA-N 2 0 371.507 -1.618 20 0 FAADRP CN(C)S(=O)(=O)N1CC[C@@H]2CN(C(=O)[C@@H]3C[NH2+]CC34C[NH2+]C4)C[C@H]2C1 ZINC001160007254 792896606 /nfs/dbraw/zinc/89/66/06/792896606.db2.gz HLJYNUPAFDWMIN-RDBSUJKOSA-N 2 0 371.507 -1.618 20 0 FAADRP CS(=O)(=O)N(CC[NH3+])CC(=O)N1C[C@@H]2C[N@@H+](CC3CC3)C[C@H](C1)O2 ZINC001160154969 792898056 /nfs/dbraw/zinc/89/80/56/792898056.db2.gz BXIMGKCAEJOIDX-OKILXGFUSA-N 2 0 360.480 -1.472 20 0 FAADRP CC(=O)N1CC(=O)NC[C@@]12CCN(C(=O)[C@@H]([NH3+])CCCC[NH+](C)C)C2 ZINC001160171357 792898099 /nfs/dbraw/zinc/89/80/99/792898099.db2.gz LFPVNMRQOLXSNN-WMLDXEAASA-N 2 0 353.467 -1.005 20 0 FAADRP CC(=O)N1CC(=O)NC[C@]12CCN(C(=O)[C@@H]([NH3+])CCCC[NH+](C)C)C2 ZINC001160171358 792897576 /nfs/dbraw/zinc/89/75/76/792897576.db2.gz LFPVNMRQOLXSNN-YOEHRIQHSA-N 2 0 353.467 -1.005 20 0 FAADRP Cn1cc(N2C[C@@H]3CN(C(=O)[C@@H]([NH3+])CSCC[NH3+])C[C@@H]3C2=O)cn1 ZINC001160218053 792897492 /nfs/dbraw/zinc/89/74/92/792897492.db2.gz PIRJZYNGQPHKQJ-DRZSPHRISA-N 2 0 352.464 -1.140 20 0 FAADRP CN(C)C(=O)COCc1nnc2n1CCN(C(=O)C[NH2+]CCC[NH3+])C2 ZINC001160380601 792899136 /nfs/dbraw/zinc/89/91/36/792899136.db2.gz HEVLQHNOKFFGCC-UHFFFAOYSA-N 2 0 353.427 -1.837 20 0 FAADRP CN(C)C(=O)COCc1nnc2n1CCN(C(=O)[C@H]([NH3+])CCC[NH3+])C2 ZINC001160381530 792899479 /nfs/dbraw/zinc/89/94/79/792899479.db2.gz WWTMYJUJLITFOW-LLVKDONJSA-N 2 0 353.427 -1.709 20 0 FAADRP CN(C)C(=O)COCc1nnc2n1CCN(C(=O)[C@@H]([NH3+])CCC[NH3+])C2 ZINC001160381533 792899369 /nfs/dbraw/zinc/89/93/69/792899369.db2.gz WWTMYJUJLITFOW-NSHDSACASA-N 2 0 353.427 -1.709 20 0 FAADRP COCCN(C(=O)CN(CC[NH3+])S(C)(=O)=O)C1CC[NH+](C)CC1 ZINC001160438896 792900062 /nfs/dbraw/zinc/90/00/62/792900062.db2.gz CXZHVGDYKRYASZ-UHFFFAOYSA-N 2 0 350.485 -1.224 20 0 FAADRP COCCN(C(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)[NH3+])C1CC[NH+](C)CC1 ZINC001160439177 792900149 /nfs/dbraw/zinc/90/01/49/792900149.db2.gz HGOHSNIKGULCHL-AAEUAGOBSA-N 2 0 357.455 -1.737 20 0 FAADRP NC(=O)N1CCN(C(=O)[C@@H]2CCCN2C(=O)[C@@H]([NH3+])CCCC[NH3+])CC1 ZINC001160456538 792900976 /nfs/dbraw/zinc/90/09/76/792900976.db2.gz MLICAPMHXUSKNC-STQMWFEESA-N 2 0 354.455 -1.343 20 0 FAADRP C[NH2+]CC1CCN(C(=O)CNC(=O)CNC(=O)CNC(=O)C[NH3+])CC1 ZINC001160459512 792901302 /nfs/dbraw/zinc/90/13/02/792901302.db2.gz MSTGYHIFNZSJBD-UHFFFAOYSA-N 2 0 356.427 -3.248 20 0 FAADRP C[NH2+]CC1CCN(C(=O)[C@H](C)NC(=O)[C@@H]2CCCN2C(=O)C[NH3+])CC1 ZINC001160460017 792900929 /nfs/dbraw/zinc/90/09/29/792900929.db2.gz WETBKIDFFDXUNJ-JSGCOSHPSA-N 2 0 353.467 -1.101 20 0 FAADRP CC(C)NC(=O)CN1CCN(C(=O)[C@@H]([NH3+])CN2CCC([NH3+])CC2)CC1 ZINC001160485134 792900954 /nfs/dbraw/zinc/90/09/54/792900954.db2.gz RKKPDQBATKTQJR-HNNXBMFYSA-N 2 0 354.499 -1.594 20 0 FAADRP CC(C)NC(=O)CN1CCN(C(=O)[C@H]([NH3+])CN2CCC([NH3+])CC2)CC1 ZINC001160485135 792901191 /nfs/dbraw/zinc/90/11/91/792901191.db2.gz RKKPDQBATKTQJR-OAHLLOKOSA-N 2 0 354.499 -1.594 20 0 FAADRP C[C@H]([NH3+])C(=O)N[C@@H](CC(N)=O)C(=O)N1CC[NH+](C2CCOCC2)CC1 ZINC001160490906 792901096 /nfs/dbraw/zinc/90/10/96/792901096.db2.gz LXBXMCBAQUAVBN-AAEUAGOBSA-N 2 0 355.439 -1.983 20 0 FAADRP COC(=O)[C@@H]1CS[C@@H](C(=O)OC)N1C(=O)[C@@H]([NH3+])CSCC[NH3+] ZINC001160492834 792901114 /nfs/dbraw/zinc/90/11/14/792901114.db2.gz IHDJWJOQMPSUMT-NRPADANISA-N 2 0 351.450 -1.378 20 0 FAADRP COC(=O)[C@@H]1CS[C@H](C(=O)OC)N1C(=O)[C@@H]([NH3+])CSCC[NH3+] ZINC001160492835 792901260 /nfs/dbraw/zinc/90/12/60/792901260.db2.gz IHDJWJOQMPSUMT-OYNCUSHFSA-N 2 0 351.450 -1.378 20 0 FAADRP COC(=O)[C@H]1SC[C@H](C(=O)OC)N1C(=O)[C@@H]([NH3+])CSCC[NH3+] ZINC001160492836 792902409 /nfs/dbraw/zinc/90/24/09/792902409.db2.gz IHDJWJOQMPSUMT-QXFUBDJGSA-N 2 0 351.450 -1.378 20 0 FAADRP COC(=O)[C@H]1CS[C@@H](C(=O)OC)N1C(=O)[C@@H]([NH3+])CSCC[NH3+] ZINC001160492837 792902340 /nfs/dbraw/zinc/90/23/40/792902340.db2.gz IHDJWJOQMPSUMT-XKSSXDPKSA-N 2 0 351.450 -1.378 20 0 FAADRP COC(=O)[C@@H]1CS[C@H](C(=O)OC)N1C(=O)[C@@H]([NH3+])CN1CCC([NH3+])CC1 ZINC001160492963 792902481 /nfs/dbraw/zinc/90/24/81/792902481.db2.gz KPNGWAYINLCSET-GMXVVIOVSA-N 2 0 374.463 -1.647 20 0 FAADRP COC(=O)[C@@H]1CS[C@@H](C(=O)OC)N1C(=O)[C@@H]([NH3+])CN1CCC([NH3+])CC1 ZINC001160492964 792901972 /nfs/dbraw/zinc/90/19/72/792901972.db2.gz KPNGWAYINLCSET-GVXVVHGQSA-N 2 0 374.463 -1.647 20 0 FAADRP COC(=O)[C@@H]1CS[C@@H](C(=O)OC)N1C(=O)[C@H]([NH3+])CN1CCC([NH3+])CC1 ZINC001160492965 792901894 /nfs/dbraw/zinc/90/18/94/792901894.db2.gz KPNGWAYINLCSET-MDZLAQPJSA-N 2 0 374.463 -1.647 20 0 FAADRP COC(=O)[C@@H]1CS[C@H](C(=O)OC)N1C(=O)[C@H]([NH3+])CN1CCC([NH3+])CC1 ZINC001160492966 792902052 /nfs/dbraw/zinc/90/20/52/792902052.db2.gz KPNGWAYINLCSET-NTZNESFSSA-N 2 0 374.463 -1.647 20 0 FAADRP COC(=O)[C@@H]1CS[C@@H](C(=O)OC)N1C(=O)[C@]12C[NH2+]C[C@H]1C[NH2+]CC2 ZINC001160494330 792902558 /nfs/dbraw/zinc/90/25/58/792902558.db2.gz SELCONOWHPYALL-DZHLUBAWSA-N 2 0 357.432 -1.198 20 0 FAADRP COC(=O)[C@@H]1CS[C@H](C(=O)OC)N1C(=O)[C@]12C[NH2+]C[C@H]1C[NH2+]CC2 ZINC001160494332 792901990 /nfs/dbraw/zinc/90/19/90/792901990.db2.gz SELCONOWHPYALL-JNIYBQFBSA-N 2 0 357.432 -1.198 20 0 FAADRP COC(=O)[C@H]1SC[C@H](C(=O)OC)N1C(=O)[C@]12C[NH2+]C[C@H]1C[NH2+]CC2 ZINC001160494334 792902178 /nfs/dbraw/zinc/90/21/78/792902178.db2.gz SELCONOWHPYALL-UYUMYWFVSA-N 2 0 357.432 -1.198 20 0 FAADRP COC(=O)[C@H]1CS[C@@H](C(=O)OC)N1C(=O)[C@]12C[NH2+]C[C@H]1C[NH2+]CC2 ZINC001160494337 792902489 /nfs/dbraw/zinc/90/24/89/792902489.db2.gz SELCONOWHPYALL-YYHMBLRTSA-N 2 0 357.432 -1.198 20 0 FAADRP CS(=O)(=O)CCCN1CCN(C(=O)[C@]23C[NH2+]C[C@H]2C[NH2+]CC3)CC1 ZINC001160584240 792902460 /nfs/dbraw/zinc/90/24/60/792902460.db2.gz ANIANXLDEMUHDS-GDBMZVCRSA-N 2 0 358.508 -1.236 20 0 FAADRP CS(=O)(=O)CCCN1CCN(C(=O)[C@@H]([NH3+])CSCC[NH3+])CC1 ZINC001160584248 792902590 /nfs/dbraw/zinc/90/25/90/792902590.db2.gz ASFWNSOFXXPRSX-LBPRGKRZSA-N 2 0 352.526 -1.416 20 0 FAADRP C[NH+](C)CCCN(CCC[NH+](C)C)C(=O)CN(CC[NH3+])S(C)(=O)=O ZINC001160626881 792903461 /nfs/dbraw/zinc/90/34/61/792903461.db2.gz CAUHAJMPKIXIKY-UHFFFAOYSA-N 3 0 365.544 -1.061 20 0 FAADRP CC1([NH+]2CCOCC2)CCN(C(=O)CN(CC[NH3+])S(C)(=O)=O)CC1 ZINC001160669549 792904180 /nfs/dbraw/zinc/90/41/80/792904180.db2.gz IJSKLIPSYPXRNQ-UHFFFAOYSA-N 2 0 362.496 -1.080 20 0 FAADRP C[C@H](NC(=O)[C@@H]1CCCN1C(=O)C[NH3+])C(=O)N(C)CC[NH+]1CCCC1 ZINC001160687395 792904286 /nfs/dbraw/zinc/90/42/86/792904286.db2.gz DDYSEQSHRYWEMF-KBPBESRZSA-N 2 0 353.467 -1.005 20 0 FAADRP CN(CC[NH+]1CCCC1)C(=O)CNC(=O)CNC(=O)CNC(=O)C[NH3+] ZINC001160688343 792903940 /nfs/dbraw/zinc/90/39/40/792903940.db2.gz OETLAFSIVBXVJY-UHFFFAOYSA-N 2 0 356.427 -3.152 20 0 FAADRP CN(C[C@@H]1CCC[NH2+]C1)C(=O)CNC(=O)CNC(=O)CNC(=O)C[NH3+] ZINC001160695134 792904009 /nfs/dbraw/zinc/90/40/09/792904009.db2.gz IVDFWAOZJNHWIQ-LLVKDONJSA-N 2 0 356.427 -3.248 20 0 FAADRP CN(C[C@H]1CCC[NH2+]C1)C(=O)CNC(=O)CNC(=O)CNC(=O)C[NH3+] ZINC001160695136 792904165 /nfs/dbraw/zinc/90/41/65/792904165.db2.gz IVDFWAOZJNHWIQ-NSHDSACASA-N 2 0 356.427 -3.248 20 0 FAADRP C[C@H](NC(=O)[C@@H]1CCCN1C(=O)C[NH3+])C(=O)N(C)C[C@H]1CCC[NH2+]C1 ZINC001160698167 792904435 /nfs/dbraw/zinc/90/44/35/792904435.db2.gz GQBYOZZRVQKNHB-IHRRRGAJSA-N 2 0 353.467 -1.101 20 0 FAADRP C[C@H](NC(=O)[C@@H]1CCCN1C(=O)C[NH3+])C(=O)N(C)C[C@@H]1CCC[NH2+]C1 ZINC001160698168 792904417 /nfs/dbraw/zinc/90/44/17/792904417.db2.gz GQBYOZZRVQKNHB-MJBXVCDLSA-N 2 0 353.467 -1.101 20 0 FAADRP NC(=O)[C@@H]1CN(C(=O)[C@@H]2CCCN2C(=O)[C@@H]([NH3+])CCCC[NH3+])CCO1 ZINC001160703235 792903899 /nfs/dbraw/zinc/90/38/99/792903899.db2.gz AMBKEDUAPNNFCQ-AVGNSLFASA-N 2 0 355.439 -1.854 20 0 FAADRP NC(=O)[C@H]1CN(C(=O)[C@@H]2CCCN2C(=O)[C@@H]([NH3+])CCCC[NH3+])CCO1 ZINC001160703242 792904476 /nfs/dbraw/zinc/90/44/76/792904476.db2.gz AMBKEDUAPNNFCQ-RWMBFGLXSA-N 2 0 355.439 -1.854 20 0 FAADRP C[C@H](NC(=O)[C@@H]1CCCN1C(=O)C[NH3+])C(=O)N1C[C@@H]2C[N@@H+](C)C[C@@H]2C1 ZINC001160703794 792904540 /nfs/dbraw/zinc/90/45/40/792904540.db2.gz DVJQNWTZSBQMEV-FQUUOJAGSA-N 2 0 351.451 -1.539 20 0 FAADRP C[N@H+]1C[C@H]2CN(C(=O)CNC(=O)CNC(=O)CNC(=O)C[NH3+])C[C@H]2C1 ZINC001160705655 792905103 /nfs/dbraw/zinc/90/51/03/792905103.db2.gz ZCZNZCRSLOTSDU-PHIMTYICSA-N 2 0 354.411 -3.686 20 0 FAADRP [NH3+][C@H](CN1CCC([NH3+])CC1)C(=O)N1CCC2(CC1)CC(=O)NC(=O)C2 ZINC001160718892 792905028 /nfs/dbraw/zinc/90/50/28/792905028.db2.gz WUBDAPYZEKIWIE-CYBMUJFWSA-N 2 0 351.451 -1.218 20 0 FAADRP [NH3+][C@@H](CN1CCC([NH3+])CC1)C(=O)N1CCC2(CC1)CC(=O)NC(=O)C2 ZINC001160718893 792905709 /nfs/dbraw/zinc/90/57/09/792905709.db2.gz WUBDAPYZEKIWIE-ZDUSSCGKSA-N 2 0 351.451 -1.218 20 0 FAADRP [NH3+]CC(=O)NCC(=O)NCC(=O)NCC(=O)N1CC[NH+]2CCC1CC2 ZINC001160726624 792905599 /nfs/dbraw/zinc/90/55/99/792905599.db2.gz RJUMCLWLSGIZFV-UHFFFAOYSA-N 2 0 354.411 -3.400 20 0 FAADRP C[C@H](NC(=O)[C@@H]1CCCN1C(=O)C[NH3+])C(=O)N1CC[NH+]2CCC1CC2 ZINC001160726785 792905726 /nfs/dbraw/zinc/90/57/26/792905726.db2.gz UZCKYNIEACGHHU-JSGCOSHPSA-N 2 0 351.451 -1.253 20 0 FAADRP CCNC(=O)CO[C@@H]1CCCN(C(=O)[C@@H]([NH3+])CN2CCC([NH3+])CC2)C1 ZINC001160746183 792905019 /nfs/dbraw/zinc/90/50/19/792905019.db2.gz CIFCGDPYUNJFKR-CABCVRRESA-N 2 0 355.483 -1.120 20 0 FAADRP CCNC(=O)CO[C@H]1CCCN(C(=O)[C@@H]([NH3+])CN2CCC([NH3+])CC2)C1 ZINC001160746184 792905001 /nfs/dbraw/zinc/90/50/01/792905001.db2.gz CIFCGDPYUNJFKR-GJZGRUSLSA-N 2 0 355.483 -1.120 20 0 FAADRP CCNC(=O)CO[C@@H]1CCCN(C(=O)[C@H]([NH3+])CN2CCC([NH3+])CC2)C1 ZINC001160746185 792905910 /nfs/dbraw/zinc/90/59/10/792905910.db2.gz CIFCGDPYUNJFKR-HUUCEWRRSA-N 2 0 355.483 -1.120 20 0 FAADRP CCNC(=O)CO[C@H]1CCCN(C(=O)[C@H]([NH3+])CN2CCC([NH3+])CC2)C1 ZINC001160746186 792905470 /nfs/dbraw/zinc/90/54/70/792905470.db2.gz CIFCGDPYUNJFKR-LSDHHAIUSA-N 2 0 355.483 -1.120 20 0 FAADRP COC(=O)[C@H]1CCS(=O)(=O)C12CN(C(=O)[C@]13C[NH2+]C[C@H]1C[NH2+]CC3)C2 ZINC001160772263 792905036 /nfs/dbraw/zinc/90/50/36/792905036.db2.gz QFDGZUQBWLFWMN-LALPHHSUSA-N 2 0 371.459 -1.626 20 0 FAADRP COC(=O)[C@@H]1CCS(=O)(=O)C12CN(C(=O)[C@]13C[NH2+]C[C@H]1C[NH2+]CC3)C2 ZINC001160772269 792905777 /nfs/dbraw/zinc/90/57/77/792905777.db2.gz QFDGZUQBWLFWMN-TYNCELHUSA-N 2 0 371.459 -1.626 20 0 FAADRP COC(=O)[C@H]1CCS(=O)(=O)C12CN(C(=O)[C@H]1C[NH2+]CC13C[NH2+]C3)C2 ZINC001160772433 792905639 /nfs/dbraw/zinc/90/56/39/792905639.db2.gz RSUGFTBIMXLGJD-GHMZBOCLSA-N 2 0 357.432 -2.016 20 0 FAADRP COC(=O)[C@H]1CCS(=O)(=O)C12CN(C(=O)[C@@H]1C[NH2+]CC13C[NH2+]C3)C2 ZINC001160772437 792905619 /nfs/dbraw/zinc/90/56/19/792905619.db2.gz RSUGFTBIMXLGJD-MNOVXSKESA-N 2 0 357.432 -2.016 20 0 FAADRP COC(=O)[C@@H]1CCS(=O)(=O)C12CN(C(=O)[C@@H]1C[NH2+]CC13C[NH2+]C3)C2 ZINC001160772440 792906834 /nfs/dbraw/zinc/90/68/34/792906834.db2.gz RSUGFTBIMXLGJD-QWRGUYRKSA-N 2 0 357.432 -2.016 20 0 FAADRP COC(=O)[C@@H]1CCS(=O)(=O)C12CN(C(=O)[C@H]1C[NH2+]CC13C[NH2+]C3)C2 ZINC001160772442 792906847 /nfs/dbraw/zinc/90/68/47/792906847.db2.gz RSUGFTBIMXLGJD-WDEREUQCSA-N 2 0 357.432 -2.016 20 0 FAADRP C[NH2+][C@@H](CCCC[NH3+])C(=O)N1CC2(C1)[C@@H](C(=O)OC)CCS2(=O)=O ZINC001160772803 792906600 /nfs/dbraw/zinc/90/66/00/792906600.db2.gz XMITURJILQQEDG-NEPJUHHUSA-N 2 0 361.464 -1.108 20 0 FAADRP C[NH2+][C@@H](CCCC[NH3+])C(=O)N1CC2(C1)[C@H](C(=O)OC)CCS2(=O)=O ZINC001160772807 792906501 /nfs/dbraw/zinc/90/65/01/792906501.db2.gz XMITURJILQQEDG-RYUDHWBXSA-N 2 0 361.464 -1.108 20 0 FAADRP COC(=O)[C@@H]1CCS(=O)(=O)C12CN(C(=O)[C@@H]([NH3+])CSCC[NH3+])C2 ZINC001160774068 792906282 /nfs/dbraw/zinc/90/62/82/792906282.db2.gz PDDWNDGBRJCIKA-UWVGGRQHSA-N 2 0 365.477 -1.806 20 0 FAADRP COC(=O)[C@H]1CCS(=O)(=O)C12CN(C(=O)[C@@H]([NH3+])CSCC[NH3+])C2 ZINC001160774069 792906578 /nfs/dbraw/zinc/90/65/78/792906578.db2.gz PDDWNDGBRJCIKA-ZJUUUORDSA-N 2 0 365.477 -1.806 20 0 FAADRP COC(=O)[C@H]1CCS(=O)(=O)C12CN(C(=O)[C@@H]([NH3+])C1CC[NH2+]CC1)C2 ZINC001160774488 792906659 /nfs/dbraw/zinc/90/66/59/792906659.db2.gz UPFOQIZSZKKZCN-NEPJUHHUSA-N 2 0 359.448 -1.498 20 0 FAADRP COC(=O)[C@@H]1CCS(=O)(=O)C12CN(C(=O)[C@H]([NH3+])C1CC[NH2+]CC1)C2 ZINC001160774489 792906376 /nfs/dbraw/zinc/90/63/76/792906376.db2.gz UPFOQIZSZKKZCN-NWDGAFQWSA-N 2 0 359.448 -1.498 20 0 FAADRP COC(=O)[C@@H]1CCS(=O)(=O)C12CN(C(=O)[C@@H]([NH3+])C1CC[NH2+]CC1)C2 ZINC001160774490 792906302 /nfs/dbraw/zinc/90/63/02/792906302.db2.gz UPFOQIZSZKKZCN-RYUDHWBXSA-N 2 0 359.448 -1.498 20 0 FAADRP COC(=O)[C@H]1CCS(=O)(=O)C12CN(C(=O)[C@H]([NH3+])C1CC[NH2+]CC1)C2 ZINC001160774491 792906781 /nfs/dbraw/zinc/90/67/81/792906781.db2.gz UPFOQIZSZKKZCN-VXGBXAGGSA-N 2 0 359.448 -1.498 20 0 FAADRP COC(=O)[C@@]12C[NH2+]C[C@@H]1[C@H]1CN(C(=O)COCCOCC[NH3+])C[C@H]1C2 ZINC001160792840 792906645 /nfs/dbraw/zinc/90/66/45/792906645.db2.gz XSTXCLVYRDHUQH-OEUWWYETSA-N 2 0 355.435 -1.165 20 0 FAADRP COC(=O)[C@@]12C[NH2+]C[C@@H]1[C@H]1CN(C(=O)/C=C/C(=O)NCC[NH3+])C[C@H]1C2 ZINC001160793013 792906525 /nfs/dbraw/zinc/90/65/25/792906525.db2.gz ZIORVVROUBTELX-CLMYJEHCSA-N 2 0 350.419 -1.525 20 0 FAADRP COC(=O)[C@@]12C[NH2+]C[C@@H]1[C@H]1CN(C(=O)[C@H](C)NC(=O)[C@H](C)[NH3+])C[C@H]1C2 ZINC001160793768 792906612 /nfs/dbraw/zinc/90/66/12/792906612.db2.gz GNAHFBYWTFVSLS-XHBFJLKOSA-N 2 0 352.435 -1.305 20 0 FAADRP COC(=O)[C@@]12C[NH2+]C[C@@H]1[C@H]1CN(C(=O)C[C@@H]([NH3+])CCC(N)=O)C[C@H]1C2 ZINC001160794158 792906727 /nfs/dbraw/zinc/90/67/27/792906727.db2.gz LUAUHVKISSWAIA-XWNMQXIPSA-N 2 0 352.435 -1.174 20 0 FAADRP COC(=O)[C@@]12C[NH2+]C[C@@H]1[C@H]1CN(C(=O)[C@@H]([NH3+])CC[S@](C)=O)C[C@H]1C2 ZINC001160795794 792907314 /nfs/dbraw/zinc/90/73/14/792907314.db2.gz ZKTACKJFRYJJSR-PHPCDAJSSA-N 2 0 357.476 -1.061 20 0 FAADRP COC(=O)[C@@]12C[NH2+]C[C@@H]1[C@H]1CN(C(=O)[C@@H]([NH3+])CC[S@@](C)=O)C[C@H]1C2 ZINC001160795797 792907444 /nfs/dbraw/zinc/90/74/44/792907444.db2.gz ZKTACKJFRYJJSR-PLAHREOVSA-N 2 0 357.476 -1.061 20 0 FAADRP COC(=O)[C@@]12C[NH2+]C[C@@H]1[C@H]1CN(C(=O)[C@@H]([NH3+])CSCC[NH3+])C[C@H]1C2 ZINC001160797657 792907652 /nfs/dbraw/zinc/90/76/52/792907652.db2.gz RCGNCXIAPTUOQJ-CRQFQMBKSA-N 3 0 356.492 -1.137 20 0 FAADRP CCOC(=O)[C@]12CN(C(=O)[C@@H]([NH3+])CCCNC(N)=O)C[C@H]1C[NH2+]CC2 ZINC001160811186 792907738 /nfs/dbraw/zinc/90/77/38/792907738.db2.gz MPDXTGRYUHAMHF-BFQNTYOBSA-N 2 0 355.439 -1.237 20 0 FAADRP CCOC(=O)[C@]12CN(C(=O)[C@H]([NH3+])CCCNC(N)=O)C[C@H]1C[NH2+]CC2 ZINC001160811187 792907803 /nfs/dbraw/zinc/90/78/03/792907803.db2.gz MPDXTGRYUHAMHF-XHBSWPGZSA-N 2 0 355.439 -1.237 20 0 FAADRP CCOC(=O)[C@]12CN(C(=O)[C@@H]3COC4(C[NH2+]C4)CN3)C[C@H]1C[NH2+]CC2 ZINC001160811313 792907381 /nfs/dbraw/zinc/90/73/81/792907381.db2.gz NJLQGCCEUDIWOY-IIYDPXPESA-N 2 0 352.435 -1.682 20 0 FAADRP CCOC(=O)[C@]12CN(C(=O)[C@H]3COC4(C[NH2+]C4)CN3)C[C@H]1C[NH2+]CC2 ZINC001160811314 792907356 /nfs/dbraw/zinc/90/73/56/792907356.db2.gz NJLQGCCEUDIWOY-PBFPGSCMSA-N 2 0 352.435 -1.682 20 0 FAADRP CCOC(=O)[C@]12CN(C(=O)[C@@H]3NC(=O)CC34C[NH2+]C4)C[C@H]1C[NH2+]CC2 ZINC001160811677 792907833 /nfs/dbraw/zinc/90/78/33/792907833.db2.gz TVFREHXKDCAOEV-BTJLNZGRSA-N 2 0 350.419 -1.534 20 0 FAADRP CCOC(=O)[C@]12CN(C(=O)[C@H]3NC(=O)CC34C[NH2+]C4)C[C@H]1C[NH2+]CC2 ZINC001160811678 792907458 /nfs/dbraw/zinc/90/74/58/792907458.db2.gz TVFREHXKDCAOEV-CJBNDPTMSA-N 2 0 350.419 -1.534 20 0 FAADRP CCOC(=O)[C@]12CN(C(=O)[C@@H]3CCCN3C(=O)C[NH3+])C[C@H]1C[NH2+]CC2 ZINC001160812688 792907670 /nfs/dbraw/zinc/90/76/70/792907670.db2.gz RKADIVKNFVVRCU-IIYDPXPESA-N 2 0 352.435 -1.063 20 0 FAADRP CCOC(=O)[C@]12CN(C(=O)CNC(=O)[C@@H]3CCC[NH2+]3)C[C@H]1C[NH2+]CC2 ZINC001160814334 792907845 /nfs/dbraw/zinc/90/78/45/792907845.db2.gz ZUWSZDCATQYREL-IIYDPXPESA-N 2 0 352.435 -1.144 20 0 FAADRP C[C@@H]1CN(C)C[C@H](C(=O)NCCC[NH2+]CCN(C)S(C)(=O)=O)O1 ZINC001160850527 792907481 /nfs/dbraw/zinc/90/74/81/792907481.db2.gz ABFFOZUIJNLRFJ-CHWSQXEVSA-N 2 0 350.485 -1.307 20 0 FAADRP C[C@@H]1CN(C)C[C@H](C(=O)NCCC[NH2+]C[C@H](O)CN2CCCC2=O)O1 ZINC001160851289 792907751 /nfs/dbraw/zinc/90/77/51/792907751.db2.gz VYWTULJNIKGVPY-QLFBSQMISA-N 2 0 356.467 -1.215 20 0 FAADRP CCS(=O)(=O)NCC[NH2+]CCCNC(=O)[C@H]1CN(C)C[C@@H](C)O1 ZINC001160857570 792907781 /nfs/dbraw/zinc/90/77/81/792907781.db2.gz LAFCOVPNBHGLMB-CHWSQXEVSA-N 2 0 350.485 -1.259 20 0 FAADRP C[C@@H]1CN(C)C[C@H](C(=O)NCCC[NH2+]CCCN2C(=O)CNC2=O)O1 ZINC001160857597 792907894 /nfs/dbraw/zinc/90/78/94/792907894.db2.gz MFAVZLGWIYTRLO-CHWSQXEVSA-N 2 0 355.439 -1.257 20 0 FAADRP C[C@@H]1CN(C)C[C@H](C(=O)NCCC[NH2+]CC(=O)NC[C@@H]2CCOC2)O1 ZINC001160858122 792907855 /nfs/dbraw/zinc/90/78/55/792907855.db2.gz WRYWCIOYZDDDIY-QLFBSQMISA-N 2 0 356.467 -1.046 20 0 FAADRP C[C@@H]1CN(C)C[C@H](C(=O)NCCC[NH2+]CC(=O)NC[C@H]2CCOC2)O1 ZINC001160858123 792907552 /nfs/dbraw/zinc/90/75/52/792907552.db2.gz WRYWCIOYZDDDIY-RBSFLKMASA-N 2 0 356.467 -1.046 20 0 FAADRP C[C@@H]1CN(C)C[C@H](C(=O)NCCC[NH2+]CC(=O)N2CCNC(=O)C2)O1 ZINC001160861912 792907722 /nfs/dbraw/zinc/90/77/22/792907722.db2.gz AIRZIDOGVBFCGK-CHWSQXEVSA-N 2 0 355.439 -2.240 20 0 FAADRP C[C@@H]1CN(C)C[C@H](C(=O)NCCC[NH2+]CC(=O)NC(=O)NC2CC2)O1 ZINC001160861961 792907583 /nfs/dbraw/zinc/90/75/83/792907583.db2.gz DDIAWKDVIKERGG-DGCLKSJQSA-N 2 0 355.439 -1.210 20 0 FAADRP C[C@@H]1CN(C)C[C@H](C(=O)NCCC[NH2+]CCN2CCCS2(=O)=O)O1 ZINC001160862559 792907870 /nfs/dbraw/zinc/90/78/70/792907870.db2.gz RDWHJXKLQUQPKA-ZIAGYGMSSA-N 2 0 362.496 -1.163 20 0 FAADRP COC(=O)c1cn2c(n1)CN(C(=O)[C@H]([NH3+])CN1CCC([NH3+])CC1)CC2 ZINC001160903776 792908401 /nfs/dbraw/zinc/90/84/01/792908401.db2.gz BSMCFQNURYWPOI-GFCCVEGCSA-N 2 0 350.423 -1.238 20 0 FAADRP COC(=O)c1cn2c(n1)CN(C(=O)[C@@H]([NH3+])CN1CCC([NH3+])CC1)CC2 ZINC001160903777 792908510 /nfs/dbraw/zinc/90/85/10/792908510.db2.gz 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O=C([C@H]1C[NH2+]CC12C[NH2+]C2)N1CC[C@@H](NS(=O)(=O)c2ccccn2)C1 ZINC001161067900 792908637 /nfs/dbraw/zinc/90/86/37/792908637.db2.gz MBXRZKQTXMHUSL-CHWSQXEVSA-N 2 0 365.459 -1.230 20 0 FAADRP O=C([C@@H]1C[NH2+]CC12C[NH2+]C2)N1CC[C@@H](NS(=O)(=O)c2ccccn2)C1 ZINC001161067902 792908567 /nfs/dbraw/zinc/90/85/67/792908567.db2.gz MBXRZKQTXMHUSL-OLZOCXBDSA-N 2 0 365.459 -1.230 20 0 FAADRP O=C([C@H]1C[NH2+]CC12C[NH2+]C2)N1CC[C@H](NS(=O)(=O)c2ccccn2)C1 ZINC001161067904 792908546 /nfs/dbraw/zinc/90/85/46/792908546.db2.gz MBXRZKQTXMHUSL-QWHCGFSZSA-N 2 0 365.459 -1.230 20 0 FAADRP O=C([C@@H]1C[NH2+]CC12C[NH2+]C2)N1CC[C@H](NS(=O)(=O)c2ccccn2)C1 ZINC001161067907 792908716 /nfs/dbraw/zinc/90/87/16/792908716.db2.gz MBXRZKQTXMHUSL-STQMWFEESA-N 2 0 365.459 -1.230 20 0 FAADRP CN(C(=O)CNC(=O)CNC(=O)CNC(=O)C[NH3+])C1(C)CC[NH2+]CC1 ZINC001161074273 792909571 /nfs/dbraw/zinc/90/95/71/792909571.db2.gz XTQNDVDBDHKMRK-UHFFFAOYSA-N 2 0 356.427 -3.106 20 0 FAADRP CCOC(=O)CN(CCC[NH3+])C(=O)CC[C@@H](NC(=O)[C@H](C)[NH3+])C(N)=O ZINC001161158208 792910053 /nfs/dbraw/zinc/91/00/53/792910053.db2.gz ATYZDCZTADZPJN-WDEREUQCSA-N 2 0 359.427 -2.176 20 0 FAADRP CCOC(=O)CN(CCC[NH3+])C(=O)CNC(=O)[C@@H]([NH3+])COC(C)(C)C ZINC001161159151 792909845 /nfs/dbraw/zinc/90/98/45/792909845.db2.gz WMSQAWQMACCFFZ-LBPRGKRZSA-N 2 0 360.455 -1.015 20 0 FAADRP CC(C)(O)CC[NH+]1CCN(C(=O)CN(CC[NH3+])S(C)(=O)=O)CC1 ZINC001161174670 792909742 /nfs/dbraw/zinc/90/97/42/792909742.db2.gz CDGOJJMUUUVPPX-UHFFFAOYSA-N 2 0 350.485 -1.488 20 0 FAADRP C[C@H]([NH3+])C(=O)N[C@@H](CC(N)=O)C(=O)N1CC[NH+](CCC(C)(C)O)CC1 ZINC001161176878 792910016 /nfs/dbraw/zinc/91/00/16/792910016.db2.gz WZQORYDDFKUKLX-RYUDHWBXSA-N 2 0 357.455 -2.001 20 0 FAADRP [NH3+]CC(=O)NCC(=O)N(CCCN1CCOCC1)CC1CC[NH2+]CC1 ZINC001161196165 792909755 /nfs/dbraw/zinc/90/97/55/792909755.db2.gz AAKYXRUMOFFDKU-UHFFFAOYSA-N 2 0 355.483 -1.388 20 0 FAADRP C[C@H]([NH3+])C(=O)N[C@@H](CC(N)=O)C(=O)N1CCC(C2CC[NH2+]CC2)CC1 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351.451 -1.364 20 0 FAADRP C[C@H](NC(=O)[C@@H]1CCCN1C(=O)C[NH3+])C(=O)N1C[C@@H]2CC[C@@H]([NH3+])[C@H]2C1 ZINC001161411925 792913303 /nfs/dbraw/zinc/91/33/03/792913303.db2.gz CMNIANQMZHRESR-YHQUGGNUSA-N 2 0 351.451 -1.364 20 0 FAADRP [NH3+]CC(=O)NCC(=O)NCC(=O)NCC(=O)N1C[C@@H]2CC[C@H]([NH3+])[C@@H]2C1 ZINC001161412162 792913325 /nfs/dbraw/zinc/91/33/25/792913325.db2.gz HBJAKPNLRLPNIW-AXFHLTTASA-N 2 0 354.411 -3.511 20 0 FAADRP [NH3+]CC(=O)NCC(=O)NCC(=O)NCC(=O)N1C[C@@H]2CC[C@H]([NH3+])[C@H]2C1 ZINC001161412163 792913483 /nfs/dbraw/zinc/91/34/83/792913483.db2.gz HBJAKPNLRLPNIW-DCAQKATOSA-N 2 0 354.411 -3.511 20 0 FAADRP [NH3+]CC(=O)NCC(=O)NCC(=O)NCC(=O)N1C[C@@H]2CC[C@@H]([NH3+])[C@H]2C1 ZINC001161412164 792913409 /nfs/dbraw/zinc/91/34/09/792913409.db2.gz HBJAKPNLRLPNIW-GARJFASQSA-N 2 0 354.411 -3.511 20 0 FAADRP [NH3+]CC(=O)NCC(=O)NCC(=O)NCC(=O)N1C[C@@H]2CC[C@@H]([NH3+])[C@@H]2C1 ZINC001161412165 792912671 /nfs/dbraw/zinc/91/26/71/792912671.db2.gz HBJAKPNLRLPNIW-HBNTYKKESA-N 2 0 354.411 -3.511 20 0 FAADRP CN(C)CCN(C(=O)[C@@H]1CCS(=O)(=O)C12C[NH2+]C2)[C@H]1CCC[NH2+]C1 ZINC001161447144 792912617 /nfs/dbraw/zinc/91/26/17/792912617.db2.gz VTJOUPJDMUALHT-KBPBESRZSA-N 2 0 358.508 -1.095 20 0 FAADRP CN(C)CCN(C(=O)[C@@H]1CCS(=O)(=O)C12C[NH2+]C2)[C@@H]1CCC[NH2+]C1 ZINC001161447147 792913133 /nfs/dbraw/zinc/91/31/33/792913133.db2.gz VTJOUPJDMUALHT-KGLIPLIRSA-N 2 0 358.508 -1.095 20 0 FAADRP CN(C)CCN(C(=O)[C@H]1CCS(=O)(=O)C12C[NH2+]C2)[C@H]1CCC[NH2+]C1 ZINC001161447150 792913109 /nfs/dbraw/zinc/91/31/09/792913109.db2.gz VTJOUPJDMUALHT-UONOGXRCSA-N 2 0 358.508 -1.095 20 0 FAADRP CN(C)CCN(C(=O)[C@H]1CCS(=O)(=O)C12C[NH2+]C2)[C@@H]1CCC[NH2+]C1 ZINC001161447153 792912750 /nfs/dbraw/zinc/91/27/50/792912750.db2.gz VTJOUPJDMUALHT-ZIAGYGMSSA-N 2 0 358.508 -1.095 20 0 FAADRP C[C@H]([NH3+])C(=O)N[C@@H](CC(N)=O)C(=O)N(CC[NH+](C)C)[C@H]1CCC[NH2+]C1 ZINC001161449054 792913450 /nfs/dbraw/zinc/91/34/50/792913450.db2.gz JKOWPAVAFRGQQA-AVGNSLFASA-N 3 0 356.471 -2.164 20 0 FAADRP C[C@H]([NH3+])C(=O)N[C@@H](CC(N)=O)C(=O)N(CC[NH+](C)C)[C@@H]1CCC[NH2+]C1 ZINC001161449057 792913374 /nfs/dbraw/zinc/91/33/74/792913374.db2.gz JKOWPAVAFRGQQA-XQQFMLRXSA-N 3 0 356.471 -2.164 20 0 FAADRP COC(=O)[C@]12CC[NH2+][C@H]1CN(C(=O)[C@@H]1CCS(=O)(=O)C13C[NH2+]C3)CC2 ZINC001161476556 792912888 /nfs/dbraw/zinc/91/28/88/792912888.db2.gz DJYZXZJHHVXJII-HUBLWGQQSA-N 2 0 371.459 -1.483 20 0 FAADRP COC(=O)[C@]12CC[NH2+][C@@H]1CN(C(=O)[C@H]1CCS(=O)(=O)C13C[NH2+]C3)CC2 ZINC001161476557 792913234 /nfs/dbraw/zinc/91/32/34/792913234.db2.gz DJYZXZJHHVXJII-JMSVASOKSA-N 2 0 371.459 -1.483 20 0 FAADRP COC(=O)[C@]12CC[NH2+][C@H]1CN(C(=O)[C@H]1CCS(=O)(=O)C13C[NH2+]C3)CC2 ZINC001161476558 792913076 /nfs/dbraw/zinc/91/30/76/792913076.db2.gz DJYZXZJHHVXJII-XUJVJEKNSA-N 2 0 371.459 -1.483 20 0 FAADRP COC(=O)[C@]12CC[NH2+][C@@H]1CN(C(=O)[C@@H]1CCS(=O)(=O)C13C[NH2+]C3)CC2 ZINC001161476559 792913059 /nfs/dbraw/zinc/91/30/59/792913059.db2.gz DJYZXZJHHVXJII-ZOWXZIJZSA-N 2 0 371.459 -1.483 20 0 FAADRP COC(=O)[C@]12CC[NH2+][C@@H]1CN(C(=O)[C@H]([NH3+])CN1CCC([NH3+])CC1)CC2 ZINC001161476932 792912798 /nfs/dbraw/zinc/91/27/98/792912798.db2.gz CRIHRQMTHYSODE-CPUCHLNUSA-N 3 0 353.467 -1.510 20 0 FAADRP COC(=O)[C@]12CC[NH2+][C@H]1CN(C(=O)[C@H]([NH3+])CN1CCC([NH3+])CC1)CC2 ZINC001161476933 792913287 /nfs/dbraw/zinc/91/32/87/792913287.db2.gz CRIHRQMTHYSODE-KEYYUXOJSA-N 3 0 353.467 -1.510 20 0 FAADRP COC(=O)[C@]12CC[NH2+][C@@H]1CN(C(=O)[C@@H]([NH3+])CN1CCC([NH3+])CC1)CC2 ZINC001161476934 792912982 /nfs/dbraw/zinc/91/29/82/792912982.db2.gz CRIHRQMTHYSODE-VBQJREDUSA-N 3 0 353.467 -1.510 20 0 FAADRP COC(=O)[C@]12CC[NH2+][C@H]1CN(C(=O)[C@@H]([NH3+])CN1CCC([NH3+])CC1)CC2 ZINC001161476935 792913200 /nfs/dbraw/zinc/91/32/00/792913200.db2.gz CRIHRQMTHYSODE-ZQIUZPCESA-N 3 0 353.467 -1.510 20 0 FAADRP COC(=O)[C@@]12CC[NH2+][C@@H]1CN(C(=O)CN(CC[NH3+])S(C)(=O)=O)CC2 ZINC001161479184 792913025 /nfs/dbraw/zinc/91/30/25/792913025.db2.gz OYWGHNSHRYRWMK-BXUZGUMPSA-N 2 0 362.452 -2.040 20 0 FAADRP COC(=O)[C@]12CC[NH2+][C@H]1CN(C(=O)CN(CC[NH3+])S(C)(=O)=O)CC2 ZINC001161479185 792913298 /nfs/dbraw/zinc/91/32/98/792913298.db2.gz OYWGHNSHRYRWMK-FZMZJTMJSA-N 2 0 362.452 -2.040 20 0 FAADRP COC(=O)[C@]12CC[NH2+][C@@H]1CN(C(=O)CN(CC[NH3+])S(C)(=O)=O)CC2 ZINC001161479186 792913158 /nfs/dbraw/zinc/91/31/58/792913158.db2.gz OYWGHNSHRYRWMK-RISCZKNCSA-N 2 0 362.452 -2.040 20 0 FAADRP COC(=O)[C@@]12CC[NH2+][C@H]1CN(C(=O)CN(CC[NH3+])S(C)(=O)=O)CC2 ZINC001161479187 792913219 /nfs/dbraw/zinc/91/32/19/792913219.db2.gz OYWGHNSHRYRWMK-SMDDNHRTSA-N 2 0 362.452 -2.040 20 0 FAADRP COC(=O)[C@]12CC[NH2+][C@H]1CN(C(=O)[C@@H]([NH3+])CSCNC(C)=O)CC2 ZINC001161480458 792913092 /nfs/dbraw/zinc/91/30/92/792913092.db2.gz UHBUGMHFUZRVBS-HUBLWGQQSA-N 2 0 358.464 -1.106 20 0 FAADRP COC(=O)[C@@]12CC[NH2+][C@H]1CN(C(=O)[C@@H]([NH3+])CSCNC(C)=O)CC2 ZINC001161480459 792913471 /nfs/dbraw/zinc/91/34/71/792913471.db2.gz UHBUGMHFUZRVBS-SLEUVZQESA-N 2 0 358.464 -1.106 20 0 FAADRP COC(=O)[C@@]12CC[NH2+][C@@H]1CN(C(=O)[C@@H]([NH3+])CSCNC(C)=O)CC2 ZINC001161480461 792912954 /nfs/dbraw/zinc/91/29/54/792912954.db2.gz UHBUGMHFUZRVBS-YWPYICTPSA-N 2 0 358.464 -1.106 20 0 FAADRP COC(=O)[C@]12CC[NH2+][C@@H]1CN(C(=O)[C@@H]([NH3+])CSCNC(C)=O)CC2 ZINC001161480463 792913456 /nfs/dbraw/zinc/91/34/56/792913456.db2.gz UHBUGMHFUZRVBS-ZOWXZIJZSA-N 2 0 358.464 -1.106 20 0 FAADRP C[C@@]1(C[NH3+])CCCN(C(=O)CNC(=O)CNC(=O)CNC(=O)C[NH3+])C1 ZINC001161490247 792912907 /nfs/dbraw/zinc/91/29/07/792912907.db2.gz WAVVKCQGYXGNIJ-HNNXBMFYSA-N 2 0 356.427 -3.119 20 0 FAADRP C[C@]1(C[NH3+])CCCN(C(=O)CNC(=O)CNC(=O)CNC(=O)C[NH3+])C1 ZINC001161490248 792913039 /nfs/dbraw/zinc/91/30/39/792913039.db2.gz WAVVKCQGYXGNIJ-OAHLLOKOSA-N 2 0 356.427 -3.119 20 0 FAADRP CC(=O)N1CC2(C1)CN(C(=O)[C@@H]([NH3+])CSCC[NH3+])C[C@@H]2C(=O)N(C)C ZINC001161506538 792913851 /nfs/dbraw/zinc/91/38/51/792913851.db2.gz KQDKCVOBECGQJA-OLZOCXBDSA-N 2 0 371.507 -1.599 20 0 FAADRP CC(=O)N1CC2(C1)CN(C(=O)[C@@H]([NH3+])CSCC[NH3+])C[C@H]2C(=O)N(C)C ZINC001161506539 792914054 /nfs/dbraw/zinc/91/40/54/792914054.db2.gz KQDKCVOBECGQJA-STQMWFEESA-N 2 0 371.507 -1.599 20 0 FAADRP CC(=O)N1CC2(C1)CN(C(=O)[C@@H]([NH3+])CCCC[NH3+])C[C@H]2C(=O)N(C)C ZINC001161508104 792914433 /nfs/dbraw/zinc/91/44/33/792914433.db2.gz WTIWKDFJFGAVOQ-KBPBESRZSA-N 2 0 353.467 -1.162 20 0 FAADRP CC(=O)N1CC2(C1)CN(C(=O)[C@@H]([NH3+])CCCC[NH3+])C[C@@H]2C(=O)N(C)C ZINC001161508105 792913960 /nfs/dbraw/zinc/91/39/60/792913960.db2.gz WTIWKDFJFGAVOQ-KGLIPLIRSA-N 2 0 353.467 -1.162 20 0 FAADRP C[C@H](NC(=O)[C@@H]1CCCN1C(=O)C[NH3+])C(=O)N1C[C@@H]([NH3+])C2(COC2)C1 ZINC001161508257 792914136 /nfs/dbraw/zinc/91/41/36/792914136.db2.gz CNAIAYPCVKWNIZ-SDDRHHMPSA-N 2 0 353.423 -2.373 20 0 FAADRP C[C@H](NC(=O)[C@@H]1CCCN1C(=O)C[NH3+])C(=O)N1C[C@H]([NH3+])C2(COC2)C1 ZINC001161508259 792913824 /nfs/dbraw/zinc/91/38/24/792913824.db2.gz CNAIAYPCVKWNIZ-SRVKXCTJSA-N 2 0 353.423 -2.373 20 0 FAADRP [NH3+]CCCC[C@H]([NH3+])C(=O)N1CCC[C@H]1C(=O)N1C[C@H]([NH3+])C2(COC2)C1 ZINC001161510788 792914294 /nfs/dbraw/zinc/91/42/94/792914294.db2.gz RFNZZKKKEGTNIE-IHRRRGAJSA-N 3 0 353.467 -1.380 20 0 FAADRP [NH3+]CCCC[C@H]([NH3+])C(=O)N1CCC[C@H]1C(=O)N1C[C@@H]([NH3+])C2(COC2)C1 ZINC001161510789 792913881 /nfs/dbraw/zinc/91/38/81/792913881.db2.gz RFNZZKKKEGTNIE-MELADBBJSA-N 3 0 353.467 -1.380 20 0 FAADRP [NH3+]CC(=O)NCC(=O)NCC(=O)NCC(=O)N1C[C@@H]([NH3+])C2(COC2)C1 ZINC001161511335 792914074 /nfs/dbraw/zinc/91/40/74/792914074.db2.gz YSJKJQYFRYFIDC-SECBINFHSA-N 2 0 356.383 -4.520 20 0 FAADRP [NH3+]CC(=O)NCC(=O)NCC(=O)NCC(=O)N1C[C@H]([NH3+])C2(COC2)C1 ZINC001161511336 792914239 /nfs/dbraw/zinc/91/42/39/792914239.db2.gz YSJKJQYFRYFIDC-VIFPVBQESA-N 2 0 356.383 -4.520 20 0 FAADRP C[C@@H]1C[C@H]([NH3+])CN1C(=O)[C@H](CO)NC(=O)[C@@H]([NH3+])Cc1ccc(O)cc1 ZINC001161529465 792914353 /nfs/dbraw/zinc/91/43/53/792914353.db2.gz DHHHXUNCQFAAHB-WCUVEOEZSA-N 2 0 350.419 -1.313 20 0 FAADRP CS(=O)(=O)c1nc2c(c(N3CCN4CC[NH2+]C[C@@H]4C3)n1)CC[NH2+]CC2 ZINC001164392067 718828811 /nfs/dbraw/zinc/82/88/11/718828811.db2.gz MTFWGFOZOGVRGL-GFCCVEGCSA-N 2 0 366.491 -1.338 20 0 FAADRP CS(=O)(=O)c1nc2c(c(N3CCN4CC[NH2+]C[C@H]4C3)n1)CC[NH2+]CC2 ZINC001164392072 718828668 /nfs/dbraw/zinc/82/86/68/718828668.db2.gz MTFWGFOZOGVRGL-LBPRGKRZSA-N 2 0 366.491 -1.338 20 0 FAADRP CS(=O)(=O)c1nc2c(c(N3C[C@H]4C[NH2+]C[C@@]4(CO)C3)n1)CC[NH2+]CC2 ZINC001165282205 792922261 /nfs/dbraw/zinc/92/22/61/792922261.db2.gz TZUODPDLCCCRAM-BZNIZROVSA-N 2 0 367.475 -1.414 20 0 FAADRP CS(=O)(=O)c1nc2c(c(N3CCOCC34C[NH2+]C4)n1)CC[NH2+]CC2 ZINC001165287756 790580954 /nfs/dbraw/zinc/58/09/54/790580954.db2.gz RBSRAGWEPPYZTE-UHFFFAOYSA-N 2 0 353.448 -1.253 20 0 FAADRP CS(=O)(=O)c1nc2c(c(N3CCNC(=O)C34C[NH2+]C4)n1)CC[NH2+]CC2 ZINC001165298024 792923099 /nfs/dbraw/zinc/92/30/99/792923099.db2.gz OXVPAQWKSUEYII-UHFFFAOYSA-N 2 0 366.447 -2.154 20 0 FAADRP COC(=O)[C@H]1C[NH2+]CCN1c1nc(S(C)(=O)=O)nc2c1CC[NH2+]CC2 ZINC001165435638 792922853 /nfs/dbraw/zinc/92/28/53/792922853.db2.gz DKVALKBWMUJJSC-GFCCVEGCSA-N 2 0 369.447 -1.481 20 0 FAADRP COC(=O)[C@@H]1C[NH2+]CCN1c1nc(S(C)(=O)=O)nc2c1CC[NH2+]CC2 ZINC001165435650 792922304 /nfs/dbraw/zinc/92/23/04/792922304.db2.gz DKVALKBWMUJJSC-LBPRGKRZSA-N 2 0 369.447 -1.481 20 0 FAADRP [NH3+][C@H]1CN(c2nc(N3CCOCC3)nc(N3CCOCC3)n2)C[C@H]1O ZINC001167090350 789650555 /nfs/dbraw/zinc/65/05/55/789650555.db2.gz OUVHMWZJTIUGJJ-NWDGAFQWSA-N 2 0 351.411 -1.947 20 0 FAADRP CS(=O)(=O)c1nc2c(c(N3C[C@H]4COC[C@@H](C3)C4[NH3+])n1)CC[NH2+]CC2 ZINC001167184649 789650872 /nfs/dbraw/zinc/65/08/72/789650872.db2.gz YTOWVHFLOZKDRH-BVUQATHDSA-N 2 0 367.475 -1.022 20 0 FAADRP C[C@H](CCCCn1c(=O)c2c(ncn2C)n(C)c1=O)[NH2+]C[C@@H](O)C[NH3+] ZINC001169161300 790674201 /nfs/dbraw/zinc/67/42/01/790674201.db2.gz BQEFYAYZMIAKGX-NEPJUHHUSA-N 2 0 352.439 -1.098 20 0 FAADRP C[C@@H](CCCCn1c(=O)c2c(ncn2C)n(C)c1=O)[NH2+]C[C@H](O)C[NH3+] ZINC001169161301 790674341 /nfs/dbraw/zinc/67/43/41/790674341.db2.gz BQEFYAYZMIAKGX-NWDGAFQWSA-N 2 0 352.439 -1.098 20 0 FAADRP C[C@@H](CCCCn1c(=O)c2c(ncn2C)n(C)c1=O)[NH2+]C[C@@H](O)C[NH3+] ZINC001169161302 790674435 /nfs/dbraw/zinc/67/44/35/790674435.db2.gz BQEFYAYZMIAKGX-RYUDHWBXSA-N 2 0 352.439 -1.098 20 0 FAADRP C[C@H](CCCCn1c(=O)c2c(ncn2C)n(C)c1=O)[NH2+]C[C@H](O)C[NH3+] ZINC001169161303 790673985 /nfs/dbraw/zinc/67/39/85/790673985.db2.gz BQEFYAYZMIAKGX-VXGBXAGGSA-N 2 0 352.439 -1.098 20 0 FAADRP COCCC[NH+]1CCC([NH2+]CCO[C@@H]2O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]2O)CC1 ZINC001172249575 790998703 /nfs/dbraw/zinc/99/87/03/790998703.db2.gz JSUUNDUMTWXIGS-BYHHXJKWSA-N 2 0 362.467 -1.079 20 0 FAADRP C[NH+](C)CCOCC(=O)N1CC[C@H]2C[N@@H+]([C@@H]3CCC(=O)NC3=O)C[C@H]21 ZINC001189801435 791984164 /nfs/dbraw/zinc/98/41/64/791984164.db2.gz GJDDSEMNAVEDMS-BFHYXJOUSA-N 2 0 352.435 -1.098 20 0 FAADRP C[NH+](C)CCOCC(=O)N1CC[C@H]2C[N@@H+]([C@H]3CCC(=O)NC3=O)C[C@H]21 ZINC001189801436 791983989 /nfs/dbraw/zinc/98/39/89/791983989.db2.gz GJDDSEMNAVEDMS-MELADBBJSA-N 2 0 352.435 -1.098 20 0 FAADRP COC[C@H](O)C[N@@H+]1C[C@@H](O)[C@H](NC(=O)c2ccn(CC[NH+](C)C)n2)C1 ZINC001193068552 792113868 /nfs/dbraw/zinc/11/38/68/792113868.db2.gz VTJNQOOOWLALEA-BPLDGKMQSA-N 2 0 355.439 -1.773 20 0 FAADRP COC[C@@H](O)C[N@@H+]1C[C@@H](O)[C@H](NC(=O)c2ccn(CC[NH+](C)C)n2)C1 ZINC001193068568 792113337 /nfs/dbraw/zinc/11/33/37/792113337.db2.gz VTJNQOOOWLALEA-NWANDNLSSA-N 2 0 355.439 -1.773 20 0 FAADRP CC(=O)NCCOCC[NH+]1C[C@@H](O)[C@H](NC(=O)[C@@H]2CC[N@H+](C)[C@@H]2C)C1 ZINC001193102994 792116018 /nfs/dbraw/zinc/11/60/18/792116018.db2.gz OAJSEMBTPXEQQY-DTZQCDIJSA-N 2 0 356.467 -1.359 20 0 FAADRP C[NH+](C)C1(C(=O)N[C@@H]2C[N@H+](C[C@@H](O)Cn3cccn3)C[C@H]2O)CCC1 ZINC001193737715 792157779 /nfs/dbraw/zinc/15/77/79/792157779.db2.gz FQUPPBOYJKFONG-RBSFLKMASA-N 2 0 351.451 -1.110 20 0 FAADRP C[NH+](C)C1(C(=O)N[C@@H]2C[N@H+](C[C@H](O)Cn3cccn3)C[C@H]2O)CCC1 ZINC001193737716 792157710 /nfs/dbraw/zinc/15/77/10/792157710.db2.gz FQUPPBOYJKFONG-RRFJBIMHSA-N 2 0 351.451 -1.110 20 0 FAADRP COCCOC[C@H](O)C[N@@H+]1C[C@@H](O)[C@H](NC(=O)C2([NH+](C)C)CCC2)C1 ZINC001193765599 792161076 /nfs/dbraw/zinc/16/10/76/792161076.db2.gz DFMFSNPMJZVZRB-RBSFLKMASA-N 2 0 359.467 -1.344 20 0 FAADRP COCCOC[C@@H](O)C[N@@H+]1C[C@@H](O)[C@H](NC(=O)C2([NH+](C)C)CCC2)C1 ZINC001193765600 792161049 /nfs/dbraw/zinc/16/10/49/792161049.db2.gz DFMFSNPMJZVZRB-RRFJBIMHSA-N 2 0 359.467 -1.344 20 0 FAADRP C[NH+](C)C1(C(=O)N[C@@H]2CN(CCN3C(=O)CCC3=O)C[C@H]2O)CCC1 ZINC001193774608 792159196 /nfs/dbraw/zinc/15/91/96/792159196.db2.gz QKLCIIZMFCVWJA-CHWSQXEVSA-N 2 0 352.435 -1.219 20 0 FAADRP C[NH+](C)C1(C(=O)N[C@@H]2CN(CCN3C(=O)CNC3=O)C[C@H]2O)CCC1 ZINC001193774833 792158765 /nfs/dbraw/zinc/15/87/65/792158765.db2.gz VOIBWJFPUAQFIX-VXGBXAGGSA-N 2 0 353.423 -1.816 20 0 FAADRP CC(=O)NCCOCC[N@@H+]1C[C@@H](O)[C@H](NC(=O)[C@@H](C2CC2)[NH+](C)C)C1 ZINC001193791905 792159987 /nfs/dbraw/zinc/15/99/87/792159987.db2.gz STUDLEVIRPBJJG-BZUAXINKSA-N 2 0 356.467 -1.359 20 0 FAADRP CC(=O)NCCOCC[N@@H+]1C[C@@H](O)[C@H](NC(=O)[C@H](C2CC2)[NH+](C)C)C1 ZINC001193791908 792159511 /nfs/dbraw/zinc/15/95/11/792159511.db2.gz STUDLEVIRPBJJG-OAGGEKHMSA-N 2 0 356.467 -1.359 20 0 FAADRP C[N@H+](CC(=O)N[C@@H]1C[NH+](C[C@H](O)Cn2cccn2)C[C@H]1O)C1CCC1 ZINC001193805915 792162488 /nfs/dbraw/zinc/16/24/88/792162488.db2.gz UKVXLZUFHCVIDU-ARFHVFGLSA-N 2 0 351.451 -1.110 20 0 FAADRP C[N@H+](CC(=O)N[C@@H]1C[NH+](C[C@@H](O)Cn2cccn2)C[C@H]1O)C1CCC1 ZINC001193805916 792162236 /nfs/dbraw/zinc/16/22/36/792162236.db2.gz UKVXLZUFHCVIDU-BZUAXINKSA-N 2 0 351.451 -1.110 20 0 FAADRP CC(=O)NCCOCC[NH+]1C[C@@H](O)[C@H](NC(=O)C[N@@H+](C)C2CCC2)C1 ZINC001193821677 792163461 /nfs/dbraw/zinc/16/34/61/792163461.db2.gz PWMUDWCXKQOCTM-HZPDHXFCSA-N 2 0 356.467 -1.215 20 0 FAADRP COCCOC[C@@H](O)C[N@@H+]1C[C@@H](O)[C@H](NC(=O)C[NH+](C)C2CCC2)C1 ZINC001193821682 792163609 /nfs/dbraw/zinc/16/36/09/792163609.db2.gz QAGWRFXUKQCRIQ-ARFHVFGLSA-N 2 0 359.467 -1.344 20 0 FAADRP COCCOC[C@H](O)C[N@@H+]1C[C@@H](O)[C@H](NC(=O)C[NH+](C)C2CCC2)C1 ZINC001193821683 792163557 /nfs/dbraw/zinc/16/35/57/792163557.db2.gz QAGWRFXUKQCRIQ-BZUAXINKSA-N 2 0 359.467 -1.344 20 0 FAADRP CC(=O)NCCOCC[N@@H+]1C[C@@H](O)[C@H](NC(=O)[C@H](C(C)C)[NH+](C)C)C1 ZINC001193960928 792170231 /nfs/dbraw/zinc/17/02/31/792170231.db2.gz JCJMBXDOCVPMNT-OAGGEKHMSA-N 2 0 358.483 -1.113 20 0 FAADRP COC[C@H](O)C[N@@H+]1C[C@@H](O)[C@H](NC(=O)C(C)(C)C[NH+]2CCOCC2)C1 ZINC001194102399 792179512 /nfs/dbraw/zinc/17/95/12/792179512.db2.gz KHAWXQOZEJNZAN-RBSFLKMASA-N 2 0 359.467 -1.487 20 0 FAADRP COC[C@@H](O)C[N@@H+]1C[C@@H](O)[C@H](NC(=O)C(C)(C)C[NH+]2CCOCC2)C1 ZINC001194102402 792179599 /nfs/dbraw/zinc/17/95/99/792179599.db2.gz KHAWXQOZEJNZAN-RRFJBIMHSA-N 2 0 359.467 -1.487 20 0 FAADRP CC[N@H+](C)C(C)(C)C(=O)N[C@@H]1C[NH+](C[C@@H](O)COCCOC)C[C@H]1O ZINC001194259559 792191249 /nfs/dbraw/zinc/19/12/49/792191249.db2.gz YLFXXYBMMZDPNS-RBSFLKMASA-N 2 0 361.483 -1.098 20 0 FAADRP CC[N@H+](C)C(C)(C)C(=O)N[C@@H]1C[NH+](C[C@H](O)COCCOC)C[C@H]1O ZINC001194259562 792191500 /nfs/dbraw/zinc/19/15/00/792191500.db2.gz YLFXXYBMMZDPNS-RRFJBIMHSA-N 2 0 361.483 -1.098 20 0 FAADRP C[NH+](C)CC1(C(=O)N[C@@H]2C[N@H+](C[C@@H](O)Cn3cccn3)C[C@H]2O)CC1 ZINC001195676657 792256498 /nfs/dbraw/zinc/25/64/98/792256498.db2.gz HPHVSMYRLVFUOZ-RBSFLKMASA-N 2 0 351.451 -1.253 20 0 FAADRP C[NH+](C)CC1(C(=O)N[C@@H]2C[N@H+](C[C@H](O)Cn3cccn3)C[C@H]2O)CC1 ZINC001195676659 792256703 /nfs/dbraw/zinc/25/67/03/792256703.db2.gz HPHVSMYRLVFUOZ-RRFJBIMHSA-N 2 0 351.451 -1.253 20 0 FAADRP COCCOC[C@H](O)C[N@@H+]1C[C@@H](O)[C@H](NC(=O)C2(C[NH+](C)C)CC2)C1 ZINC001195677268 792256815 /nfs/dbraw/zinc/25/68/15/792256815.db2.gz PLHHBFDCKDRPNZ-RBSFLKMASA-N 2 0 359.467 -1.487 20 0 FAADRP COCCOC[C@@H](O)C[N@@H+]1C[C@@H](O)[C@H](NC(=O)C2(C[NH+](C)C)CC2)C1 ZINC001195677271 792256917 /nfs/dbraw/zinc/25/69/17/792256917.db2.gz PLHHBFDCKDRPNZ-RRFJBIMHSA-N 2 0 359.467 -1.487 20 0 FAADRP C[NH+](C)CCCC(=O)N[C@@H]1C[N@H+](CCCN2C(=O)CNC2=O)C[C@H]1O ZINC001195708682 792258956 /nfs/dbraw/zinc/25/89/56/792258956.db2.gz RUCJZMUYDBXKDN-CHWSQXEVSA-N 2 0 355.439 -1.569 20 0 FAADRP COCCOC[C@@H](O)C[N@@H+]1C[C@@H](O)[C@H](NC(=O)C2CC[NH+](C)CC2)C1 ZINC001195828981 792267246 /nfs/dbraw/zinc/26/72/46/792267246.db2.gz NBGWXUINIKPMHK-ARFHVFGLSA-N 2 0 359.467 -1.487 20 0 FAADRP COCCOC[C@H](O)C[N@@H+]1C[C@@H](O)[C@H](NC(=O)C2CC[NH+](C)CC2)C1 ZINC001195828982 792266588 /nfs/dbraw/zinc/26/65/88/792266588.db2.gz NBGWXUINIKPMHK-BZUAXINKSA-N 2 0 359.467 -1.487 20 0 FAADRP CC(=O)NCCOCC[N@@H+]1C[C@@H](O)[C@H](NC(=O)C2CC[NH+](C)CC2)C1 ZINC001195829715 792266790 /nfs/dbraw/zinc/26/67/90/792266790.db2.gz VEOHZZAOSJHFKP-HZPDHXFCSA-N 2 0 356.467 -1.358 20 0 FAADRP C[NH+](C)CCC(=O)N[C@@H]1C[N@H+](C[C@@H]2CCN(S(C)(=O)=O)C2)C[C@H]1O ZINC001195859007 792265017 /nfs/dbraw/zinc/26/50/17/792265017.db2.gz AQAYRRYXMRNRHL-BFHYXJOUSA-N 2 0 362.496 -1.619 20 0 FAADRP C[NH+](C)CCC(=O)N[C@@H]1C[N@H+](C[C@H]2CCN(S(C)(=O)=O)C2)C[C@H]1O ZINC001195859008 792265139 /nfs/dbraw/zinc/26/51/39/792265139.db2.gz AQAYRRYXMRNRHL-MGPQQGTHSA-N 2 0 362.496 -1.619 20 0 FAADRP C[NH+](C)CCC(=O)N[C@@H]1C[N@H+](C[C@@H](O)COC2CCOCC2)C[C@H]1O ZINC001195871999 792268168 /nfs/dbraw/zinc/26/81/68/792268168.db2.gz WLIMGIWSQVNHNZ-FVQBIDKESA-N 2 0 359.467 -1.344 20 0 FAADRP C[NH+](C)CCC(=O)N[C@@H]1C[N@H+](C[C@H](O)COC2CCOCC2)C[C@H]1O ZINC001195872000 792268107 /nfs/dbraw/zinc/26/81/07/792268107.db2.gz WLIMGIWSQVNHNZ-NUEKZKHPSA-N 2 0 359.467 -1.344 20 0 FAADRP CC(=O)NCCOCC[N@@H+]1C[C@@H](O)[C@H](NC(=O)[C@@H](C(C)C)[NH+](C)C)C1 ZINC001195980878 792269556 /nfs/dbraw/zinc/26/95/56/792269556.db2.gz JCJMBXDOCVPMNT-BZUAXINKSA-N 2 0 358.483 -1.113 20 0 FAADRP COC[C@H](O)C[N@@H+]1C[C@@H](O)[C@H](NC(=O)c2cnn(CC[NH+](C)C)c2)C1 ZINC001196798802 792311573 /nfs/dbraw/zinc/31/15/73/792311573.db2.gz UEWDFPWCNWOKBA-RBSFLKMASA-N 2 0 355.439 -1.773 20 0 FAADRP COC[C@@H](O)C[N@@H+]1C[C@@H](O)[C@H](NC(=O)c2cnn(CC[NH+](C)C)c2)C1 ZINC001196798803 792311981 /nfs/dbraw/zinc/31/19/81/792311981.db2.gz UEWDFPWCNWOKBA-RRFJBIMHSA-N 2 0 355.439 -1.773 20 0 FAADRP CC[N@H+](C)CCC(=O)N[C@@H]1C[NH+](CCCN2C(=O)CNC2=O)C[C@H]1O ZINC001197493255 792358629 /nfs/dbraw/zinc/35/86/29/792358629.db2.gz HVPJRSGUXMLSEM-CHWSQXEVSA-N 2 0 355.439 -1.569 20 0 FAADRP Cn1ccc(C[N@@H+]2C[C@@H](O)[C@H](NC(=O)COCC[NH+](C)C)C2)cc1=O ZINC001197783896 792376179 /nfs/dbraw/zinc/37/61/79/792376179.db2.gz RHINLSZUOCGEPP-HUUCEWRRSA-N 2 0 352.435 -1.375 20 0 FAADRP CC(=O)NCCOCC[NH+]1C[C@@H](O)[C@H](NC(=O)C[C@@H]2CC[N@@H+](C)C2)C1 ZINC001197792163 792375470 /nfs/dbraw/zinc/37/54/70/792375470.db2.gz LAQQVJJTTXGPSY-ARFHVFGLSA-N 2 0 356.467 -1.358 20 0 FAADRP CC(=O)NCCOCC[NH+]1C[C@@H](O)[C@H](NC(=O)C[C@H]2CC[N@@H+](C)C2)C1 ZINC001197792164 792375718 /nfs/dbraw/zinc/37/57/18/792375718.db2.gz LAQQVJJTTXGPSY-BZUAXINKSA-N 2 0 356.467 -1.358 20 0 FAADRP C[NH+](C)CCOCC(=O)N[C@@H]1C[N@H+](CCCN2CCCC2=O)C[C@H]1O ZINC001197792619 792375347 /nfs/dbraw/zinc/37/53/47/792375347.db2.gz ODJNMJPUPUBTBI-HUUCEWRRSA-N 2 0 356.467 -1.262 20 0 FAADRP C[NH+](C)CCOCC(=O)N[C@@H]1C[N@H+](C[C@@H](O)Cn2cccn2)C[C@H]1O ZINC001197792893 792375802 /nfs/dbraw/zinc/37/58/02/792375802.db2.gz SNTRSZBPYVJXHM-RBSFLKMASA-N 2 0 355.439 -2.017 20 0 FAADRP C[NH+](C)CCOCC(=O)N[C@@H]1C[N@H+](C[C@H](O)Cn2cccn2)C[C@H]1O ZINC001197792894 792376030 /nfs/dbraw/zinc/37/60/30/792376030.db2.gz SNTRSZBPYVJXHM-RRFJBIMHSA-N 2 0 355.439 -2.017 20 0 FAADRP COCCOC[C@H](O)C[N@@H+]1C[C@@H](O)[C@H](NC(=O)C23CC[NH+](CC2)C3)C1 ZINC001197819702 792378149 /nfs/dbraw/zinc/37/81/49/792378149.db2.gz KLDTYGZHFSFIAI-RBSFLKMASA-N 2 0 357.451 -1.733 20 0 FAADRP COCCOC[C@@H](O)C[N@@H+]1C[C@@H](O)[C@H](NC(=O)C23CC[NH+](CC2)C3)C1 ZINC001197819703 792377811 /nfs/dbraw/zinc/37/78/11/792377811.db2.gz KLDTYGZHFSFIAI-RRFJBIMHSA-N 2 0 357.451 -1.733 20 0 FAADRP CC(C)COC[C@@H](O)C[N@@H+]1C[C@@H](O)[C@H](NC(=O)COCC[NH+](C)C)C1 ZINC001197825784 792378954 /nfs/dbraw/zinc/37/89/54/792378954.db2.gz IJSUCFINCYLOJZ-ARFHVFGLSA-N 2 0 361.483 -1.241 20 0 FAADRP CC(C)COC[C@H](O)C[N@@H+]1C[C@@H](O)[C@H](NC(=O)COCC[NH+](C)C)C1 ZINC001197825798 792379603 /nfs/dbraw/zinc/37/96/03/792379603.db2.gz IJSUCFINCYLOJZ-BZUAXINKSA-N 2 0 361.483 -1.241 20 0 FAADRP C[NH+](C)CCOCC(=O)N[C@@H]1C[N@H+](CCCO[C@H]2CCOC2)C[C@H]1O ZINC001197825819 792379427 /nfs/dbraw/zinc/37/94/27/792379427.db2.gz IYLPEPJYXGNQSB-ARFHVFGLSA-N 2 0 359.467 -1.079 20 0 FAADRP C[NH+](C)CCOCC(=O)N[C@@H]1C[N@H+](CCCO[C@@H]2CCOC2)C[C@H]1O ZINC001197825821 792379712 /nfs/dbraw/zinc/37/97/12/792379712.db2.gz IYLPEPJYXGNQSB-BZUAXINKSA-N 2 0 359.467 -1.079 20 0 FAADRP C[NH+](C)CCOCC(=O)N[C@@H]1C[N@H+](C[C@@H]2CCc3ncnn32)C[C@H]1O ZINC001197826049 792379567 /nfs/dbraw/zinc/37/95/67/792379567.db2.gz OBOVNWLHOGENFW-BFHYXJOUSA-N 2 0 352.439 -1.495 20 0 FAADRP C[NH+](C)CCOCC(=O)N[C@@H]1C[N@H+](C[C@H]2CCc3ncnn32)C[C@H]1O ZINC001197826050 792378619 /nfs/dbraw/zinc/37/86/19/792378619.db2.gz OBOVNWLHOGENFW-MGPQQGTHSA-N 2 0 352.439 -1.495 20 0 FAADRP COCCOC[C@H](O)C[N@@H+]1C[C@@H](O)[C@H](NC(=O)COCC[NH+](C)C)C1 ZINC001197826251 792379314 /nfs/dbraw/zinc/37/93/14/792379314.db2.gz SJTUSQGIPYNDRR-RBSFLKMASA-N 2 0 363.455 -2.250 20 0 FAADRP COCCOC[C@@H](O)C[N@@H+]1C[C@@H](O)[C@H](NC(=O)COCC[NH+](C)C)C1 ZINC001197826252 792379140 /nfs/dbraw/zinc/37/91/40/792379140.db2.gz SJTUSQGIPYNDRR-RRFJBIMHSA-N 2 0 363.455 -2.250 20 0 FAADRP C[NH+](C)CCOCC(=O)N[C@@H]1C[N@H+](C[C@H]2CCNC(=O)CC2)C[C@H]1O ZINC001197826485 792379200 /nfs/dbraw/zinc/37/92/00/792379200.db2.gz ZECVEDRXINGXSQ-RBSFLKMASA-N 2 0 356.467 -1.358 20 0 FAADRP C[NH+](C)CCOCC(=O)N[C@@H]1C[N@H+](C[C@@H]2CCNC(=O)CC2)C[C@H]1O ZINC001197826486 792379530 /nfs/dbraw/zinc/37/95/30/792379530.db2.gz ZECVEDRXINGXSQ-RRFJBIMHSA-N 2 0 356.467 -1.358 20 0 FAADRP COCCOC[C@@H](O)C[N@@H+]1C[C@@H](O)[C@H](NC(=O)CCCC[NH+](C)C)C1 ZINC001197949220 792383064 /nfs/dbraw/zinc/38/30/64/792383064.db2.gz PSWNQDSBPZVLSV-ARFHVFGLSA-N 2 0 361.483 -1.097 20 0 FAADRP COCCOC[C@H](O)C[N@@H+]1C[C@@H](O)[C@H](NC(=O)CCCC[NH+](C)C)C1 ZINC001197949226 792383349 /nfs/dbraw/zinc/38/33/49/792383349.db2.gz PSWNQDSBPZVLSV-BZUAXINKSA-N 2 0 361.483 -1.097 20 0 FAADRP CCC[N@H+](C)CCC(=O)N[C@@H]1C[NH+](C[C@H](O)COCCOC)C[C@H]1O ZINC001198038078 792388259 /nfs/dbraw/zinc/38/82/59/792388259.db2.gz JHNWSJVEXYDCFH-ARFHVFGLSA-N 2 0 361.483 -1.097 20 0 FAADRP CCC[N@H+](C)CCC(=O)N[C@@H]1C[NH+](C[C@@H](O)COCCOC)C[C@H]1O ZINC001198038079 792387628 /nfs/dbraw/zinc/38/76/28/792387628.db2.gz JHNWSJVEXYDCFH-BZUAXINKSA-N 2 0 361.483 -1.097 20 0 FAADRP C[C@@H]1C[N@H+](Cc2cc(=O)n(C)c(=O)n2C)C[C@H]1NC(=O)CC[NH+](C)C ZINC001208496056 792969990 /nfs/dbraw/zinc/96/99/90/792969990.db2.gz IKQPBYIAAQQTKZ-TZMCWYRMSA-N 2 0 351.451 -1.028 20 0 FAADRP C[C@@H]1C[N@H+](C[C@H](O)CN2C(=O)CCC2=O)C[C@H]1NC(=O)CC[NH+](C)C ZINC001208496466 792969524 /nfs/dbraw/zinc/96/95/24/792969524.db2.gz UOTHOTZCRUXLDB-HZSPNIEDSA-N 2 0 354.451 -1.116 20 0 FAADRP C[C@@H]1C[N@H+](C[C@@H](O)CN2C(=O)CCC2=O)C[C@H]1NC(=O)CC[NH+](C)C ZINC001208496467 792969744 /nfs/dbraw/zinc/96/97/44/792969744.db2.gz UOTHOTZCRUXLDB-MGPQQGTHSA-N 2 0 354.451 -1.116 20 0 FAADRP C[C@@H]1C[N@H+](CCN2C(=O)CNC2=O)C[C@H]1NC(=O)COCC[NH+](C)C ZINC001210322438 792987823 /nfs/dbraw/zinc/98/78/23/792987823.db2.gz RMVXQULIJXYKCW-CHWSQXEVSA-N 2 0 355.439 -1.447 20 0 FAADRP CO[C@@H]1CN(CCNS(C)(=O)=O)C[C@H]1NC(=O)[C@@H]1CC[N@H+](C)[C@@H]1C ZINC001212297816 790482629 /nfs/dbraw/zinc/48/26/29/790482629.db2.gz MBUSVMCSBXGTAR-AAVRWANBSA-N 2 0 362.496 -1.309 20 0 FAADRP CO[C@@H]1C[N@H+](C[C@H](O)CN2CCCC2=O)C[C@H]1NC(=O)CC[NH+](C)C ZINC001213378629 793023073 /nfs/dbraw/zinc/02/30/73/793023073.db2.gz ZQSQQLUZCHCCTG-RRFJBIMHSA-N 2 0 356.467 -1.263 20 0 FAADRP CO[C@@H]1C[N@H+](CCCN2C(=O)CNC2=O)C[C@H]1NC(=O)CC[NH+](C)C ZINC001213378632 793022155 /nfs/dbraw/zinc/02/21/55/793022155.db2.gz ZTIRMYDVEDBJFT-CHWSQXEVSA-N 2 0 355.439 -1.305 20 0 FAADRP COC[C@H](O)C[N@@H+]1C[C@@H](NC(=O)COC2CC[NH+](C)CC2)[C@H](OC)C1 ZINC001213638268 793044090 /nfs/dbraw/zinc/04/40/90/793044090.db2.gz HBZYFEDOHOAENI-FVQBIDKESA-N 2 0 359.467 -1.080 20 0 FAADRP COC[C@@H](O)C[N@@H+]1C[C@@H](NC(=O)COC2CC[NH+](C)CC2)[C@H](OC)C1 ZINC001213638269 793044187 /nfs/dbraw/zinc/04/41/87/793044187.db2.gz HBZYFEDOHOAENI-NUEKZKHPSA-N 2 0 359.467 -1.080 20 0 FAADRP CO[C@@H]1C[N@H+](CCOCCO)C[C@H]1NC(=O)COC1CC[NH+](C)CC1 ZINC001213638455 793043914 /nfs/dbraw/zinc/04/39/14/793043914.db2.gz PDZYUVHCYIAAHZ-HZPDHXFCSA-N 2 0 359.467 -1.079 20 0 FAADRP CO[C@@H]1C[N@H+](CCOCCNC(C)=O)C[C@H]1NC(=O)[C@H]1CC[NH+](C)C1 ZINC001213857384 793064344 /nfs/dbraw/zinc/06/43/44/793064344.db2.gz LKQLWIIBPVQXJL-ARFHVFGLSA-N 2 0 356.467 -1.094 20 0 FAADRP CO[C@@H]1C[N@H+](CCOCCNC(C)=O)C[C@H]1NC(=O)[C@@H]1CC[NH+](C)C1 ZINC001213857385 793064686 /nfs/dbraw/zinc/06/46/86/793064686.db2.gz LKQLWIIBPVQXJL-BZUAXINKSA-N 2 0 356.467 -1.094 20 0 FAADRP C[C@@H]1CN(C(=O)CCC[NH+](C)C)C[C@H]1[NH2+]CC(=O)N1CCNC(=O)C1 ZINC001215421797 793108943 /nfs/dbraw/zinc/10/89/43/793108943.db2.gz MTDTXEIDROVIPP-ZIAGYGMSSA-N 2 0 353.467 -1.277 20 0 FAADRP C[C@H](NC(=O)C[NH2+][C@@H]1CN(C(=O)CC[NH+](C)C)C[C@H]1C)C(=O)N(C)C ZINC001215458864 793109881 /nfs/dbraw/zinc/10/98/81/793109881.db2.gz NLXSIRBNVRLLGN-HZSPNIEDSA-N 2 0 355.483 -1.033 20 0 FAADRP C[C@@H](NC(=O)C[NH2+][C@@H]1CN(C(=O)CC[NH+](C)C)C[C@H]1C)C(=O)N(C)C ZINC001215458865 793110064 /nfs/dbraw/zinc/11/00/64/793110064.db2.gz NLXSIRBNVRLLGN-MGPQQGTHSA-N 2 0 355.483 -1.033 20 0 FAADRP C[C@@H]1CN(C(=O)CC[NH+](C)C)C[C@H]1[NH2+]Cc1cc(=O)n(C)c(=O)n1C ZINC001215459038 793110288 /nfs/dbraw/zinc/11/02/88/793110288.db2.gz UZEONUBPPLCTAM-TZMCWYRMSA-N 2 0 351.451 -1.028 20 0 FAADRP C[C@@H]1CN(C(=O)CC[NH+](C)C)C[C@H]1[NH2+]C[C@H](O)CN1C(=O)CCC1=O ZINC001215463070 793109820 /nfs/dbraw/zinc/10/98/20/793109820.db2.gz GJFNXXVTIYCZAT-HZSPNIEDSA-N 2 0 354.451 -1.116 20 0 FAADRP C[C@@H]1CN(C(=O)CC[NH+](C)C)C[C@H]1[NH2+]C[C@@H](O)CN1C(=O)CCC1=O ZINC001215463071 793110382 /nfs/dbraw/zinc/11/03/82/793110382.db2.gz GJFNXXVTIYCZAT-MGPQQGTHSA-N 2 0 354.451 -1.116 20 0 FAADRP CC[NH+](CC)CC(=O)N1C[C@@H](C)[C@H]([NH2+]CC(=O)N2CCNC(=O)C2)C1 ZINC001215994175 793117804 /nfs/dbraw/zinc/11/78/04/793117804.db2.gz TZKOJTFTRAECAH-ZIAGYGMSSA-N 2 0 353.467 -1.277 20 0 FAADRP C[C@@H]1CN(C(=O)COC2CC[NH+](C)CC2)C[C@H]1[NH2+]CC(=O)NC(N)=O ZINC001216090973 793118976 /nfs/dbraw/zinc/11/89/76/793118976.db2.gz QVBYDUWHEQPCOR-DGCLKSJQSA-N 2 0 355.439 -1.271 20 0 FAADRP CC[N@H+](C)CCC(=O)N1C[C@@H](C)[C@H]([NH2+]CC(=O)N2CCNC(=O)C2)C1 ZINC001216217070 793119567 /nfs/dbraw/zinc/11/95/67/793119567.db2.gz GZUDSNRFTJJGSF-ZIAGYGMSSA-N 2 0 353.467 -1.277 20 0 FAADRP CCNC(=O)NC(=O)C[NH2+][C@@H]1CN(C(=O)COCC[NH+](C)C)C[C@H]1C ZINC001216400942 793122635 /nfs/dbraw/zinc/12/26/35/793122635.db2.gz FCIGOMMODUJMRC-CHWSQXEVSA-N 2 0 357.455 -1.153 20 0 FAADRP C[C@@H]1CN(C(=O)COCC[NH+](C)C)C[C@H]1[NH2+]CCN(C)S(C)(=O)=O ZINC001216402205 793122604 /nfs/dbraw/zinc/12/26/04/793122604.db2.gz XXRLJNDSIREYPT-ZIAGYGMSSA-N 2 0 364.512 -1.108 20 0 FAADRP C[C@@H]1CN(C(=O)COCC[NH+](C)C)C[C@H]1[NH2+]CC(=O)N1CCOCC1 ZINC001216402207 793122263 /nfs/dbraw/zinc/12/22/63/793122263.db2.gz YAWCQGVMIQIFKQ-HUUCEWRRSA-N 2 0 356.467 -1.140 20 0 FAADRP CCC[N@H+](C)CC(=O)N1C[C@@H](C)[C@H]([NH2+]CC(=O)N2CCNC(=O)C2)C1 ZINC001216503814 793122449 /nfs/dbraw/zinc/12/24/49/793122449.db2.gz XWLJKGLPPXCGCZ-ZIAGYGMSSA-N 2 0 353.467 -1.277 20 0 FAADRP C[C@@H](C[NH+]1CCOCC1)C(=O)N1C[C@@H](C)[C@H]([NH2+]CC(=O)NC(N)=O)C1 ZINC001216758192 793128519 /nfs/dbraw/zinc/12/85/19/793128519.db2.gz ZCSFTEDWXOCSAQ-FRRDWIJNSA-N 2 0 355.439 -1.414 20 0 FAADRP C[C@H](C[NH+]1CCOCC1)C(=O)N1C[C@@H](C)[C@H]([NH2+]CC(=O)NC(N)=O)C1 ZINC001216758193 793128852 /nfs/dbraw/zinc/12/88/52/793128852.db2.gz ZCSFTEDWXOCSAQ-JHJVBQTASA-N 2 0 355.439 -1.414 20 0 FAADRP C[NH+]1CCN(c2ccc(NC(=O)CN(CC[NH3+])S(C)(=O)=O)nc2)CC1 ZINC001218515173 793175259 /nfs/dbraw/zinc/17/52/59/793175259.db2.gz BXQYDHKVYXYNTG-UHFFFAOYSA-N 2 0 370.479 -1.008 20 0 FAADRP C[C@H](NC(=O)[C@@H]([NH3+])CO)C(=O)Nc1ccc(N2CC[NH+](C)CC2)cn1 ZINC001218516378 793174782 /nfs/dbraw/zinc/17/47/82/793174782.db2.gz GMXOEPJVADSCNB-AAEUAGOBSA-N 2 0 350.423 -1.404 20 0 FAADRP C[C@H]([NH3+])C(=O)N[C@@H](CC(N)=O)C(=O)Nc1nc2c(s1)C[C@H]([NH3+])CC2 ZINC001218533181 793174743 /nfs/dbraw/zinc/17/47/43/793174743.db2.gz KSJYCXUFMWAEMH-OOZYFLPDSA-N 2 0 354.436 -1.395 20 0 FAADRP C[C@H]([NH3+])C(=O)N[C@@H](CC(N)=O)C(=O)Nc1nc2c(s1)C[C@@H]([NH3+])CC2 ZINC001218533183 793174947 /nfs/dbraw/zinc/17/49/47/793174947.db2.gz KSJYCXUFMWAEMH-ZKWXMUAHSA-N 2 0 354.436 -1.395 20 0 FAADRP C[C@H]([NH3+])C(=O)N[C@H](CCC(=O)Nc1nc2c(s1)C[C@@H]([NH3+])CC2)C(N)=O ZINC001218533459 793174890 /nfs/dbraw/zinc/17/48/90/793174890.db2.gz MHEWKWSDGBYVEZ-OYNCUSHFSA-N 2 0 368.463 -1.005 20 0 FAADRP C[C@H]([NH3+])C(=O)N[C@H](CCC(=O)Nc1nc2c(s1)C[C@H]([NH3+])CC2)C(N)=O ZINC001218533460 793175145 /nfs/dbraw/zinc/17/51/45/793175145.db2.gz MHEWKWSDGBYVEZ-QXFUBDJGSA-N 2 0 368.463 -1.005 20 0 FAADRP NC(=O)c1n[nH]cc1NC(=O)[C@@H]1CCCN1C(=O)[C@@H]([NH3+])CCCC[NH3+] ZINC001218563879 793177476 /nfs/dbraw/zinc/17/74/76/793177476.db2.gz FTONAKYNDPAEDD-ONGXEEELSA-N 2 0 351.411 -1.106 20 0 FAADRP Nc1cn(C(=O)[C@@H]([NH3+])CSCC[NH3+])ccc1=[NH+]CCN1CCOCC1 ZINC001218619164 793179872 /nfs/dbraw/zinc/17/98/72/793179872.db2.gz ABBZJSYFIQWVHA-AWEZNQCLSA-N 3 0 368.507 -1.037 20 0 FAADRP CS(=O)(=O)N(CC[NH3+])CC(=O)N(c1ncccc1N)C1CC[NH2+]CC1 ZINC001218694803 793181672 /nfs/dbraw/zinc/18/16/72/793181672.db2.gz DQRGRBDIXUVAMM-UHFFFAOYSA-N 2 0 370.479 -1.031 20 0 FAADRP C[C@H](NC(=O)[C@@H]([NH3+])CO)C(=O)N(c1ncccc1N)C1CC[NH2+]CC1 ZINC001218696575 793182351 /nfs/dbraw/zinc/18/23/51/793182351.db2.gz VDSGWLNTSAPELK-GWCFXTLKSA-N 2 0 350.423 -1.427 20 0 FAADRP N=c1nc2c(ncn2COCCO)c(N)n1C(=O)[C@@H]([NH3+])CCCC[NH3+] ZINC001218703770 793183658 /nfs/dbraw/zinc/18/36/58/793183658.db2.gz HZEHPJXSHKUNKE-VIFPVBQESA-N 2 0 352.399 -1.643 20 0 FAADRP N=c1nc2c(ncn2COCCO)c(N)n1C(=O)[C@@H]([NH3+])CSCC[NH3+] ZINC001218703788 793184089 /nfs/dbraw/zinc/18/40/89/793184089.db2.gz IAKSKTYTDONKFT-QMMMGPOBSA-N 2 0 370.439 -2.080 20 0 FAADRP C[C@H](NC(=O)[C@@H]([NH3+])CO)C(=O)Nc1ccc(N2CCC([NH3+])CC2)nc1 ZINC001218724947 793183980 /nfs/dbraw/zinc/18/39/80/793183980.db2.gz XHFUIUBINCOOHD-GWCFXTLKSA-N 2 0 350.423 -1.228 20 0 FAADRP CS(=O)(=O)N(CC[NH3+])CC(=O)Nc1ccc(O[C@@H]2CC[NH2+]C2)nc1 ZINC001218728030 793183645 /nfs/dbraw/zinc/18/36/45/793183645.db2.gz QUJDBKZYULJWBI-GFCCVEGCSA-N 2 0 357.436 -1.019 20 0 FAADRP [NH3+]CCC[C@@H]([NH3+])C(=O)Nc1ccnc2c(N(CCO)CCO)cnn21 ZINC001218770653 793186021 /nfs/dbraw/zinc/18/60/21/793186021.db2.gz KXDWDKNBMZUHJB-LLVKDONJSA-N 2 0 351.411 -1.475 20 0 FAADRP [NH3+]CCC[C@H]([NH3+])C(=O)Nc1ccnc2c(N(CCO)CCO)cnn21 ZINC001218770654 793186076 /nfs/dbraw/zinc/18/60/76/793186076.db2.gz KXDWDKNBMZUHJB-NSHDSACASA-N 2 0 351.411 -1.475 20 0 FAADRP Nc1ncn(C(=O)[C@@H](N)CC[NH3+])c(=NC[C@@H]2CC[NH2+]C[C@@H]2O)c1Cl ZINC001218775218 793185812 /nfs/dbraw/zinc/18/58/12/793185812.db2.gz GKUSQNXIAQZDMP-GUBZILKMSA-N 2 0 357.846 -1.694 20 0 FAADRP Nc1ncn(C(=O)[C@@H](N)CC[NH3+])c(=NC[C@H]2CC[NH2+]C[C@H]2O)c1Cl ZINC001218775220 793186237 /nfs/dbraw/zinc/18/62/37/793186237.db2.gz GKUSQNXIAQZDMP-KXUCPTDWSA-N 2 0 357.846 -1.694 20 0 FAADRP Nc1ncn(C(=O)[C@@H](N)CC[NH3+])c(=NC[C@@H]2CC[NH2+]C[C@H]2O)c1Cl ZINC001218775221 793186217 /nfs/dbraw/zinc/18/62/17/793186217.db2.gz GKUSQNXIAQZDMP-LPEHRKFASA-N 2 0 357.846 -1.694 20 0 FAADRP Nc1ncn(C(=O)[C@@H](N)CC[NH3+])c(=NC[C@H]2CC[NH2+]C[C@@H]2O)c1Cl ZINC001218775222 793185916 /nfs/dbraw/zinc/18/59/16/793185916.db2.gz GKUSQNXIAQZDMP-UTLUCORTSA-N 2 0 357.846 -1.694 20 0 FAADRP CC(C)(O)[C@H]([NH3+])C(=O)n1cnc(N)c(Cl)c1=NC[C@@H]1CC[NH2+]C[C@@H]1O ZINC001218775743 793186172 /nfs/dbraw/zinc/18/61/72/793186172.db2.gz DHFHGTXISWSWAY-ATZCPNFKSA-N 2 0 372.857 -1.272 20 0 FAADRP CC(C)(O)[C@H]([NH3+])C(=O)n1cnc(N)c(Cl)c1=NC[C@H]1CC[NH2+]C[C@H]1O ZINC001218775758 793186291 /nfs/dbraw/zinc/18/62/91/793186291.db2.gz DHFHGTXISWSWAY-FXPVBKGRSA-N 2 0 372.857 -1.272 20 0 FAADRP CC(C)(O)[C@H]([NH3+])C(=O)n1cnc(N)c(Cl)c1=NC[C@@H]1CC[NH2+]C[C@H]1O ZINC001218775761 793186006 /nfs/dbraw/zinc/18/60/06/793186006.db2.gz DHFHGTXISWSWAY-IQJOONFLSA-N 2 0 372.857 -1.272 20 0 FAADRP CC(C)(O)[C@H]([NH3+])C(=O)n1cnc(N)c(Cl)c1=NC[C@H]1CC[NH2+]C[C@@H]1O ZINC001218775763 793185971 /nfs/dbraw/zinc/18/59/71/793185971.db2.gz DHFHGTXISWSWAY-WCABBAIRSA-N 2 0 372.857 -1.272 20 0 FAADRP Nc1ncn(C(=O)[C@]2(N)CC[NH2+]C2)c(=NC[C@H]2CC[NH2+]C[C@H]2O)c1Cl ZINC001218776033 793186701 /nfs/dbraw/zinc/18/67/01/793186701.db2.gz ADICZOTXARZIIF-FCHSOHFDSA-N 2 0 369.857 -1.679 20 0 FAADRP Nc1ncn(C(=O)[C@]2(N)CC[NH2+]C2)c(=NC[C@H]2CC[NH2+]C[C@@H]2O)c1Cl ZINC001218776035 793187085 /nfs/dbraw/zinc/18/70/85/793187085.db2.gz ADICZOTXARZIIF-FTGAXOIBSA-N 2 0 369.857 -1.679 20 0 FAADRP Nc1ncn(C(=O)[C@]2(N)CC[NH2+]C2)c(=NC[C@@H]2CC[NH2+]C[C@H]2O)c1Cl ZINC001218776037 793187184 /nfs/dbraw/zinc/18/71/84/793187184.db2.gz ADICZOTXARZIIF-WMFXKJRFSA-N 2 0 369.857 -1.679 20 0 FAADRP Nc1ncn(C(=O)[C@]2(N)CC[NH2+]C2)c(=NC[C@@H]2CC[NH2+]C[C@@H]2O)c1Cl ZINC001218776039 793187012 /nfs/dbraw/zinc/18/70/12/793187012.db2.gz ADICZOTXARZIIF-YHAQOWFVSA-N 2 0 369.857 -1.679 20 0 FAADRP Nc1ncn(C(=O)[C@H]2C[C@@H](O)C[NH2+]2)c(=NC[C@H]2CC[NH2+]C[C@@H]2O)c1Cl ZINC001218776047 793186163 /nfs/dbraw/zinc/18/61/63/793186163.db2.gz JWGBZEDPZIRHPN-DBIOUOCHSA-N 2 0 370.841 -1.647 20 0 FAADRP Nc1ncn(C(=O)[C@H]2C[C@@H](O)C[NH2+]2)c(=NC[C@H]2CC[NH2+]C[C@H]2O)c1Cl ZINC001218776054 793186253 /nfs/dbraw/zinc/18/62/53/793186253.db2.gz JWGBZEDPZIRHPN-GWOFURMSSA-N 2 0 370.841 -1.647 20 0 FAADRP Nc1ncn(C(=O)[C@H]2C[C@@H](O)C[NH2+]2)c(=NC[C@@H]2CC[NH2+]C[C@H]2O)c1Cl ZINC001218776056 793186184 /nfs/dbraw/zinc/18/61/84/793186184.db2.gz JWGBZEDPZIRHPN-LNFKQOIKSA-N 2 0 370.841 -1.647 20 0 FAADRP Nc1ncn(C(=O)[C@@H]2C[C@H](O)C[NH2+]2)c(=NC[C@@H]2CC[NH2+]C[C@@H]2O)c1Cl ZINC001218776058 793186119 /nfs/dbraw/zinc/18/61/19/793186119.db2.gz JWGBZEDPZIRHPN-NAKRPEOUSA-N 2 0 370.841 -1.647 20 0 FAADRP Nc1ncn(C(=O)[C@@H]2C[C@H](O)C[NH2+]2)c(=NC[C@H]2CC[NH2+]C[C@@H]2O)c1Cl ZINC001218776059 793186282 /nfs/dbraw/zinc/18/62/82/793186282.db2.gz JWGBZEDPZIRHPN-RCWTZXSCSA-N 2 0 370.841 -1.647 20 0 FAADRP Nc1ncn(C(=O)[C@@H]2C[C@H](O)C[NH2+]2)c(=NC[C@H]2CC[NH2+]C[C@H]2O)c1Cl ZINC001218776060 793186212 /nfs/dbraw/zinc/18/62/12/793186212.db2.gz JWGBZEDPZIRHPN-VPOLOUISSA-N 2 0 370.841 -1.647 20 0 FAADRP Nc1ncn(C(=O)[C@@H]2C[C@H](O)C[NH2+]2)c(=NC[C@@H]2CC[NH2+]C[C@H]2O)c1Cl ZINC001218776062 793187201 /nfs/dbraw/zinc/18/72/01/793187201.db2.gz JWGBZEDPZIRHPN-XWLWVQCSSA-N 2 0 370.841 -1.647 20 0 FAADRP Nc1ncn(C(=O)[C@H]2C[C@@H](O)C[NH2+]2)c(=NC[C@@H]2CC[NH2+]C[C@@H]2O)c1Cl ZINC001218776063 793187155 /nfs/dbraw/zinc/18/71/55/793187155.db2.gz JWGBZEDPZIRHPN-ZDCRXTMVSA-N 2 0 370.841 -1.647 20 0 FAADRP Nc1ncn(C(=O)[C@H]2C[NH2+]CCN2)c(=NC[C@@H]2CC[NH2+]C[C@@H]2O)c1Cl ZINC001218776105 793186918 /nfs/dbraw/zinc/18/69/18/793186918.db2.gz KCBXKHBEGLBMCK-AXFHLTTASA-N 2 0 369.857 -1.809 20 0 FAADRP Nc1ncn(C(=O)[C@H]2C[NH2+]CCN2)c(=NC[C@H]2CC[NH2+]C[C@H]2O)c1Cl ZINC001218776111 793186882 /nfs/dbraw/zinc/18/68/82/793186882.db2.gz KCBXKHBEGLBMCK-GMTAPVOTSA-N 2 0 369.857 -1.809 20 0 FAADRP Nc1ncn(C(=O)[C@H]2C[NH2+]CCN2)c(=NC[C@@H]2CC[NH2+]C[C@H]2O)c1Cl ZINC001218776112 793186723 /nfs/dbraw/zinc/18/67/23/793186723.db2.gz KCBXKHBEGLBMCK-HBNTYKKESA-N 2 0 369.857 -1.809 20 0 FAADRP Nc1ncn(C(=O)[C@H]2C[NH2+]CCN2)c(=NC[C@H]2CC[NH2+]C[C@@H]2O)c1Cl ZINC001218776113 793187191 /nfs/dbraw/zinc/18/71/91/793187191.db2.gz KCBXKHBEGLBMCK-MXWKQRLJSA-N 2 0 369.857 -1.809 20 0 FAADRP Nc1ncn(C(=O)[C@@H]2C[NH2+]CCO2)c(=NC[C@@H]2CC[NH2+]C[C@H]2O)c1Cl ZINC001218776315 793187311 /nfs/dbraw/zinc/18/73/11/793187311.db2.gz FPINUKQMQUDVHY-AXFHLTTASA-N 2 0 370.841 -1.382 20 0 FAADRP Nc1ncn(C(=O)[C@@H]2C[NH2+]CCO2)c(=NC[C@@H]2CC[NH2+]C[C@@H]2O)c1Cl ZINC001218776316 793186980 /nfs/dbraw/zinc/18/69/80/793186980.db2.gz FPINUKQMQUDVHY-DCAQKATOSA-N 2 0 370.841 -1.382 20 0 FAADRP Nc1ncn(C(=O)[C@@H]2C[NH2+]CCO2)c(=NC[C@H]2CC[NH2+]C[C@H]2O)c1Cl ZINC001218776317 793186929 /nfs/dbraw/zinc/18/69/29/793186929.db2.gz FPINUKQMQUDVHY-MXWKQRLJSA-N 2 0 370.841 -1.382 20 0 FAADRP Nc1ncn(C(=O)[C@@H]2C[NH2+]CCO2)c(=NC[C@H]2CC[NH2+]C[C@@H]2O)c1Cl ZINC001218776318 793186869 /nfs/dbraw/zinc/18/68/69/793186869.db2.gz FPINUKQMQUDVHY-VWYCJHECSA-N 2 0 370.841 -1.382 20 0 FAADRP Nc1ncn(C(=O)[C@@H]2C[C@@H]([NH3+])CN2)c(=NC[C@H]2CC[NH2+]C[C@H]2O)c1Cl ZINC001218776532 793186805 /nfs/dbraw/zinc/18/68/05/793186805.db2.gz LTWZVZSWSSGCFP-CHWFTXMASA-N 2 0 369.857 -1.681 20 0 FAADRP Nc1ncn(C(=O)[C@@H]2C[C@@H]([NH3+])CN2)c(=NC[C@@H]2CC[NH2+]C[C@@H]2O)c1Cl ZINC001218776533 793187286 /nfs/dbraw/zinc/18/72/86/793187286.db2.gz LTWZVZSWSSGCFP-VLEAKVRGSA-N 2 0 369.857 -1.681 20 0 FAADRP Nc1ncn(C(=O)[C@@H]2C[C@@H]([NH3+])CN2)c(=NC[C@H]2CC[NH2+]C[C@@H]2O)c1Cl ZINC001218776534 793187176 /nfs/dbraw/zinc/18/71/76/793187176.db2.gz LTWZVZSWSSGCFP-ZNSHCXBVSA-N 2 0 369.857 -1.681 20 0 FAADRP Nc1ncn(C(=O)[C@@H]2C[C@@H]([NH3+])CN2)c(=NC[C@@H]2CC[NH2+]C[C@H]2O)c1Cl ZINC001218776535 793187235 /nfs/dbraw/zinc/18/72/35/793187235.db2.gz LTWZVZSWSSGCFP-ZRUFSTJUSA-N 2 0 369.857 -1.681 20 0 FAADRP COC[C@H]([NH3+])C(=O)n1cnc(N)c(Cl)c1=NC[C@@H]1CC[NH2+]C[C@@H]1O ZINC001218776544 793186758 /nfs/dbraw/zinc/18/67/58/793186758.db2.gz MAULFXTYGUVSEV-GUBZILKMSA-N 2 0 358.830 -1.396 20 0 FAADRP COC[C@H]([NH3+])C(=O)n1cnc(N)c(Cl)c1=NC[C@H]1CC[NH2+]C[C@H]1O ZINC001218776545 793187139 /nfs/dbraw/zinc/18/71/39/793187139.db2.gz MAULFXTYGUVSEV-KXUCPTDWSA-N 2 0 358.830 -1.396 20 0 FAADRP COC[C@H]([NH3+])C(=O)n1cnc(N)c(Cl)c1=NC[C@@H]1CC[NH2+]C[C@H]1O ZINC001218776546 793186788 /nfs/dbraw/zinc/18/67/88/793186788.db2.gz MAULFXTYGUVSEV-LPEHRKFASA-N 2 0 358.830 -1.396 20 0 FAADRP COC[C@H]([NH3+])C(=O)n1cnc(N)c(Cl)c1=NC[C@H]1CC[NH2+]C[C@@H]1O ZINC001218776547 793187103 /nfs/dbraw/zinc/18/71/03/793187103.db2.gz MAULFXTYGUVSEV-UTLUCORTSA-N 2 0 358.830 -1.396 20 0 FAADRP Nc1ncn(C(=O)C[C@@H](O)C[NH3+])c(=NC[C@@H]2CC[NH2+]C[C@@H]2O)c1Cl ZINC001218777076 793186840 /nfs/dbraw/zinc/18/68/40/793186840.db2.gz IGGGNPBXJYCQPO-AEJSXWLSSA-N 2 0 358.830 -1.660 20 0 FAADRP Nc1ncn(C(=O)C[C@@H](O)C[NH3+])c(=NC[C@H]2CC[NH2+]C[C@@H]2O)c1Cl ZINC001218777077 793187163 /nfs/dbraw/zinc/18/71/63/793187163.db2.gz IGGGNPBXJYCQPO-BBBLOLIVSA-N 2 0 358.830 -1.660 20 0 FAADRP Nc1ncn(C(=O)C[C@@H](O)C[NH3+])c(=NC[C@@H]2CC[NH2+]C[C@H]2O)c1Cl ZINC001218777078 793187076 /nfs/dbraw/zinc/18/70/76/793187076.db2.gz IGGGNPBXJYCQPO-IVZWLZJFSA-N 2 0 358.830 -1.660 20 0 FAADRP Nc1ncn(C(=O)C[C@@H](O)C[NH3+])c(=NC[C@H]2CC[NH2+]C[C@H]2O)c1Cl ZINC001218777079 793187037 /nfs/dbraw/zinc/18/70/37/793187037.db2.gz IGGGNPBXJYCQPO-OPRDCNLKSA-N 2 0 358.830 -1.660 20 0 FAADRP C[NH2+][C@H](C(=O)n1cnc(N)c(Cl)c1=NC[C@H]1CC[NH2+]C[C@H]1O)[C@@H](C)O ZINC001218777650 793187046 /nfs/dbraw/zinc/18/70/46/793187046.db2.gz QLVWSYTYFFYWDG-BFLSOPEQSA-N 2 0 372.857 -1.401 20 0 FAADRP C[NH2+][C@H](C(=O)n1cnc(N)c(Cl)c1=NC[C@@H]1CC[NH2+]C[C@H]1O)[C@@H](C)O ZINC001218777657 793186736 /nfs/dbraw/zinc/18/67/36/793186736.db2.gz QLVWSYTYFFYWDG-KLBPJQLPSA-N 2 0 372.857 -1.401 20 0 FAADRP C[NH2+][C@H](C(=O)n1cnc(N)c(Cl)c1=NC[C@H]1CC[NH2+]C[C@@H]1O)[C@@H](C)O ZINC001218777661 793187122 /nfs/dbraw/zinc/18/71/22/793187122.db2.gz QLVWSYTYFFYWDG-SVDPJWKOSA-N 2 0 372.857 -1.401 20 0 FAADRP C[NH2+][C@H](C(=O)n1cnc(N)c(Cl)c1=NC[C@@H]1CC[NH2+]C[C@@H]1O)[C@@H](C)O ZINC001218777664 793187210 /nfs/dbraw/zinc/18/72/10/793187210.db2.gz QLVWSYTYFFYWDG-WDCWCFNPSA-N 2 0 372.857 -1.401 20 0 FAADRP Nc1ncn(C(=O)[C@@H]([NH3+])CCC[NH3+])c(=NC[C@@H]2CC[NH2+]C[C@@H]2O)c1Cl ZINC001218777744 793188131 /nfs/dbraw/zinc/18/81/31/793188131.db2.gz JWCUSOFKAHWHKA-DCAQKATOSA-N 3 0 371.873 -1.304 20 0 FAADRP Nc1ncn(C(=O)[C@@H]([NH3+])CCC[NH3+])c(=NC[C@@H]2CC[NH2+]C[C@H]2O)c1Cl ZINC001218777747 793187759 /nfs/dbraw/zinc/18/77/59/793187759.db2.gz JWCUSOFKAHWHKA-GARJFASQSA-N 3 0 371.873 -1.304 20 0 FAADRP Nc1ncn(C(=O)CNCC[NH3+])c(=NC[C@H]2CC[NH2+]C[C@H]2O)c1Cl ZINC001218777973 793188017 /nfs/dbraw/zinc/18/80/17/793188017.db2.gz GPXXWDARYYJMIE-NXEZZACHSA-N 2 0 357.846 -1.822 20 0 FAADRP Nc1ncn(C(=O)CNCC[NH3+])c(=NC[C@@H]2CC[NH2+]C[C@@H]2O)c1Cl ZINC001218777979 793188225 /nfs/dbraw/zinc/18/82/25/793188225.db2.gz GPXXWDARYYJMIE-UWVGGRQHSA-N 2 0 357.846 -1.822 20 0 FAADRP Nc1ncn(C(=O)CNCC[NH3+])c(=NC[C@@H]2CC[NH2+]C[C@H]2O)c1Cl ZINC001218777980 793188085 /nfs/dbraw/zinc/18/80/85/793188085.db2.gz GPXXWDARYYJMIE-VHSXEESVSA-N 2 0 357.846 -1.822 20 0 FAADRP Nc1ncn(C(=O)CNCC[NH3+])c(=NC[C@H]2CC[NH2+]C[C@@H]2O)c1Cl ZINC001218777982 793188077 /nfs/dbraw/zinc/18/80/77/793188077.db2.gz GPXXWDARYYJMIE-ZJUUUORDSA-N 2 0 357.846 -1.822 20 0 FAADRP Nc1ncn(C(=O)[C@@H]([NH3+])CCC[NH3+])c(=NC[C@H]2CC[NH2+]C[C@H]2O)c1Cl ZINC001218778056 793187845 /nfs/dbraw/zinc/18/78/45/793187845.db2.gz JWCUSOFKAHWHKA-OUAUKWLOSA-N 3 0 371.873 -1.304 20 0 FAADRP Nc1ncn(C(=O)[C@@H]([NH3+])CCC[NH3+])c(=NC[C@H]2CC[NH2+]C[C@@H]2O)c1Cl ZINC001218778057 793188035 /nfs/dbraw/zinc/18/80/35/793188035.db2.gz JWCUSOFKAHWHKA-VWYCJHECSA-N 3 0 371.873 -1.304 20 0 FAADRP Nc1ncn(C(=O)[C@H]2C[NH2+]C[C@@H]2N)c(=NC[C@@H]2CC[NH2+]C[C@@H]2O)c1Cl ZINC001218778416 793188057 /nfs/dbraw/zinc/18/80/57/793188057.db2.gz HLMDZAZEYHWHBI-NAKRPEOUSA-N 2 0 369.857 -1.823 20 0 FAADRP Nc1ncn(C(=O)[C@H]2C[NH2+]C[C@@H]2N)c(=NC[C@H]2CC[NH2+]C[C@@H]2O)c1Cl ZINC001218778417 793188091 /nfs/dbraw/zinc/18/80/91/793188091.db2.gz HLMDZAZEYHWHBI-RCWTZXSCSA-N 2 0 369.857 -1.823 20 0 FAADRP Nc1ncn(C(=O)[C@H]2C[NH2+]C[C@@H]2N)c(=NC[C@H]2CC[NH2+]C[C@H]2O)c1Cl ZINC001218778418 793187923 /nfs/dbraw/zinc/18/79/23/793187923.db2.gz HLMDZAZEYHWHBI-VPOLOUISSA-N 2 0 369.857 -1.823 20 0 FAADRP Nc1ncn(C(=O)[C@H]2C[NH2+]C[C@@H]2N)c(=NC[C@@H]2CC[NH2+]C[C@H]2O)c1Cl ZINC001218778419 793188147 /nfs/dbraw/zinc/18/81/47/793188147.db2.gz HLMDZAZEYHWHBI-XWLWVQCSSA-N 2 0 369.857 -1.823 20 0 FAADRP Nc1ncn(C(=O)[C@@H]2C[NH2+]CCN2)c(=NC[C@@H]2CC[NH2+]C[C@@H]2O)c1Cl ZINC001218779073 793187857 /nfs/dbraw/zinc/18/78/57/793187857.db2.gz KCBXKHBEGLBMCK-DCAQKATOSA-N 2 0 369.857 -1.809 20 0 FAADRP Nc1ncn(C(=O)[C@@H]2C[NH2+]CCN2)c(=NC[C@@H]2CC[NH2+]C[C@H]2O)c1Cl ZINC001218779074 793188212 /nfs/dbraw/zinc/18/82/12/793188212.db2.gz KCBXKHBEGLBMCK-GARJFASQSA-N 2 0 369.857 -1.809 20 0 FAADRP Nc1ncn(C(=O)[C@@H]2C[NH2+]CCN2)c(=NC[C@H]2CC[NH2+]C[C@H]2O)c1Cl ZINC001218779103 793188126 /nfs/dbraw/zinc/18/81/26/793188126.db2.gz KCBXKHBEGLBMCK-OUAUKWLOSA-N 2 0 369.857 -1.809 20 0 FAADRP Nc1ncn(C(=O)[C@@H]2C[NH2+]CCN2)c(=NC[C@H]2CC[NH2+]C[C@@H]2O)c1Cl ZINC001218779108 793188219 /nfs/dbraw/zinc/18/82/19/793188219.db2.gz KCBXKHBEGLBMCK-VWYCJHECSA-N 2 0 369.857 -1.809 20 0 FAADRP CO[C@@H](C[NH3+])C(=O)n1cnc(N)c(Cl)c1=NC[C@@H]1CC[NH2+]C[C@H]1O ZINC001218779265 793188000 /nfs/dbraw/zinc/18/80/00/793188000.db2.gz KUNNPKLWFOBAQC-AEJSXWLSSA-N 2 0 358.830 -1.396 20 0 FAADRP CO[C@@H](C[NH3+])C(=O)n1cnc(N)c(Cl)c1=NC[C@H]1CC[NH2+]C[C@H]1O ZINC001218779267 793187772 /nfs/dbraw/zinc/18/77/72/793187772.db2.gz KUNNPKLWFOBAQC-BBBLOLIVSA-N 2 0 358.830 -1.396 20 0 FAADRP CO[C@@H](C[NH3+])C(=O)n1cnc(N)c(Cl)c1=NC[C@@H]1CC[NH2+]C[C@@H]1O ZINC001218779269 793187834 /nfs/dbraw/zinc/18/78/34/793187834.db2.gz KUNNPKLWFOBAQC-GUBZILKMSA-N 2 0 358.830 -1.396 20 0 FAADRP CO[C@@H](C[NH3+])C(=O)n1cnc(N)c(Cl)c1=NC[C@H]1CC[NH2+]C[C@@H]1O ZINC001218779272 793187910 /nfs/dbraw/zinc/18/79/10/793187910.db2.gz KUNNPKLWFOBAQC-UTLUCORTSA-N 2 0 358.830 -1.396 20 0 FAADRP Nc1ncn(C(=O)[C@@H]2C[C@H]([NH3+])CN2)c(=NC[C@@H]2CC[NH2+]C[C@@H]2O)c1Cl ZINC001218779776 793187893 /nfs/dbraw/zinc/18/78/93/793187893.db2.gz LTWZVZSWSSGCFP-NAKRPEOUSA-N 2 0 369.857 -1.681 20 0 FAADRP Nc1ncn(C(=O)[C@@H]2C[C@H]([NH3+])CN2)c(=NC[C@H]2CC[NH2+]C[C@@H]2O)c1Cl ZINC001218779778 793187780 /nfs/dbraw/zinc/18/77/80/793187780.db2.gz LTWZVZSWSSGCFP-RCWTZXSCSA-N 2 0 369.857 -1.681 20 0 FAADRP Nc1ncn(C(=O)[C@@H]2C[C@H]([NH3+])CN2)c(=NC[C@H]2CC[NH2+]C[C@H]2O)c1Cl ZINC001218779780 793187801 /nfs/dbraw/zinc/18/78/01/793187801.db2.gz LTWZVZSWSSGCFP-VPOLOUISSA-N 2 0 369.857 -1.681 20 0 FAADRP Nc1ncn(C(=O)[C@@H]2C[C@H]([NH3+])CN2)c(=NC[C@@H]2CC[NH2+]C[C@H]2O)c1Cl ZINC001218779781 793187958 /nfs/dbraw/zinc/18/79/58/793187958.db2.gz LTWZVZSWSSGCFP-XWLWVQCSSA-N 2 0 369.857 -1.681 20 0 FAADRP C[NH2+][C@@H](CO)C(=O)n1cnc(N)c(Cl)c1=NC[C@@H]1CC[NH2+]C[C@@H]1O ZINC001218780041 793188204 /nfs/dbraw/zinc/18/82/04/793188204.db2.gz YQXMTMALCHZDLG-GUBZILKMSA-N 2 0 358.830 -1.790 20 0 FAADRP C[NH2+][C@@H](CO)C(=O)n1cnc(N)c(Cl)c1=NC[C@H]1CC[NH2+]C[C@H]1O ZINC001218780042 793188195 /nfs/dbraw/zinc/18/81/95/793188195.db2.gz YQXMTMALCHZDLG-KXUCPTDWSA-N 2 0 358.830 -1.790 20 0 FAADRP C[NH2+][C@@H](CO)C(=O)n1cnc(N)c(Cl)c1=NC[C@@H]1CC[NH2+]C[C@H]1O ZINC001218780043 793188170 /nfs/dbraw/zinc/18/81/70/793188170.db2.gz YQXMTMALCHZDLG-LPEHRKFASA-N 2 0 358.830 -1.790 20 0 FAADRP C[NH2+][C@@H](CO)C(=O)n1cnc(N)c(Cl)c1=NC[C@H]1CC[NH2+]C[C@@H]1O ZINC001218780045 793187986 /nfs/dbraw/zinc/18/79/86/793187986.db2.gz YQXMTMALCHZDLG-UTLUCORTSA-N 2 0 358.830 -1.790 20 0 FAADRP Nc1ncn(C(=O)C[C@H]([NH3+])CO)c(=NC[C@@H]2CC[NH2+]C[C@@H]2O)c1Cl ZINC001218780532 793188183 /nfs/dbraw/zinc/18/81/83/793188183.db2.gz ZWMYWGRLRIRZPI-GUBZILKMSA-N 2 0 358.830 -1.660 20 0 FAADRP Nc1ncn(C(=O)C[C@H]([NH3+])CO)c(=NC[C@H]2CC[NH2+]C[C@H]2O)c1Cl ZINC001218780533 793187948 /nfs/dbraw/zinc/18/79/48/793187948.db2.gz ZWMYWGRLRIRZPI-KXUCPTDWSA-N 2 0 358.830 -1.660 20 0 FAADRP Nc1ncn(C(=O)C[C@H]([NH3+])CO)c(=NC[C@@H]2CC[NH2+]C[C@H]2O)c1Cl ZINC001218780534 793188029 /nfs/dbraw/zinc/18/80/29/793188029.db2.gz ZWMYWGRLRIRZPI-LPEHRKFASA-N 2 0 358.830 -1.660 20 0 FAADRP Nc1ncn(C(=O)C[C@H]([NH3+])CO)c(=NC[C@H]2CC[NH2+]C[C@@H]2O)c1Cl ZINC001218780535 793187942 /nfs/dbraw/zinc/18/79/42/793187942.db2.gz ZWMYWGRLRIRZPI-UTLUCORTSA-N 2 0 358.830 -1.660 20 0 FAADRP Nc1ncn(C(=O)[C@@H]2C[NH2+]C[C@@H]2O)c(=NC[C@H]2CC[NH2+]C[C@H]2O)c1Cl ZINC001218780945 793188070 /nfs/dbraw/zinc/18/80/70/793188070.db2.gz OKHSNNAIOZRVCK-DBIOUOCHSA-N 2 0 370.841 -1.790 20 0 FAADRP Nc1ncn(C(=O)[C@@H]2C[NH2+]C[C@@H]2O)c(=NC[C@@H]2CC[NH2+]C[C@@H]2O)c1Cl ZINC001218780948 793187862 /nfs/dbraw/zinc/18/78/62/793187862.db2.gz OKHSNNAIOZRVCK-VLEAKVRGSA-N 2 0 370.841 -1.790 20 0 FAADRP Nc1ncn(C(=O)[C@@H]2C[NH2+]C[C@@H]2O)c(=NC[C@@H]2CC[NH2+]C[C@H]2O)c1Cl ZINC001218780950 793188011 /nfs/dbraw/zinc/18/80/11/793188011.db2.gz OKHSNNAIOZRVCK-ZDCRXTMVSA-N 2 0 370.841 -1.790 20 0 FAADRP Nc1ncn(C(=O)[C@@H]2C[NH2+]C[C@@H]2O)c(=NC[C@H]2CC[NH2+]C[C@@H]2O)c1Cl ZINC001218780952 793188049 /nfs/dbraw/zinc/18/80/49/793188049.db2.gz OKHSNNAIOZRVCK-ZNSHCXBVSA-N 2 0 370.841 -1.790 20 0 FAADRP Nc1ncn(C(=O)[C@H]2[NH2+]CC[C@@H]2O)c(=NC[C@@H]2CC[NH2+]C[C@@H]2O)c1Cl ZINC001218781459 793187952 /nfs/dbraw/zinc/18/79/52/793187952.db2.gz QBLOLEZTJBAPHD-GMOBBJLQSA-N 2 0 370.841 -1.647 20 0 FAADRP Nc1ncn(C(=O)[C@H]2[NH2+]CC[C@@H]2O)c(=NC[C@@H]2CC[NH2+]C[C@H]2O)c1Cl ZINC001218781463 793188897 /nfs/dbraw/zinc/18/88/97/793188897.db2.gz QBLOLEZTJBAPHD-GUDRVLHUSA-N 2 0 370.841 -1.647 20 0 FAADRP Nc1ncn(C(=O)[C@H]2[NH2+]CC[C@@H]2O)c(=NC[C@H]2CC[NH2+]C[C@H]2O)c1Cl ZINC001218781466 793189372 /nfs/dbraw/zinc/18/93/72/793189372.db2.gz QBLOLEZTJBAPHD-KLBPJQLPSA-N 2 0 370.841 -1.647 20 0 FAADRP Nc1ncn(C(=O)[C@H]2[NH2+]CC[C@@H]2O)c(=NC[C@H]2CC[NH2+]C[C@@H]2O)c1Cl ZINC001218781470 793189065 /nfs/dbraw/zinc/18/90/65/793189065.db2.gz QBLOLEZTJBAPHD-WDCWCFNPSA-N 2 0 370.841 -1.647 20 0 FAADRP C[C@@H](O)[C@H]([NH3+])C(=O)n1cnc(N)c(Cl)c1=NC[C@H]1CC[NH2+]C[C@H]1O ZINC001218782167 793189220 /nfs/dbraw/zinc/18/92/20/793189220.db2.gz TUHSDPSUXLHBNK-CDLYGTGVSA-N 2 0 358.830 -1.662 20 0 FAADRP C[C@@H](O)[C@H]([NH3+])C(=O)n1cnc(N)c(Cl)c1=NC[C@@H]1CC[NH2+]C[C@@H]1O ZINC001218782168 793188682 /nfs/dbraw/zinc/18/86/82/793188682.db2.gz TUHSDPSUXLHBNK-HJGDQZAQSA-N 2 0 358.830 -1.662 20 0 FAADRP C[C@@H](O)[C@H]([NH3+])C(=O)n1cnc(N)c(Cl)c1=NC[C@@H]1CC[NH2+]C[C@H]1O ZINC001218782169 793188847 /nfs/dbraw/zinc/18/88/47/793188847.db2.gz TUHSDPSUXLHBNK-LOKLDPHHSA-N 2 0 358.830 -1.662 20 0 FAADRP C[C@@H](O)[C@H]([NH3+])C(=O)n1cnc(N)c(Cl)c1=NC[C@H]1CC[NH2+]C[C@@H]1O ZINC001218782170 793189346 /nfs/dbraw/zinc/18/93/46/793189346.db2.gz TUHSDPSUXLHBNK-REIXXSIJSA-N 2 0 358.830 -1.662 20 0 FAADRP Nc1ncn(C(=O)CNC(=O)C[NH3+])c(=NC[C@H]2CC[NH2+]C[C@@H]2O)c1Cl ZINC001218783437 793188874 /nfs/dbraw/zinc/18/88/74/793188874.db2.gz XJNOVHJHHADCGW-BDAKNGLRSA-N 2 0 371.829 -2.295 20 0 FAADRP Nc1ncn(C(=O)CNC(=O)C[NH3+])c(=NC[C@@H]2CC[NH2+]C[C@H]2O)c1Cl ZINC001218783448 793188783 /nfs/dbraw/zinc/18/87/83/793188783.db2.gz XJNOVHJHHADCGW-DTWKUNHWSA-N 2 0 371.829 -2.295 20 0 FAADRP Nc1ncn(C(=O)CNC(=O)C[NH3+])c(=NC[C@@H]2CC[NH2+]C[C@@H]2O)c1Cl ZINC001218783450 793188833 /nfs/dbraw/zinc/18/88/33/793188833.db2.gz XJNOVHJHHADCGW-IUCAKERBSA-N 2 0 371.829 -2.295 20 0 FAADRP Nc1ncn(C(=O)CNC(=O)C[NH3+])c(=NC[C@H]2CC[NH2+]C[C@H]2O)c1Cl ZINC001218783451 793189038 /nfs/dbraw/zinc/18/90/38/793189038.db2.gz XJNOVHJHHADCGW-RKDXNWHRSA-N 2 0 371.829 -2.295 20 0 FAADRP C[C@]([NH3+])(CO)C(=O)n1cnc(N)c(Cl)c1=NC[C@@H]1CC[NH2+]C[C@@H]1O ZINC001218783468 793189314 /nfs/dbraw/zinc/18/93/14/793189314.db2.gz XMTOIZGTAQCYMH-FZNYLWTLSA-N 2 0 358.830 -1.660 20 0 FAADRP C[C@]([NH3+])(CO)C(=O)n1cnc(N)c(Cl)c1=NC[C@H]1CC[NH2+]C[C@@H]1O ZINC001218783470 793189052 /nfs/dbraw/zinc/18/90/52/793189052.db2.gz XMTOIZGTAQCYMH-ITMYJUKJSA-N 2 0 358.830 -1.660 20 0 FAADRP C[C@]([NH3+])(CO)C(=O)n1cnc(N)c(Cl)c1=NC[C@H]1CC[NH2+]C[C@H]1O ZINC001218783472 793189360 /nfs/dbraw/zinc/18/93/60/793189360.db2.gz XMTOIZGTAQCYMH-NUPCCRGMSA-N 2 0 358.830 -1.660 20 0 FAADRP C[C@]([NH3+])(CO)C(=O)n1cnc(N)c(Cl)c1=NC[C@@H]1CC[NH2+]C[C@H]1O ZINC001218783474 793189022 /nfs/dbraw/zinc/18/90/22/793189022.db2.gz XMTOIZGTAQCYMH-QIBSRJKCSA-N 2 0 358.830 -1.660 20 0 FAADRP Nc1ncn(C(=O)CNCCC[NH3+])c(=NC[C@H]2CC[NH2+]C[C@H]2O)c1Cl ZINC001218785112 793189283 /nfs/dbraw/zinc/18/92/83/793189283.db2.gz RNRLWWRIIJTUAI-GHMZBOCLSA-N 2 0 371.873 -1.432 20 0 FAADRP Nc1ncn(C(=O)CNCCC[NH3+])c(=NC[C@H]2CC[NH2+]C[C@@H]2O)c1Cl ZINC001218785113 793189397 /nfs/dbraw/zinc/18/93/97/793189397.db2.gz RNRLWWRIIJTUAI-MNOVXSKESA-N 2 0 371.873 -1.432 20 0 FAADRP Nc1ncn(C(=O)CNCCC[NH3+])c(=NC[C@@H]2CC[NH2+]C[C@@H]2O)c1Cl ZINC001218785114 793189201 /nfs/dbraw/zinc/18/92/01/793189201.db2.gz RNRLWWRIIJTUAI-QWRGUYRKSA-N 2 0 371.873 -1.432 20 0 FAADRP Nc1ncn(C(=O)CNCCC[NH3+])c(=NC[C@@H]2CC[NH2+]C[C@H]2O)c1Cl ZINC001218785115 793189419 /nfs/dbraw/zinc/18/94/19/793189419.db2.gz RNRLWWRIIJTUAI-WDEREUQCSA-N 2 0 371.873 -1.432 20 0 FAADRP Nc1ncn(C(=O)[C@H]2COC[C@H]2[NH3+])c(=NC[C@H]2CC[NH2+]C[C@H]2O)c1Cl ZINC001218786207 793189147 /nfs/dbraw/zinc/18/91/47/793189147.db2.gz WFYHOXWWULRHFC-LMLFDSFASA-N 2 0 370.841 -1.396 20 0 FAADRP Nc1ncn(C(=O)[C@H]2COC[C@H]2[NH3+])c(=NC[C@@H]2CC[NH2+]C[C@@H]2O)c1Cl ZINC001218786210 793189122 /nfs/dbraw/zinc/18/91/22/793189122.db2.gz WFYHOXWWULRHFC-MMWGEVLESA-N 2 0 370.841 -1.396 20 0 FAADRP Nc1ncn(C(=O)[C@H]2COC[C@H]2[NH3+])c(=NC[C@@H]2CC[NH2+]C[C@H]2O)c1Cl ZINC001218786213 793189091 /nfs/dbraw/zinc/18/90/91/793189091.db2.gz WFYHOXWWULRHFC-UKKRHICBSA-N 2 0 370.841 -1.396 20 0 FAADRP Nc1ncn(C(=O)[C@H]2COC[C@H]2[NH3+])c(=NC[C@H]2CC[NH2+]C[C@@H]2O)c1Cl ZINC001218786215 793189084 /nfs/dbraw/zinc/18/90/84/793189084.db2.gz WFYHOXWWULRHFC-YTWAJWBKSA-N 2 0 370.841 -1.396 20 0 FAADRP Nc1ccc(S(N)(=O)=O)cc1NC(=O)[C@H]([NH3+])CN1CCC([NH3+])CC1 ZINC001218912956 793192180 /nfs/dbraw/zinc/19/21/80/793192180.db2.gz HBGLIFHAXIPOEY-GFCCVEGCSA-N 2 0 356.452 -1.395 20 0 FAADRP Nc1ccc(S(N)(=O)=O)cc1NC(=O)[C@@H]([NH3+])CN1CCC([NH3+])CC1 ZINC001218912957 793192161 /nfs/dbraw/zinc/19/21/61/793192161.db2.gz HBGLIFHAXIPOEY-LBPRGKRZSA-N 2 0 356.452 -1.395 20 0 FAADRP C[NH+](C)CCOCC(=O)N1CCO[C@@H]2C[N@@H+]([C@@H]3CCCNC3=O)C[C@@H]21 ZINC001218971234 793194187 /nfs/dbraw/zinc/19/41/87/793194187.db2.gz VEEARIIVHDFGPF-QLFBSQMISA-N 2 0 354.451 -1.245 20 0 FAADRP C[NH+](C)CCOCC(=O)N1CCO[C@@H]2C[N@@H+]([C@H]3CCCNC3=O)C[C@@H]21 ZINC001218971236 793194029 /nfs/dbraw/zinc/19/40/29/793194029.db2.gz VEEARIIVHDFGPF-SOUVJXGZSA-N 2 0 354.451 -1.245 20 0 FAADRP CS(=O)(=O)N(CC[NH3+])C(=O)[C@@H]1C[NH2+]CC12CCS(=O)(=O)CC2 ZINC001219593845 793297471 /nfs/dbraw/zinc/29/74/71/793297471.db2.gz MJOLYZLTHYANOF-JTQLQIEISA-N 2 0 353.466 -1.852 20 0 FAADRP CS(=O)(=O)N(CC[NH3+])C(=O)[C@H]1C[NH2+]CC12CCS(=O)(=O)CC2 ZINC001219593846 793297629 /nfs/dbraw/zinc/29/76/29/793297629.db2.gz MJOLYZLTHYANOF-SNVBAGLBSA-N 2 0 353.466 -1.852 20 0 FAADRP C[C@H](NC(=O)[C@@H]1CCCN1C(=O)C[NH3+])C(=O)N(CC[NH3+])S(C)(=O)=O ZINC001219595637 793296918 /nfs/dbraw/zinc/29/69/18/793296918.db2.gz JDVBOUYTKGHCMU-UWVGGRQHSA-N 2 0 363.440 -2.812 20 0 FAADRP CS(=O)(=O)N(CC[NH3+])C(=O)[C@@H]1CCCN1C(=O)[C@@H]([NH3+])CCCC[NH3+] ZINC001219595838 793297184 /nfs/dbraw/zinc/29/71/84/793297184.db2.gz SEEJPWCWESCZNF-RYUDHWBXSA-N 3 0 363.484 -1.819 20 0 FAADRP CS(=O)(=O)N(CC[NH3+])C(=O)CNC(=O)CNC(=O)CNC(=O)C[NH3+] ZINC001219595860 793297221 /nfs/dbraw/zinc/29/72/21/793297221.db2.gz TYVDBDDKDAZCOT-UHFFFAOYSA-N 2 0 366.400 -4.959 20 0 FAADRP C[C@H]([NH3+])C(=O)N[C@H](CCC(=O)N[C@]1(C(F)(F)F)CC[NH2+]C1)C(N)=O ZINC001219614078 793302763 /nfs/dbraw/zinc/30/27/63/793302763.db2.gz RIIYYGGZOKPQRL-JOAULVNJSA-N 2 0 353.345 -1.506 20 0 FAADRP C[C@H]([NH3+])C(=O)N[C@H](CCC(=O)N[C@@]1(C(F)(F)F)CC[NH2+]C1)C(N)=O ZINC001219614079 793302110 /nfs/dbraw/zinc/30/21/10/793302110.db2.gz RIIYYGGZOKPQRL-SXMVTHIZSA-N 2 0 353.345 -1.506 20 0 FAADRP O=C(NC[C@]1(O)CC[NH2+]C[C@@H]1F)[C@H]1Cn2cnnc2C12CC[NH2+]CC2 ZINC001219615891 793304579 /nfs/dbraw/zinc/30/45/79/793304579.db2.gz HVNJFSZYIIIVRJ-BFQNTYOBSA-N 2 0 352.414 -1.292 20 0 FAADRP O=C(NC[C@]1(O)CC[NH2+]C[C@@H]1F)[C@@H]1Cn2cnnc2C12CC[NH2+]CC2 ZINC001219615892 793303669 /nfs/dbraw/zinc/30/36/69/793303669.db2.gz HVNJFSZYIIIVRJ-MQIPJXDCSA-N 2 0 352.414 -1.292 20 0 FAADRP O=C(NC[C@]1(O)CC[NH2+]C[C@@H]1F)[C@H]1Cn2nnnc2C12CC[NH2+]CC2 ZINC001219616208 793304068 /nfs/dbraw/zinc/30/40/68/793304068.db2.gz SHJOIBNMKIUJMU-JRPNMDOOSA-N 2 0 353.402 -1.897 20 0 FAADRP O=C(NC[C@]1(O)CC[NH2+]C[C@@H]1F)[C@@H]1Cn2nnnc2C12CC[NH2+]CC2 ZINC001219616209 793304314 /nfs/dbraw/zinc/30/43/14/793304314.db2.gz SHJOIBNMKIUJMU-ZIBATOQPSA-N 2 0 353.402 -1.897 20 0 FAADRP O=C(NC[C@]1(O)CC[NH2+]C[C@@H]1F)[C@@H]1C[NH2+]CC12CCS(=O)(=O)CC2 ZINC001219616647 793304341 /nfs/dbraw/zinc/30/43/41/793304341.db2.gz AYSSQKZHFGOGHS-SLEUVZQESA-N 2 0 363.455 -1.421 20 0 FAADRP O=C(NC[C@]1(O)CC[NH2+]C[C@@H]1F)[C@H]1C[NH2+]CC12CCS(=O)(=O)CC2 ZINC001219616651 793304167 /nfs/dbraw/zinc/30/41/67/793304167.db2.gz AYSSQKZHFGOGHS-TYNCELHUSA-N 2 0 363.455 -1.421 20 0 FAADRP [NH3+]CC(=O)N[C@@H](Cc1ccccc1)C(=O)NC[C@]1(O)CC[NH2+]C[C@@H]1F ZINC001219621596 793308608 /nfs/dbraw/zinc/30/86/08/793308608.db2.gz FCNDYPUFFBKMFV-GRDNDAEWSA-N 2 0 352.410 -1.149 20 0 FAADRP [NH3+][C@@H](Cc1ccccc1)C(=O)NCC(=O)NC[C@]1(O)CC[NH2+]C[C@@H]1F ZINC001219622397 793308552 /nfs/dbraw/zinc/30/85/52/793308552.db2.gz UUYDWUYGSALOAY-GRDNDAEWSA-N 2 0 352.410 -1.149 20 0 FAADRP C[C@H](NC(=O)[C@@H]1CCCN1C(=O)C[NH3+])C(=O)NC[C@H]1C[NH2+]C[C@@H](C)C1 ZINC001219649874 793574593 /nfs/dbraw/zinc/57/45/93/793574593.db2.gz LNEVXIFIDVPLND-FQUUOJAGSA-N 2 0 353.467 -1.197 20 0 FAADRP C[C@H](NC(=O)[C@@H]1CCCN1C(=O)C[NH3+])C(=O)NC[C@@H]1C[NH2+]C[C@H](C)C1 ZINC001219649876 793574734 /nfs/dbraw/zinc/57/47/34/793574734.db2.gz LNEVXIFIDVPLND-RFGFWPKPSA-N 2 0 353.467 -1.197 20 0 FAADRP C[C@H](NC(=O)[C@@H]1CCCN1C(=O)C[NH3+])C(=O)NC[C@H]1C[NH2+]C[C@H](C)C1 ZINC001219649877 793574742 /nfs/dbraw/zinc/57/47/42/793574742.db2.gz LNEVXIFIDVPLND-RQJABVFESA-N 2 0 353.467 -1.197 20 0 FAADRP C[C@H](NC(=O)[C@@H]1CCCN1C(=O)C[NH3+])C(=O)NC[C@@H]1C[NH2+]C[C@@H](C)C1 ZINC001219649878 793574873 /nfs/dbraw/zinc/57/48/73/793574873.db2.gz LNEVXIFIDVPLND-XUXIUFHCSA-N 2 0 353.467 -1.197 20 0 FAADRP COC[C@@H](O)C[N@H+]1C[C@@H](NC(=O)c2ccn(CC[NH+](C)C)n2)[C@@H](O)C1 ZINC001219652372 793575638 /nfs/dbraw/zinc/57/56/38/793575638.db2.gz VTJNQOOOWLALEA-CFVMTHIKSA-N 2 0 355.439 -1.773 20 0 FAADRP COC[C@H](O)C[N@H+]1C[C@@H](NC(=O)c2ccn(CC[NH+](C)C)n2)[C@@H](O)C1 ZINC001219652373 793575539 /nfs/dbraw/zinc/57/55/39/793575539.db2.gz VTJNQOOOWLALEA-YUELXQCFSA-N 2 0 355.439 -1.773 20 0 FAADRP CC(=O)NCCOCC[NH+]1C[C@@H](NC(=O)[C@@H]2CC[N@H+](C)[C@@H]2C)[C@@H](O)C1 ZINC001219656166 793575477 /nfs/dbraw/zinc/57/54/77/793575477.db2.gz OAJSEMBTPXEQQY-MIGQKNRLSA-N 2 0 356.467 -1.359 20 0 FAADRP [NH3+]CCCC[C@H]([NH3+])C(=O)N1CCC[C@H]1C(=O)N[C@@H]1CCS(=O)(=O)C1 ZINC001219671912 793577928 /nfs/dbraw/zinc/57/79/28/793577928.db2.gz VVKSSAFCQPGNJK-AGIUHOORSA-N 2 0 360.480 -1.263 20 0 FAADRP [NH3+]CCCC[C@H]([NH3+])C(=O)N1CCC[C@H]1C(=O)N[C@H]1CCS(=O)(=O)C1 ZINC001219671913 793578665 /nfs/dbraw/zinc/57/86/65/793578665.db2.gz VVKSSAFCQPGNJK-AVGNSLFASA-N 2 0 360.480 -1.263 20 0 FAADRP O=C(NCCS(=O)(=O)N1CCNCC1)[C@H]1CCC2(CC[NH2+]CC2)[NH2+]1 ZINC001219676268 793580006 /nfs/dbraw/zinc/58/00/06/793580006.db2.gz DIFPEVMRNLRSBA-CYBMUJFWSA-N 2 0 359.496 -1.788 20 0 FAADRP O=C(NCCS(=O)(=O)N1CCNCC1)[C@@H]1CCC2(CC[NH2+]CC2)[NH2+]1 ZINC001219676269 793580089 /nfs/dbraw/zinc/58/00/89/793580089.db2.gz DIFPEVMRNLRSBA-ZDUSSCGKSA-N 2 0 359.496 -1.788 20 0 FAADRP [NH3+][C@H](CN1CCC([NH3+])CC1)C(=O)NCCS(=O)(=O)N1CCNCC1 ZINC001219678544 793581969 /nfs/dbraw/zinc/58/19/69/793581969.db2.gz SFOVKYFONQWZCX-CYBMUJFWSA-N 2 0 362.500 -2.912 20 0 FAADRP [NH3+][C@@H](CN1CCC([NH3+])CC1)C(=O)NCCS(=O)(=O)N1CCNCC1 ZINC001219678545 793582182 /nfs/dbraw/zinc/58/21/82/793582182.db2.gz SFOVKYFONQWZCX-ZDUSSCGKSA-N 2 0 362.500 -2.912 20 0 FAADRP CC(C)[NH2+]CCCC[C@H]([NH3+])C(=O)NCCS(=O)(=O)N1CCNCC1 ZINC001219678583 793581811 /nfs/dbraw/zinc/58/18/11/793581811.db2.gz USBUZCZIFKKOLU-AWEZNQCLSA-N 2 0 363.528 -1.167 20 0 FAADRP CN1CCO[C@H](CNC(=O)[C@@H]2CCCN2C(=O)[C@@H]([NH3+])CCCC[NH3+])C1 ZINC001219694451 793584897 /nfs/dbraw/zinc/58/48/97/793584897.db2.gz IZDJEGMFNLLHIE-ILXRZTDVSA-N 2 0 355.483 -1.120 20 0 FAADRP CN1CCO[C@@H](CNC(=O)[C@@H]2CCCN2C(=O)[C@@H]([NH3+])CCCC[NH3+])C1 ZINC001219694458 793585007 /nfs/dbraw/zinc/58/50/07/793585007.db2.gz IZDJEGMFNLLHIE-KKUMJFAQSA-N 2 0 355.483 -1.120 20 0 FAADRP CC(C)(C)OC[C@H]([NH3+])C(=O)N1CCC[C@H]1C(=O)NCCC1(O)C[NH2+]C1 ZINC001219696273 793584744 /nfs/dbraw/zinc/58/47/44/793584744.db2.gz FQCRSUGPQOZJEO-STQMWFEESA-N 2 0 356.467 -1.040 20 0 FAADRP CSCC[C@H]([NH3+])C(=O)N[C@@H](CCSC)C(=O)N[C@@H]1C[NH2+]C[C@H]1O ZINC001219714610 793585708 /nfs/dbraw/zinc/58/57/08/793585708.db2.gz QKRLWQZEYQVYLH-NNYUYHANSA-N 2 0 364.537 -1.246 20 0 FAADRP [NH3+][C@H](CSCNC(=O)Cc1ccccc1)C(=O)N[C@@H]1C[NH2+]C[C@H]1O ZINC001219714723 793585826 /nfs/dbraw/zinc/58/58/26/793585826.db2.gz VZIJMFQGTINTCD-MGPQQGTHSA-N 2 0 352.460 -1.188 20 0 FAADRP O=C(N[C@@H]1C[NH2+]C[C@H]1O)c1cccc(S(=O)(=O)NC2CC[NH2+]CC2)c1 ZINC001219714782 793585437 /nfs/dbraw/zinc/58/54/37/793585437.db2.gz XZDHVWAIVSOPQG-HUUCEWRRSA-N 2 0 368.459 -1.221 20 0 FAADRP O=C(NC[C@H]1CC2(C[NH2+]C2)CO1)[C@H]1C[NH2+]CC12CCS(=O)(=O)CC2 ZINC001219737561 793595805 /nfs/dbraw/zinc/59/58/05/793595805.db2.gz ZCJUKIFMFVKAOB-CHWSQXEVSA-N 2 0 357.476 -1.105 20 0 FAADRP O=C(NC[C@H]1CC2(C[NH2+]C2)CO1)[C@@H]1C[NH2+]CC12CCS(=O)(=O)CC2 ZINC001219737562 793596385 /nfs/dbraw/zinc/59/63/85/793596385.db2.gz ZCJUKIFMFVKAOB-OLZOCXBDSA-N 2 0 357.476 -1.105 20 0 FAADRP O=C(NC[C@@H]1CC2(C[NH2+]C2)CO1)[C@H]1C[NH2+]CC12CCS(=O)(=O)CC2 ZINC001219737563 793596062 /nfs/dbraw/zinc/59/60/62/793596062.db2.gz ZCJUKIFMFVKAOB-QWHCGFSZSA-N 2 0 357.476 -1.105 20 0 FAADRP O=C(NC[C@@H]1CC2(C[NH2+]C2)CO1)[C@@H]1C[NH2+]CC12CCS(=O)(=O)CC2 ZINC001219737564 793596264 /nfs/dbraw/zinc/59/62/64/793596264.db2.gz ZCJUKIFMFVKAOB-STQMWFEESA-N 2 0 357.476 -1.105 20 0 FAADRP C[C@H]([NH3+])C(=O)N[C@@H](CC(N)=O)C(=O)NC[C@@H]1CCC2(CC[NH2+]CC2)O1 ZINC001219743245 793599607 /nfs/dbraw/zinc/59/96/07/793599607.db2.gz AIRBSCJOXVXEBG-SRVKXCTJSA-N 2 0 355.439 -1.889 20 0 FAADRP C[C@H]([NH3+])C(=O)N[C@@H](CC(N)=O)C(=O)NC[C@H]1CCC2(CC[NH2+]CC2)O1 ZINC001219743246 793599404 /nfs/dbraw/zinc/59/94/04/793599404.db2.gz AIRBSCJOXVXEBG-TUAOUCFPSA-N 2 0 355.439 -1.889 20 0 FAADRP O=C(NCc1nnc2n1CCC[NH2+]C2)[C@@H]1CCS(=O)(=O)C12C[NH2+]C2 ZINC001219748799 793601043 /nfs/dbraw/zinc/60/10/43/793601043.db2.gz CNOJTFYNVXFKSW-JTQLQIEISA-N 2 0 354.436 -1.836 20 0 FAADRP O=C(NCc1nnc2n1CCC[NH2+]C2)[C@H]1CCS(=O)(=O)C12C[NH2+]C2 ZINC001219748800 793601099 /nfs/dbraw/zinc/60/10/99/793601099.db2.gz CNOJTFYNVXFKSW-SNVBAGLBSA-N 2 0 354.436 -1.836 20 0 FAADRP C[C@H]([NH3+])C(=O)N[C@@H](CC(N)=O)C(=O)NCc1nnc2n1CCC[NH2+]C2 ZINC001219749017 793601141 /nfs/dbraw/zinc/60/11/41/793601141.db2.gz HIHSDLUCXYSPPR-IUCAKERBSA-N 2 0 352.399 -2.905 20 0 FAADRP O=C(NC[C@H]1C[C@H]2CNCC[N@@H+]2C1)[C@@H]1C[NH2+]CC12CCS(=O)(=O)CC2 ZINC001219764769 793604578 /nfs/dbraw/zinc/60/45/78/793604578.db2.gz LJHBGQCODPZDSD-ILXRZTDVSA-N 2 0 370.519 -1.189 20 0 FAADRP O=C(NC[C@H]1C[C@H]2CNCC[N@@H+]2C1)[C@H]1C[NH2+]CC12CCS(=O)(=O)CC2 ZINC001219764770 793605299 /nfs/dbraw/zinc/60/52/99/793605299.db2.gz LJHBGQCODPZDSD-QLFBSQMISA-N 2 0 370.519 -1.189 20 0 FAADRP C[N@@H+]1C[C@H](C(=O)NC[C@H]2C[C@H]3CNCC[NH+]3C2)OC2(CC[NH2+]CC2)C1 ZINC001219764928 793604991 /nfs/dbraw/zinc/60/49/91/793604991.db2.gz PLTBWQKVYARQFE-OWCLPIDISA-N 3 0 351.495 -1.151 20 0 FAADRP C[N@@H+]1C[C@@H](C(=O)NC[C@H]2C[C@H]3CNCC[NH+]3C2)OC2(CC[NH2+]CC2)C1 ZINC001219764929 793605080 /nfs/dbraw/zinc/60/50/80/793605080.db2.gz PLTBWQKVYARQFE-PMPSAXMXSA-N 3 0 351.495 -1.151 20 0 FAADRP C[C@H]([NH3+])C(=O)N1[C@H](C(=O)NC[C@H]2C[C@H]3CNCC[N@@H+]3C2)COC1(C)C ZINC001219765820 793604605 /nfs/dbraw/zinc/60/46/05/793604605.db2.gz DITAHKVRVIBYRQ-CRWXNKLISA-N 2 0 353.467 -1.293 20 0 FAADRP C[C@H]([NH3+])C(=O)N[C@H](CCC(=O)NC[C@H]1C[C@H]2CNCC[N@@H+]2C1)C(N)=O ZINC001219766300 793604922 /nfs/dbraw/zinc/60/49/22/793604922.db2.gz PGUHKAXNMJRBHC-QNWHQSFQSA-N 2 0 354.455 -2.506 20 0 FAADRP C[C@H](NC(=O)[C@@H]1CCCN1C(=O)C[NH3+])C(=O)NC[C@]1(F)CCC[NH2+]C1 ZINC001219771043 793606038 /nfs/dbraw/zinc/60/60/38/793606038.db2.gz HJTQUHUGZRVXBP-MKBNYLNASA-N 2 0 357.430 -1.351 20 0 FAADRP C[C@H](NC(=O)[C@@H]1CCCN1C(=O)C[NH3+])C(=O)NC[C@@]1(F)CCC[NH2+]C1 ZINC001219771044 793605902 /nfs/dbraw/zinc/60/59/02/793605902.db2.gz HJTQUHUGZRVXBP-MQIPJXDCSA-N 2 0 357.430 -1.351 20 0 FAADRP CS(=O)(=O)N(CC[NH3+])CC(=O)NCC[C@@H]1C[NH2+]Cc2cccn2C1 ZINC001219787336 793606841 /nfs/dbraw/zinc/60/68/41/793606841.db2.gz ASPOAYZRDDDXDX-CYBMUJFWSA-N 2 0 357.480 -1.066 20 0 FAADRP CS(=O)(=O)N(CC[NH3+])CC(=O)NCC[C@H]1C[NH2+]Cc2cccn2C1 ZINC001219787337 793607516 /nfs/dbraw/zinc/60/75/16/793607516.db2.gz ASPOAYZRDDDXDX-ZDUSSCGKSA-N 2 0 357.480 -1.066 20 0 FAADRP CS(=O)(=O)N(CC[NH3+])CC(=O)NC1CC[NH+](C2CC[NH2+]CC2)CC1 ZINC001219796255 793608977 /nfs/dbraw/zinc/60/89/77/793608977.db2.gz SSOOVOMWCVQNQD-UHFFFAOYSA-N 3 0 361.512 -1.461 20 0 FAADRP C[NH+](C)C1(C(=O)N[C@@H]2C[N@H+](C[C@@H](O)Cn3cccn3)C[C@@H]2O)CCC1 ZINC001219798124 793608814 /nfs/dbraw/zinc/60/88/14/793608814.db2.gz FQUPPBOYJKFONG-KFWWJZLASA-N 2 0 351.451 -1.110 20 0 FAADRP C[NH+](C)C1(C(=O)N[C@@H]2C[N@H+](C[C@H](O)Cn3cccn3)C[C@@H]2O)CCC1 ZINC001219798125 793609258 /nfs/dbraw/zinc/60/92/58/793609258.db2.gz FQUPPBOYJKFONG-ZNMIVQPWSA-N 2 0 351.451 -1.110 20 0 FAADRP COCCOC[C@H](O)C[N@H+]1C[C@@H](NC(=O)C2([NH+](C)C)CCC2)[C@@H](O)C1 ZINC001219802019 793610516 /nfs/dbraw/zinc/61/05/16/793610516.db2.gz DFMFSNPMJZVZRB-KFWWJZLASA-N 2 0 359.467 -1.344 20 0 FAADRP COCCOC[C@@H](O)C[N@H+]1C[C@@H](NC(=O)C2([NH+](C)C)CCC2)[C@@H](O)C1 ZINC001219802020 793610295 /nfs/dbraw/zinc/61/02/95/793610295.db2.gz DFMFSNPMJZVZRB-ZNMIVQPWSA-N 2 0 359.467 -1.344 20 0 FAADRP C[C@H]([NH3+])C(=O)N[C@H](CCC(=O)NCC[C@@H]1CCOC12C[NH2+]C2)C(N)=O ZINC001219803463 793610414 /nfs/dbraw/zinc/61/04/14/793610414.db2.gz VBBAFBXVGCXJBX-QJPTWQEYSA-N 2 0 355.439 -2.031 20 0 FAADRP C[C@H]([NH3+])C(=O)N[C@H](CCC(=O)NCC[C@H]1CCOC12C[NH2+]C2)C(N)=O ZINC001219803464 793609704 /nfs/dbraw/zinc/60/97/04/793609704.db2.gz VBBAFBXVGCXJBX-SDDRHHMPSA-N 2 0 355.439 -2.031 20 0 FAADRP CC(=O)NCCOCC[N@H+]1C[C@@H](NC(=O)[C@@H](C2CC2)[NH+](C)C)[C@@H](O)C1 ZINC001219804345 793610061 /nfs/dbraw/zinc/61/00/61/793610061.db2.gz STUDLEVIRPBJJG-OWCLPIDISA-N 2 0 356.467 -1.359 20 0 FAADRP CC(=O)NCCOCC[N@H+]1C[C@@H](NC(=O)[C@H](C2CC2)[NH+](C)C)[C@@H](O)C1 ZINC001219804346 793610457 /nfs/dbraw/zinc/61/04/57/793610457.db2.gz STUDLEVIRPBJJG-PMPSAXMXSA-N 2 0 356.467 -1.359 20 0 FAADRP C[C@H]([NH3+])C(=O)N[C@H](CCC(=O)NCc1noc2c1C[NH2+]CC2)C(N)=O ZINC001219811729 793612660 /nfs/dbraw/zinc/61/26/60/793612660.db2.gz ZKBBGHLJOFJNDH-WCBMZHEXSA-N 2 0 352.395 -1.966 20 0 FAADRP O=C(NC[C@]12C[NH2+]C[C@H]1COC2)[C@@H]1C[NH2+]CC12CCS(=O)(=O)CC2 ZINC001219813649 793612369 /nfs/dbraw/zinc/61/23/69/793612369.db2.gz YIBNEXJJTMCSHB-XEZPLFJOSA-N 2 0 357.476 -1.247 20 0 FAADRP O=C(NC[C@]12C[NH2+]C[C@H]1COC2)[C@H]1C[NH2+]CC12CCS(=O)(=O)CC2 ZINC001219813650 793612335 /nfs/dbraw/zinc/61/23/35/793612335.db2.gz YIBNEXJJTMCSHB-ZENOOKHLSA-N 2 0 357.476 -1.247 20 0 FAADRP CC(=O)NCCOCC[NH+]1C[C@@H](NC(=O)C[N@@H+](C)C2CCC2)[C@@H](O)C1 ZINC001219814043 793612190 /nfs/dbraw/zinc/61/21/90/793612190.db2.gz PWMUDWCXKQOCTM-CVEARBPZSA-N 2 0 356.467 -1.215 20 0 FAADRP COCCOC[C@H](O)C[N@H+]1C[C@@H](NC(=O)C[NH+](C)C2CCC2)[C@@H](O)C1 ZINC001219814048 793612296 /nfs/dbraw/zinc/61/22/96/793612296.db2.gz QAGWRFXUKQCRIQ-OAGGEKHMSA-N 2 0 359.467 -1.344 20 0 FAADRP COCCOC[C@@H](O)C[N@H+]1C[C@@H](NC(=O)C[NH+](C)C2CCC2)[C@@H](O)C1 ZINC001219814049 793612159 /nfs/dbraw/zinc/61/21/59/793612159.db2.gz QAGWRFXUKQCRIQ-XHSDSOJGSA-N 2 0 359.467 -1.344 20 0 FAADRP C[N@H+](CC(=O)N[C@@H]1C[NH+](C[C@@H](O)Cn2cccn2)C[C@@H]1O)C1CCC1 ZINC001219815996 793612403 /nfs/dbraw/zinc/61/24/03/793612403.db2.gz UKVXLZUFHCVIDU-OAGGEKHMSA-N 2 0 351.451 -1.110 20 0 FAADRP C[N@H+](CC(=O)N[C@@H]1C[NH+](C[C@H](O)Cn2cccn2)C[C@@H]1O)C1CCC1 ZINC001219815997 793612218 /nfs/dbraw/zinc/61/22/18/793612218.db2.gz UKVXLZUFHCVIDU-XHSDSOJGSA-N 2 0 351.451 -1.110 20 0 FAADRP O=C(NC[C@H]1C[C@@H]2C[NH2+]C[C@@H]2O1)[C@@H]1C[NH2+]CC12CCS(=O)(=O)CC2 ZINC001219831730 793614195 /nfs/dbraw/zinc/61/41/95/793614195.db2.gz WCJUNKSHICXUIO-MQYQWHSLSA-N 2 0 357.476 -1.106 20 0 FAADRP O=C(NC[C@H]1C[C@@H]2C[NH2+]C[C@@H]2O1)[C@H]1C[NH2+]CC12CCS(=O)(=O)CC2 ZINC001219831731 793614409 /nfs/dbraw/zinc/61/44/09/793614409.db2.gz WCJUNKSHICXUIO-SYQHCUMBSA-N 2 0 357.476 -1.106 20 0 FAADRP O=C(NC[C@@H]1CO[C@@]2(C1)C[NH2+]CCOC2)[C@@H]1CCS(=O)(=O)C12C[NH2+]C2 ZINC001219834236 793615615 /nfs/dbraw/zinc/61/56/15/793615615.db2.gz OROMWZDYEPUAPK-IPYPFGDCSA-N 2 0 373.475 -1.726 20 0 FAADRP O=C(NC[C@@H]1CO[C@@]2(C1)C[NH2+]CCOC2)[C@H]1CCS(=O)(=O)C12C[NH2+]C2 ZINC001219834239 793615492 /nfs/dbraw/zinc/61/54/92/793615492.db2.gz OROMWZDYEPUAPK-NFAWXSAZSA-N 2 0 373.475 -1.726 20 0 FAADRP O=C(NC[C@@H]1CO[C@]2(C1)C[NH2+]CCOC2)[C@H]1CCS(=O)(=O)C12C[NH2+]C2 ZINC001219834241 793615512 /nfs/dbraw/zinc/61/55/12/793615512.db2.gz OROMWZDYEPUAPK-UMVBOHGHSA-N 2 0 373.475 -1.726 20 0 FAADRP O=C(NC[C@@H]1CO[C@]2(C1)C[NH2+]CCOC2)[C@@H]1CCS(=O)(=O)C12C[NH2+]C2 ZINC001219834244 793615336 /nfs/dbraw/zinc/61/53/36/793615336.db2.gz OROMWZDYEPUAPK-VNHYZAJKSA-N 2 0 373.475 -1.726 20 0 FAADRP CC(=O)NCSC[C@H]([NH3+])C(=O)NC[C@@H]1CO[C@@]2(C1)C[NH2+]CCOC2 ZINC001219836600 793615951 /nfs/dbraw/zinc/61/59/51/793615951.db2.gz ATTBLIJTKRFWIH-IPYPFGDCSA-N 2 0 360.480 -1.348 20 0 FAADRP CC(=O)NCSC[C@H]([NH3+])C(=O)NC[C@H]1CO[C@]2(C1)C[NH2+]CCOC2 ZINC001219836601 793616254 /nfs/dbraw/zinc/61/62/54/793616254.db2.gz ATTBLIJTKRFWIH-KCQAQPDRSA-N 2 0 360.480 -1.348 20 0 FAADRP CC(=O)NCSC[C@H]([NH3+])C(=O)NC[C@@H]1CO[C@]2(C1)C[NH2+]CCOC2 ZINC001219836602 793616273 /nfs/dbraw/zinc/61/62/73/793616273.db2.gz ATTBLIJTKRFWIH-VNHYZAJKSA-N 2 0 360.480 -1.348 20 0 FAADRP CC(=O)NCSC[C@H]([NH3+])C(=O)NC[C@H]1CO[C@@]2(C1)C[NH2+]CCOC2 ZINC001219836603 793616004 /nfs/dbraw/zinc/61/60/04/793616004.db2.gz ATTBLIJTKRFWIH-YDHLFZDLSA-N 2 0 360.480 -1.348 20 0 FAADRP CS(=O)(=O)N(CC[NH3+])CC(=O)NC[C@H]1CO[C@]2(C1)C[NH2+]CCOC2 ZINC001219836624 793616118 /nfs/dbraw/zinc/61/61/18/793616118.db2.gz BAQBYKNHLRSQFD-GXTWGEPZSA-N 2 0 364.468 -2.282 20 0 FAADRP CS(=O)(=O)N(CC[NH3+])CC(=O)NC[C@H]1CO[C@@]2(C1)C[NH2+]CCOC2 ZINC001219836625 793615980 /nfs/dbraw/zinc/61/59/80/793615980.db2.gz BAQBYKNHLRSQFD-JSGCOSHPSA-N 2 0 364.468 -2.282 20 0 FAADRP CS(=O)(=O)N(CC[NH3+])CC(=O)NC[C@@H]1CO[C@@]2(C1)C[NH2+]CCOC2 ZINC001219836626 793615946 /nfs/dbraw/zinc/61/59/46/793615946.db2.gz BAQBYKNHLRSQFD-OCCSQVGLSA-N 2 0 364.468 -2.282 20 0 FAADRP CS(=O)(=O)N(CC[NH3+])CC(=O)NC[C@@H]1CO[C@]2(C1)C[NH2+]CCOC2 ZINC001219836627 793616307 /nfs/dbraw/zinc/61/63/07/793616307.db2.gz BAQBYKNHLRSQFD-TZMCWYRMSA-N 2 0 364.468 -2.282 20 0 FAADRP [NH3+][C@@H](CN1CCC([NH3+])CC1)C(=O)NC[C@H]1CO[C@]2(C1)C[NH2+]CCOC2 ZINC001219837476 793616230 /nfs/dbraw/zinc/61/62/30/793616230.db2.gz JVHBIEOUHUDBPZ-JLJPHGGASA-N 3 0 355.483 -1.752 20 0 FAADRP [NH3+][C@@H](CN1CCC([NH3+])CC1)C(=O)NC[C@@H]1CO[C@@]2(C1)C[NH2+]CCOC2 ZINC001219837477 793616014 /nfs/dbraw/zinc/61/60/14/793616014.db2.gz JVHBIEOUHUDBPZ-KMFMINBZSA-N 3 0 355.483 -1.752 20 0 FAADRP [NH3+][C@@H](CN1CCC([NH3+])CC1)C(=O)NC[C@H]1CO[C@@]2(C1)C[NH2+]CCOC2 ZINC001219837478 793616325 /nfs/dbraw/zinc/61/63/25/793616325.db2.gz JVHBIEOUHUDBPZ-QRTARXTBSA-N 3 0 355.483 -1.752 20 0 FAADRP [NH3+][C@@H](CN1CCC([NH3+])CC1)C(=O)NC[C@@H]1CO[C@]2(C1)C[NH2+]CCOC2 ZINC001219837479 793616159 /nfs/dbraw/zinc/61/61/59/793616159.db2.gz JVHBIEOUHUDBPZ-UKPHBRMFSA-N 3 0 355.483 -1.752 20 0 FAADRP CCOC(=O)[C@@H]1C[NH2+]C[C@H]1C(=O)NC[C@H]1CO[C@@]2(C1)C[NH2+]CCOC2 ZINC001219837700 793616222 /nfs/dbraw/zinc/61/62/22/793616222.db2.gz LFNKHZPELFZIHZ-CFAJVAMVSA-N 2 0 355.435 -1.104 20 0 FAADRP CCOC(=O)[C@@H]1C[NH2+]C[C@H]1C(=O)NC[C@@H]1CO[C@]2(C1)C[NH2+]CCOC2 ZINC001219837701 793616101 /nfs/dbraw/zinc/61/61/01/793616101.db2.gz LFNKHZPELFZIHZ-VMUDFCTBSA-N 2 0 355.435 -1.104 20 0 FAADRP CCOC(=O)[C@@H]1C[NH2+]C[C@H]1C(=O)NC[C@@H]1CO[C@@]2(C1)C[NH2+]CCOC2 ZINC001219837702 793615928 /nfs/dbraw/zinc/61/59/28/793615928.db2.gz LFNKHZPELFZIHZ-WBOJAVRRSA-N 2 0 355.435 -1.104 20 0 FAADRP CCOC(=O)[C@@H]1C[NH2+]C[C@H]1C(=O)NC[C@H]1CO[C@]2(C1)C[NH2+]CCOC2 ZINC001219837703 793615854 /nfs/dbraw/zinc/61/58/54/793615854.db2.gz LFNKHZPELFZIHZ-ZOMKSWQUSA-N 2 0 355.435 -1.104 20 0 FAADRP [NH3+][C@H]1CCCCN(CC(=O)NC[C@H]2CO[C@]3(C2)C[NH2+]CCOC3)C1=O ZINC001219838218 793616062 /nfs/dbraw/zinc/61/60/62/793616062.db2.gz OWUWRICNYRMKPL-GRDNDAEWSA-N 2 0 354.451 -1.163 20 0 FAADRP [NH3+][C@H]1CCCCN(CC(=O)NC[C@@H]2CO[C@]3(C2)C[NH2+]CCOC3)C1=O ZINC001219838219 793615914 /nfs/dbraw/zinc/61/59/14/793615914.db2.gz OWUWRICNYRMKPL-JKIFEVAISA-N 2 0 354.451 -1.163 20 0 FAADRP [NH3+][C@H]1CCCCN(CC(=O)NC[C@@H]2CO[C@@]3(C2)C[NH2+]CCOC3)C1=O ZINC001219838220 793616053 /nfs/dbraw/zinc/61/60/53/793616053.db2.gz OWUWRICNYRMKPL-KEYYUXOJSA-N 2 0 354.451 -1.163 20 0 FAADRP [NH3+][C@H]1CCCCN(CC(=O)NC[C@H]2CO[C@@]3(C2)C[NH2+]CCOC3)C1=O ZINC001219838221 793616211 /nfs/dbraw/zinc/61/62/11/793616211.db2.gz OWUWRICNYRMKPL-ZQIUZPCESA-N 2 0 354.451 -1.163 20 0 FAADRP C[C@H]([NH3+])C(=O)N1CCC[C@H]1C(=O)NC[C@H]1CO[C@]2(C1)C[NH2+]CCOC2 ZINC001219838424 793615875 /nfs/dbraw/zinc/61/58/75/793615875.db2.gz QBFSJNFXGNOJIM-AYMQEEERSA-N 2 0 354.451 -1.164 20 0 FAADRP C[C@H]([NH3+])C(=O)N1CCC[C@H]1C(=O)NC[C@@H]1CO[C@@]2(C1)C[NH2+]CCOC2 ZINC001219838425 793615893 /nfs/dbraw/zinc/61/58/93/793615893.db2.gz QBFSJNFXGNOJIM-LOUJCGABSA-N 2 0 354.451 -1.164 20 0 FAADRP C[C@H]([NH3+])C(=O)N1CCC[C@H]1C(=O)NC[C@@H]1CO[C@]2(C1)C[NH2+]CCOC2 ZINC001219838426 793616316 /nfs/dbraw/zinc/61/63/16/793616316.db2.gz QBFSJNFXGNOJIM-QDEZUTFSSA-N 2 0 354.451 -1.164 20 0 FAADRP C[C@H]([NH3+])C(=O)N1CCC[C@H]1C(=O)NC[C@H]1CO[C@@]2(C1)C[NH2+]CCOC2 ZINC001219838427 793616139 /nfs/dbraw/zinc/61/61/39/793616139.db2.gz QBFSJNFXGNOJIM-WSMBLCCSSA-N 2 0 354.451 -1.164 20 0 FAADRP CC(C)C[C@H](NC(=O)C[NH3+])C(=O)NC[C@H]1CO[C@]2(C1)C[NH2+]CCOC2 ZINC001219838624 793616124 /nfs/dbraw/zinc/61/61/24/793616124.db2.gz SKIJISKNBZULRJ-GRDNDAEWSA-N 2 0 356.467 -1.013 20 0 FAADRP CC(C)C[C@H](NC(=O)C[NH3+])C(=O)NC[C@@H]1CO[C@]2(C1)C[NH2+]CCOC2 ZINC001219838625 793616178 /nfs/dbraw/zinc/61/61/78/793616178.db2.gz SKIJISKNBZULRJ-JKIFEVAISA-N 2 0 356.467 -1.013 20 0 FAADRP CC(C)C[C@H](NC(=O)C[NH3+])C(=O)NC[C@@H]1CO[C@@]2(C1)C[NH2+]CCOC2 ZINC001219838626 793616867 /nfs/dbraw/zinc/61/68/67/793616867.db2.gz SKIJISKNBZULRJ-KEYYUXOJSA-N 2 0 356.467 -1.013 20 0 FAADRP CC(C)C[C@H](NC(=O)C[NH3+])C(=O)NC[C@H]1CO[C@@]2(C1)C[NH2+]CCOC2 ZINC001219838627 793617178 /nfs/dbraw/zinc/61/71/78/793617178.db2.gz SKIJISKNBZULRJ-ZQIUZPCESA-N 2 0 356.467 -1.013 20 0 FAADRP CC[C@H](C)[C@H]([NH3+])C(=O)NCC(=O)NC[C@H]1CO[C@]2(C1)C[NH2+]CCOC2 ZINC001219838708 793616950 /nfs/dbraw/zinc/61/69/50/793616950.db2.gz TZTMATHDJRRRLF-GZIXRCOHSA-N 2 0 356.467 -1.013 20 0 FAADRP CC[C@H](C)[C@H]([NH3+])C(=O)NCC(=O)NC[C@H]1CO[C@@]2(C1)C[NH2+]CCOC2 ZINC001219838709 793616841 /nfs/dbraw/zinc/61/68/41/793616841.db2.gz TZTMATHDJRRRLF-HPZZRFSDSA-N 2 0 356.467 -1.013 20 0 FAADRP CC[C@H](C)[C@H]([NH3+])C(=O)NCC(=O)NC[C@@H]1CO[C@]2(C1)C[NH2+]CCOC2 ZINC001219838710 793617024 /nfs/dbraw/zinc/61/70/24/793617024.db2.gz TZTMATHDJRRRLF-UICACZKSSA-N 2 0 356.467 -1.013 20 0 FAADRP CC[C@H](C)[C@H]([NH3+])C(=O)NCC(=O)NC[C@@H]1CO[C@@]2(C1)C[NH2+]CCOC2 ZINC001219838711 793617109 /nfs/dbraw/zinc/61/71/09/793617109.db2.gz TZTMATHDJRRRLF-YXPYIKCWSA-N 2 0 356.467 -1.013 20 0 FAADRP CC(=O)NCCOCC[N@H+]1C[C@@H](NC(=O)[C@H](C(C)C)[NH+](C)C)[C@@H](O)C1 ZINC001219846901 793619049 /nfs/dbraw/zinc/61/90/49/793619049.db2.gz JCJMBXDOCVPMNT-PMPSAXMXSA-N 2 0 358.483 -1.113 20 0 FAADRP C[C@H]([NH3+])C(=O)N[C@H](CCC(=O)NC[C@H]1OC[C@@H]2CC[NH2+]C[C@@H]21)C(N)=O ZINC001219852577 793620951 /nfs/dbraw/zinc/62/09/51/793620951.db2.gz VBGTVDJOEYOKHS-JZRPKSSGSA-N 2 0 355.439 -2.175 20 0 FAADRP CC(C)(C)OC[C@H]([NH3+])C(=O)NCC(=O)NC[C@H]1OC[C@@H]2CC[NH2+]C[C@@H]21 ZINC001219852595 793620916 /nfs/dbraw/zinc/62/09/16/793620916.db2.gz VMGXJTQDTIEXLN-XDQVBPFNSA-N 2 0 356.467 -1.014 20 0 FAADRP [NH3+]CCCC[C@H]([NH3+])C(=O)N1CCC[C@H]1C(=O)N[C@H]1CO[C@@H]2C[NH2+]C[C@H]12 ZINC001219856201 793621459 /nfs/dbraw/zinc/62/14/59/793621459.db2.gz BVFFTFKLEYJGEA-CAEXGNQWSA-N 3 0 353.467 -1.463 20 0 FAADRP C[C@H](NC(=O)[C@@H]1CCCN1C(=O)C[NH3+])C(=O)N[C@H]1CO[C@@H]2C[NH2+]C[C@H]12 ZINC001219856641 793622007 /nfs/dbraw/zinc/62/20/07/793622007.db2.gz VWLLRHKPDHPNHO-FPYNETTCSA-N 2 0 353.423 -2.456 20 0 FAADRP CC(C)[C@H]([NH3+])C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)NCC[NH3+])C(=O)CF ZINC001219870705 793624527 /nfs/dbraw/zinc/62/45/27/793624527.db2.gz QOLNOGJEIKTTAQ-KWBADKCTSA-N 2 0 361.418 -2.037 20 0 FAADRP COC[C@H](O)C[N@H+]1C[C@@H](NC(=O)C(C)(C)C[NH+]2CCOCC2)[C@@H](O)C1 ZINC001219877532 793625765 /nfs/dbraw/zinc/62/57/65/793625765.db2.gz KHAWXQOZEJNZAN-KFWWJZLASA-N 2 0 359.467 -1.487 20 0 FAADRP COC[C@@H](O)C[N@H+]1C[C@@H](NC(=O)C(C)(C)C[NH+]2CCOCC2)[C@@H](O)C1 ZINC001219877533 793625291 /nfs/dbraw/zinc/62/52/91/793625291.db2.gz KHAWXQOZEJNZAN-ZNMIVQPWSA-N 2 0 359.467 -1.487 20 0 FAADRP COC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]([NH3+])CCCC[NH3+])[C@@H](C)O ZINC001219880799 793625666 /nfs/dbraw/zinc/62/56/66/793625666.db2.gz KEXRISQBRHUVGF-VOAKCMCISA-N 2 0 358.439 -1.528 20 0 FAADRP CC[N@H+](C)C(C)(C)C(=O)N[C@@H]1CN(CCN(C)S(C)(=O)=O)C[C@@H]1O ZINC001219902999 793632283 /nfs/dbraw/zinc/63/22/83/793632283.db2.gz PFKRBGHXMKTKGQ-OLZOCXBDSA-N 2 0 364.512 -1.231 20 0 FAADRP CC[N@H+](C)C(C)(C)C(=O)N[C@@H]1CN(CCN2C(=O)CNC2=O)C[C@@H]1O ZINC001219903048 793632545 /nfs/dbraw/zinc/63/25/45/793632545.db2.gz RAZYDIGUEFKGSD-NEPJUHHUSA-N 2 0 355.439 -1.570 20 0 FAADRP CC[N@H+](C)C(C)(C)C(=O)N[C@@H]1C[NH+](C[C@@H](O)COCCOC)C[C@@H]1O ZINC001219903329 793631987 /nfs/dbraw/zinc/63/19/87/793631987.db2.gz YLFXXYBMMZDPNS-KFWWJZLASA-N 2 0 361.483 -1.098 20 0 FAADRP CC[N@H+](C)C(C)(C)C(=O)N[C@@H]1C[NH+](C[C@H](O)COCCOC)C[C@@H]1O ZINC001219903332 793632391 /nfs/dbraw/zinc/63/23/91/793632391.db2.gz YLFXXYBMMZDPNS-ZNMIVQPWSA-N 2 0 361.483 -1.098 20 0 FAADRP C[C@@H](C[NH+](C)C)NC(=O)[C@H](CO)NC(=O)[C@@H]([NH3+])Cc1ccc(O)cc1 ZINC001219915927 793635152 /nfs/dbraw/zinc/63/51/52/793635152.db2.gz DNPJKYMRRRCCTN-CQDKDKBSSA-N 2 0 352.435 -1.195 20 0 FAADRP C[C@H](C[NH+](C)C)NC(=O)[C@H](CO)NC(=O)[C@@H]([NH3+])Cc1ccc(O)cc1 ZINC001219915928 793635171 /nfs/dbraw/zinc/63/51/71/793635171.db2.gz DNPJKYMRRRCCTN-UGFHNGPFSA-N 2 0 352.435 -1.195 20 0 FAADRP C[NH+](C)CCCCCNC(=O)CNC(=O)CNC(=O)CNC(=O)C[NH3+] ZINC001219920971 793634971 /nfs/dbraw/zinc/63/49/71/793634971.db2.gz NVISCXXIDBWXHX-UHFFFAOYSA-N 2 0 358.443 -2.858 20 0 FAADRP C[C@H](NC(=O)[C@@H]([NH3+])CO)C(=O)N(c1ccc(C[NH3+])cc1)S(C)(=O)=O ZINC001219938879 793640469 /nfs/dbraw/zinc/64/04/69/793640469.db2.gz HYJXNCPHZCPOMS-CABZTGNLSA-N 2 0 358.420 -1.738 20 0 FAADRP CS(=O)(=O)N(C(=O)[C@H]1COC2(C[NH2+]C2)CN1)c1ccc(C[NH3+])cc1 ZINC001219939253 793640569 /nfs/dbraw/zinc/64/05/69/793640569.db2.gz YCEQWLULPUFQJM-CYBMUJFWSA-N 2 0 354.432 -1.232 20 0 FAADRP CS(=O)(=O)N(C(=O)[C@@H]1COC2(C[NH2+]C2)CN1)c1ccc(C[NH3+])cc1 ZINC001219939254 793640511 /nfs/dbraw/zinc/64/05/11/793640511.db2.gz YCEQWLULPUFQJM-ZDUSSCGKSA-N 2 0 354.432 -1.232 20 0 FAADRP [NH3+]CCCC[C@H]([NH3+])C(=O)N1CCC[C@H]1C(=O)N[C@@H]1C=CS(=O)(=O)C1 ZINC001219945267 793641909 /nfs/dbraw/zinc/64/19/09/793641909.db2.gz GIBCPMKGKCYJGF-AGIUHOORSA-N 2 0 358.464 -1.139 20 0 FAADRP [NH3+]CCCC[C@H]([NH3+])C(=O)N1CCC[C@H]1C(=O)N[C@H]1C=CS(=O)(=O)C1 ZINC001219945268 793642134 /nfs/dbraw/zinc/64/21/34/793642134.db2.gz GIBCPMKGKCYJGF-AVGNSLFASA-N 2 0 358.464 -1.139 20 0 FAADRP CNS(=O)(=O)CCNC(=O)[C@@H]1CCCN1C(=O)[C@@H]([NH3+])CCCC[NH3+] ZINC001219961416 793645655 /nfs/dbraw/zinc/64/56/55/793645655.db2.gz JVBNDYFMOKDGKW-RYUDHWBXSA-N 2 0 363.484 -1.901 20 0 FAADRP CCn1c(N)c(NC(=O)[C@]23C[NH2+]C[C@H]2C[NH2+]CC3)c(=O)n(CC)c1=O ZINC001219972741 793647984 /nfs/dbraw/zinc/64/79/84/793647984.db2.gz VJJBENUSLAKDIU-QLJPJBMISA-N 2 0 350.423 -1.230 20 0 FAADRP COC(=O)C1(NC(=O)[C@H]2C[NH2+]CC23CCS(=O)(=O)CC3)CC[NH2+]CC1 ZINC001219998979 793650667 /nfs/dbraw/zinc/65/06/67/793650667.db2.gz HAXKTMREOZQUMS-GFCCVEGCSA-N 2 0 373.475 -1.188 20 0 FAADRP COC(=O)C1(NC(=O)[C@@H]2C[NH2+]CC23CCS(=O)(=O)CC3)CC[NH2+]CC1 ZINC001219998980 793650524 /nfs/dbraw/zinc/65/05/24/793650524.db2.gz HAXKTMREOZQUMS-LBPRGKRZSA-N 2 0 373.475 -1.188 20 0 FAADRP COC(=O)C1(NC(=O)[C@H]2C[N@H+](C)CC3(CC[NH2+]CC3)O2)CC[NH2+]CC1 ZINC001219999132 793650790 /nfs/dbraw/zinc/65/07/90/793650790.db2.gz KZGMHIJMDVVIED-CYBMUJFWSA-N 3 0 354.451 -1.149 20 0 FAADRP COC(=O)C1(NC(=O)[C@@H]2C[N@H+](C)CC3(CC[NH2+]CC3)O2)CC[NH2+]CC1 ZINC001219999133 793650716 /nfs/dbraw/zinc/65/07/16/793650716.db2.gz KZGMHIJMDVVIED-ZDUSSCGKSA-N 3 0 354.451 -1.149 20 0 FAADRP COC(=O)C1(NC(=O)CNC(=O)[C@@H]([NH3+])COC(C)(C)C)CC[NH2+]CC1 ZINC001220000991 793650466 /nfs/dbraw/zinc/65/04/66/793650466.db2.gz BNUTZZLFWZMLDT-NSHDSACASA-N 2 0 358.439 -1.344 20 0 FAADRP COC(=O)C1(NC(=O)[C@@H]2COC(C)(C)N2C(=O)[C@H](C)[NH3+])CC[NH2+]CC1 ZINC001220001587 793650502 /nfs/dbraw/zinc/65/05/02/793650502.db2.gz STBCRJLVZYRKOM-QWRGUYRKSA-N 2 0 356.423 -1.292 20 0 FAADRP CS(=O)(=O)N(CC[NH3+])CC(=O)N(Cc1ccccc1)C1(C[NH3+])COC1 ZINC001220022449 793653768 /nfs/dbraw/zinc/65/37/68/793653768.db2.gz HPTRIYVKCOHUNT-UHFFFAOYSA-N 2 0 370.475 -1.037 20 0 FAADRP C[C@H](NC(=O)[C@@H]([NH3+])CO)C(=O)N(Cc1ccccc1)C1(C[NH3+])COC1 ZINC001220023253 793653698 /nfs/dbraw/zinc/65/36/98/793653698.db2.gz SLCHBMFJSFOBOX-JSGCOSHPSA-N 2 0 350.419 -1.433 20 0 FAADRP C[C@H]([NH3+])C(=O)N[C@@H](CC(N)=O)C(=O)n1c(=N)sc2c1CC[C@H]([NH3+])C2 ZINC001220025444 793654058 /nfs/dbraw/zinc/65/40/58/793654058.db2.gz QCYFVBPILZTEPL-FXQIFTODSA-N 2 0 354.436 -1.807 20 0 FAADRP [NH3+]CCCC[C@H]([NH3+])C(=O)N1CCC[C@H]1C(=O)N[C@H]1CCC(=O)NC1=O ZINC001220028394 793653589 /nfs/dbraw/zinc/65/35/89/793653589.db2.gz RGIDUSQGAKJALJ-SRVKXCTJSA-N 2 0 353.423 -1.645 20 0 FAADRP [NH3+]CCCC[C@H]([NH3+])C(=O)N1CCC[C@H]1C(=O)N[C@@H]1CCC(=O)NC1=O ZINC001220028395 793653833 /nfs/dbraw/zinc/65/38/33/793653833.db2.gz RGIDUSQGAKJALJ-TUAOUCFPSA-N 2 0 353.423 -1.645 20 0 FAADRP CCOC(=O)C(=CNC(=O)[C@H]([NH3+])CN1CCC([NH3+])CC1)C(=O)OCC ZINC001220043283 793655857 /nfs/dbraw/zinc/65/58/57/793655857.db2.gz MICZZOOFPLBBAP-CYBMUJFWSA-N 2 0 356.423 -1.137 20 0 FAADRP CCOC(=O)C(=CNC(=O)[C@@H]([NH3+])CN1CCC([NH3+])CC1)C(=O)OCC ZINC001220043284 793655803 /nfs/dbraw/zinc/65/58/03/793655803.db2.gz MICZZOOFPLBBAP-ZDUSSCGKSA-N 2 0 356.423 -1.137 20 0 FAADRP C[C@H](NC(=O)[C@@H]1CCCN1C(=O)C[NH3+])C(=O)N(CCCC[NH3+])C(N)=[NH2+] ZINC001220103030 793667004 /nfs/dbraw/zinc/66/70/04/793667004.db2.gz CRCVSXUKAOKJME-QWRGUYRKSA-N 3 0 355.443 -2.098 20 0 FAADRP NC(=[NH2+])N(CCCC[NH3+])C(=O)[C@@H]1CCCN1C(=O)[C@@H]([NH3+])CCCC[NH3+] ZINC001220103310 793666837 /nfs/dbraw/zinc/66/68/37/793666837.db2.gz NUIFOXHWQXBGEK-STQMWFEESA-N 4 0 355.487 -1.105 20 0 FAADRP [NH3+]CCSC[C@H]([NH3+])C(=O)NCC(=O)NCC(=O)OCc1ccccc1 ZINC001220105199 793667096 /nfs/dbraw/zinc/66/70/96/793667096.db2.gz WGHFJHSXZSQZJT-ZDUSSCGKSA-N 2 0 368.459 -1.019 20 0 FAADRP [NH3+]CCCC[C@H]([NH3+])C(=O)N1CCC[C@H]1C(=O)NC1CC(CO)(CO)C1 ZINC001220152153 793675622 /nfs/dbraw/zinc/67/56/22/793675622.db2.gz WPQCHURIXQICMS-KBPBESRZSA-N 2 0 356.467 -1.317 20 0 FAADRP COCCC[NH+]1CCC(NC(=O)CN(CC[NH3+])S(C)(=O)=O)CC1 ZINC001220200196 793678387 /nfs/dbraw/zinc/67/83/87/793678387.db2.gz CSTIQIJHOAEURL-UHFFFAOYSA-N 2 0 350.485 -1.176 20 0 FAADRP COCCC[NH+]1CCC(NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)[NH3+])CC1 ZINC001220200425 793677860 /nfs/dbraw/zinc/67/78/60/793677860.db2.gz KDSSFOAAHCALBN-AAEUAGOBSA-N 2 0 357.455 -1.689 20 0 FAADRP C[NH+](C)CC1(C(=O)N[C@@H]2C[N@H+](C[C@@H](O)Cn3cccn3)C[C@@H]2O)CC1 ZINC001220228981 793683081 /nfs/dbraw/zinc/68/30/81/793683081.db2.gz HPHVSMYRLVFUOZ-KFWWJZLASA-N 2 0 351.451 -1.253 20 0 FAADRP C[NH+](C)CC1(C(=O)N[C@@H]2C[N@H+](C[C@H](O)Cn3cccn3)C[C@@H]2O)CC1 ZINC001220228982 793683145 /nfs/dbraw/zinc/68/31/45/793683145.db2.gz HPHVSMYRLVFUOZ-ZNMIVQPWSA-N 2 0 351.451 -1.253 20 0 FAADRP COCCOC[C@H](O)C[N@H+]1C[C@@H](NC(=O)C2(C[NH+](C)C)CC2)[C@@H](O)C1 ZINC001220230714 793682815 /nfs/dbraw/zinc/68/28/15/793682815.db2.gz PLHHBFDCKDRPNZ-KFWWJZLASA-N 2 0 359.467 -1.487 20 0 FAADRP COCCOC[C@@H](O)C[N@H+]1C[C@@H](NC(=O)C2(C[NH+](C)C)CC2)[C@@H](O)C1 ZINC001220230715 793683527 /nfs/dbraw/zinc/68/35/27/793683527.db2.gz PLHHBFDCKDRPNZ-ZNMIVQPWSA-N 2 0 359.467 -1.487 20 0 FAADRP C[NH+](C)CCCC(=O)N[C@@H]1C[N@H+](CCCN2C(=O)CNC2=O)C[C@@H]1O ZINC001220238351 793685292 /nfs/dbraw/zinc/68/52/92/793685292.db2.gz RUCJZMUYDBXKDN-OLZOCXBDSA-N 2 0 355.439 -1.569 20 0 FAADRP C[N@@H+]1CCC[C@@H]1CCNC(=O)CNC(=O)CNC(=O)CNC(=O)C[NH3+] ZINC001220251990 793688989 /nfs/dbraw/zinc/68/89/89/793688989.db2.gz LBGAFBVZXXMZIS-LLVKDONJSA-N 2 0 356.427 -3.106 20 0 FAADRP C[N@@H+]1CCC[C@H]1CCNC(=O)CNC(=O)CNC(=O)CNC(=O)C[NH3+] ZINC001220251991 793688465 /nfs/dbraw/zinc/68/84/65/793688465.db2.gz LBGAFBVZXXMZIS-NSHDSACASA-N 2 0 356.427 -3.106 20 0 FAADRP C[NH+](C)CC(C)(C)CNC(=O)CNC(=O)CNC(=O)CNC(=O)C[NH3+] ZINC001220253950 793688573 /nfs/dbraw/zinc/68/85/73/793688573.db2.gz HKPVBOXNHDONPE-UHFFFAOYSA-N 2 0 358.443 -3.002 20 0 FAADRP COCCOC[C@H](O)C[N@H+]1C[C@@H](NC(=O)C2CC[NH+](C)CC2)[C@@H](O)C1 ZINC001220269021 793689577 /nfs/dbraw/zinc/68/95/77/793689577.db2.gz NBGWXUINIKPMHK-OAGGEKHMSA-N 2 0 359.467 -1.487 20 0 FAADRP COCCOC[C@@H](O)C[N@H+]1C[C@@H](NC(=O)C2CC[NH+](C)CC2)[C@@H](O)C1 ZINC001220269024 793689512 /nfs/dbraw/zinc/68/95/12/793689512.db2.gz NBGWXUINIKPMHK-XHSDSOJGSA-N 2 0 359.467 -1.487 20 0 FAADRP CC(=O)NCCOCC[N@H+]1C[C@@H](NC(=O)C2CC[NH+](C)CC2)[C@@H](O)C1 ZINC001220269332 793690763 /nfs/dbraw/zinc/69/07/63/793690763.db2.gz VEOHZZAOSJHFKP-CVEARBPZSA-N 2 0 356.467 -1.358 20 0 FAADRP C[NH+](C)CCC(=O)N[C@@H]1C[N@H+](C[C@H]2CCN(S(C)(=O)=O)C2)C[C@@H]1O ZINC001220276441 793691806 /nfs/dbraw/zinc/69/18/06/793691806.db2.gz AQAYRRYXMRNRHL-MCIONIFRSA-N 2 0 362.496 -1.619 20 0 FAADRP C[NH+](C)CCC(=O)N[C@@H]1C[N@H+](C[C@@H]2CCN(S(C)(=O)=O)C2)C[C@@H]1O ZINC001220276443 793691821 /nfs/dbraw/zinc/69/18/21/793691821.db2.gz AQAYRRYXMRNRHL-MJBXVCDLSA-N 2 0 362.496 -1.619 20 0 FAADRP C[NH+](C)CCC(=O)N[C@@H]1C[N@H+](C[C@@H](O)COC2CCOCC2)C[C@@H]1O ZINC001220277327 793691518 /nfs/dbraw/zinc/69/15/18/793691518.db2.gz WLIMGIWSQVNHNZ-BMFZPTHFSA-N 2 0 359.467 -1.344 20 0 FAADRP C[NH+](C)CCC(=O)N[C@@H]1C[N@H+](C[C@H](O)COC2CCOCC2)C[C@@H]1O ZINC001220277329 793691385 /nfs/dbraw/zinc/69/13/85/793691385.db2.gz WLIMGIWSQVNHNZ-IMJJTQAJSA-N 2 0 359.467 -1.344 20 0 FAADRP CC(C)C[C@H](NC(=O)[C@@H]1CCC[NH2+]1)C(=O)NCC(=O)N[C@H]1CC[NH2+]C1 ZINC001220282860 793691691 /nfs/dbraw/zinc/69/16/91/793691691.db2.gz PCAKJMNDEUVNER-IHRRRGAJSA-N 2 0 353.467 -1.136 20 0 FAADRP CC(=O)NCCOCC[N@H+]1C[C@@H](NC(=O)[C@@H](C(C)C)[NH+](C)C)[C@@H](O)C1 ZINC001220297052 793692850 /nfs/dbraw/zinc/69/28/50/793692850.db2.gz JCJMBXDOCVPMNT-OWCLPIDISA-N 2 0 358.483 -1.113 20 0 FAADRP C[N@@H+]1CCCN(CCNC(=O)CNC(=O)[C@@H]([NH3+])COC(C)(C)C)CC1 ZINC001220306732 793693539 /nfs/dbraw/zinc/69/35/39/793693539.db2.gz NXYXIAGCUTVNPM-AWEZNQCLSA-N 2 0 357.499 -1.001 20 0 FAADRP O=C(NCc1ncn2c1C[NH2+]CCC2)[C@H]1CCS(=O)(=O)C12C[NH2+]C2 ZINC001220310427 793694027 /nfs/dbraw/zinc/69/40/27/793694027.db2.gz AIMOORGJSIPRAZ-LLVKDONJSA-N 2 0 353.448 -1.231 20 0 FAADRP O=C(NCc1ncn2c1C[NH2+]CCC2)[C@@H]1CCS(=O)(=O)C12C[NH2+]C2 ZINC001220310428 793693676 /nfs/dbraw/zinc/69/36/76/793693676.db2.gz AIMOORGJSIPRAZ-NSHDSACASA-N 2 0 353.448 -1.231 20 0 FAADRP C[C@H]([NH3+])C(=O)N[C@@H](CC(N)=O)C(=O)NCc1ncn2c1C[NH2+]CCC2 ZINC001220313959 793693947 /nfs/dbraw/zinc/69/39/47/793693947.db2.gz ZRUZMOWKEHPVJP-UWVGGRQHSA-N 2 0 351.411 -2.300 20 0 FAADRP C[C@H]([NH3+])C(=O)N[C@H](CCC(=O)N[C@H]1CO[C@]2(C1)CCC[NH2+]C2)C(N)=O ZINC001220319729 793694670 /nfs/dbraw/zinc/69/46/70/793694670.db2.gz IWUUCRBTTQBQTP-LGSVPQMISA-N 2 0 355.439 -1.889 20 0 FAADRP C[C@H]([NH3+])C(=O)N[C@H](CCC(=O)N[C@@H]1CO[C@]2(C1)CCC[NH2+]C2)C(N)=O ZINC001220319730 793694874 /nfs/dbraw/zinc/69/48/74/793694874.db2.gz IWUUCRBTTQBQTP-OVZMXSCWSA-N 2 0 355.439 -1.889 20 0 FAADRP C[C@H]([NH3+])C(=O)N[C@H](CCC(=O)N[C@@H]1CO[C@@]2(C1)CCC[NH2+]C2)C(N)=O ZINC001220319731 793694603 /nfs/dbraw/zinc/69/46/03/793694603.db2.gz IWUUCRBTTQBQTP-PVTKRXDGSA-N 2 0 355.439 -1.889 20 0 FAADRP C[C@H]([NH3+])C(=O)N[C@H](CCC(=O)N[C@H]1CO[C@@]2(C1)CCC[NH2+]C2)C(N)=O ZINC001220319732 793694592 /nfs/dbraw/zinc/69/45/92/793694592.db2.gz IWUUCRBTTQBQTP-XSUJLISDSA-N 2 0 355.439 -1.889 20 0 FAADRP CCOC(=O)C1(NC(=O)CN(CC[NH3+])S(C)(=O)=O)CC[NH+](C)CC1 ZINC001220345654 793697769 /nfs/dbraw/zinc/69/77/69/793697769.db2.gz LESMWGRJEJHKBL-UHFFFAOYSA-N 2 0 364.468 -1.650 20 0 FAADRP CCOC(=O)C1(NC(=O)[C@@H]([NH3+])CN2CCC([NH3+])CC2)CC[NH+](C)CC1 ZINC001220345739 793697681 /nfs/dbraw/zinc/69/76/81/793697681.db2.gz NQSNMIGFNQMHEO-AWEZNQCLSA-N 3 0 355.483 -1.120 20 0 FAADRP CCOC(=O)C1(NC(=O)[C@H]([NH3+])CN2CCC([NH3+])CC2)CC[NH+](C)CC1 ZINC001220345740 793697625 /nfs/dbraw/zinc/69/76/25/793697625.db2.gz NQSNMIGFNQMHEO-CQSZACIVSA-N 3 0 355.483 -1.120 20 0 FAADRP CN1CCOC[C@H]1CNC(=O)[C@@H]1CCCN1C(=O)[C@@H]([NH3+])CCCC[NH3+] ZINC001220381666 793703162 /nfs/dbraw/zinc/70/31/62/793703162.db2.gz MDYNLGMWPQREGC-ILXRZTDVSA-N 2 0 355.483 -1.120 20 0 FAADRP CN1CCOC[C@@H]1CNC(=O)[C@@H]1CCCN1C(=O)[C@@H]([NH3+])CCCC[NH3+] ZINC001220381668 793702392 /nfs/dbraw/zinc/70/23/92/793702392.db2.gz MDYNLGMWPQREGC-KKUMJFAQSA-N 2 0 355.483 -1.120 20 0 FAADRP C[NH+](C)CCC(C)(C)NC(=O)CNC(=O)CNC(=O)CNC(=O)C[NH3+] ZINC001220386400 793704010 /nfs/dbraw/zinc/70/40/10/793704010.db2.gz RQQQZQGZQYKEPP-UHFFFAOYSA-N 2 0 358.443 -2.860 20 0 FAADRP CC(C)[C@@H]1O[C@H](C[NH3+])[C@@H](CNC(=O)CN(CC[NH3+])S(C)(=O)=O)O1 ZINC001220481424 793717816 /nfs/dbraw/zinc/71/78/16/793717816.db2.gz GUDOFVQCTXXUJG-NQBHXWOUSA-N 2 0 352.457 -1.952 20 0 FAADRP CC(C)[C@H]1O[C@H](C[NH3+])[C@@H](CNC(=O)CN(CC[NH3+])S(C)(=O)=O)O1 ZINC001220481425 793717926 /nfs/dbraw/zinc/71/79/26/793717926.db2.gz GUDOFVQCTXXUJG-WZRBSPASSA-N 2 0 352.457 -1.952 20 0 FAADRP CC(C)[C@@H]1O[C@H](C[NH3+])[C@@H](CNC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)[NH3+])O1 ZINC001220481533 793717799 /nfs/dbraw/zinc/71/77/99/793717799.db2.gz JVUHXIWZXHVESB-NDXHXBTESA-N 2 0 359.427 -2.465 20 0 FAADRP CC(C)[C@H]1O[C@H](C[NH3+])[C@@H](CNC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)[NH3+])O1 ZINC001220481534 793717879 /nfs/dbraw/zinc/71/78/79/793717879.db2.gz JVUHXIWZXHVESB-QABNJGPSSA-N 2 0 359.427 -2.465 20 0 FAADRP COCCOCCOCCOCCNC(=O)[C@]12C[NH2+]C[C@H]1C[NH2+]CC2 ZINC001220512376 793724760 /nfs/dbraw/zinc/72/47/60/793724760.db2.gz NRVQVBLQUAFTKN-NVXWUHKLSA-N 2 0 359.467 -1.002 20 0 FAADRP COCCOCCOCCOCCNC(=O)[C@@H]([NH3+])CSCC[NH3+] ZINC001220514618 793725086 /nfs/dbraw/zinc/72/50/86/793725086.db2.gz RXGSASKQEUAYHJ-ZDUSSCGKSA-N 2 0 353.485 -1.182 20 0 FAADRP COC[C@H](O)C[N@H+]1C[C@@H](NC(=O)c2cnn(CC[NH+](C)C)c2)[C@@H](O)C1 ZINC001220517059 793724880 /nfs/dbraw/zinc/72/48/80/793724880.db2.gz UEWDFPWCNWOKBA-KFWWJZLASA-N 2 0 355.439 -1.773 20 0 FAADRP COC[C@@H](O)C[N@H+]1C[C@@H](NC(=O)c2cnn(CC[NH+](C)C)c2)[C@@H](O)C1 ZINC001220517060 793725210 /nfs/dbraw/zinc/72/52/10/793725210.db2.gz UEWDFPWCNWOKBA-ZNMIVQPWSA-N 2 0 355.439 -1.773 20 0 FAADRP [NH3+]CCOCCOCCNC(=O)[C@H]1Cn2nnnc2C12CC[NH2+]CC2 ZINC001220517546 793725230 /nfs/dbraw/zinc/72/52/30/793725230.db2.gz PQRXQUUTGNYAEC-GFCCVEGCSA-N 2 0 353.427 -1.968 20 0 FAADRP [NH3+]CCOCCOCCNC(=O)[C@@H]1Cn2nnnc2C12CC[NH2+]CC2 ZINC001220517547 793724868 /nfs/dbraw/zinc/72/48/68/793724868.db2.gz PQRXQUUTGNYAEC-LBPRGKRZSA-N 2 0 353.427 -1.968 20 0 FAADRP [NH3+]CCOCCOCCNC(=O)CNC(=O)[C@@H]([NH3+])Cc1ccccc1 ZINC001220519209 793725959 /nfs/dbraw/zinc/72/59/59/793725959.db2.gz GNEXIRDGFSZDMI-HNNXBMFYSA-N 2 0 352.435 -1.219 20 0 FAADRP [NH3+]CCOCCOCCNC(=O)[C@H](Cc1ccccc1)NC(=O)C[NH3+] ZINC001220519364 793726016 /nfs/dbraw/zinc/72/60/16/793726016.db2.gz LKVHUBOOQBCEPX-HNNXBMFYSA-N 2 0 352.435 -1.219 20 0 FAADRP CCOC(=O)C1=C(NC(=O)[C@H]2CCS(=O)(=O)C23C[NH2+]C3)CC[NH2+]C1 ZINC001220521781 793725956 /nfs/dbraw/zinc/72/59/56/793725956.db2.gz ONUAGNIJQWNGDD-LLVKDONJSA-N 2 0 357.432 -1.310 20 0 FAADRP CCOC(=O)C1=C(NC(=O)[C@@H]2CCS(=O)(=O)C23C[NH2+]C3)CC[NH2+]C1 ZINC001220521782 793726132 /nfs/dbraw/zinc/72/61/32/793726132.db2.gz ONUAGNIJQWNGDD-NSHDSACASA-N 2 0 357.432 -1.310 20 0 FAADRP CCOC(=O)C1=C(NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)[NH3+])CC[NH2+]C1 ZINC001220524060 793727156 /nfs/dbraw/zinc/72/71/56/793727156.db2.gz YEJCJEHIZIQIDQ-KWQFWETISA-N 2 0 355.395 -2.380 20 0 FAADRP CCOC(=O)CN(CC[NH3+])C(=O)[C@H]1C[NH2+]CC12CCS(=O)(=O)CC2 ZINC001220583234 793742037 /nfs/dbraw/zinc/74/20/37/793742037.db2.gz GKNPQTSALIPYEC-GFCCVEGCSA-N 2 0 361.464 -1.249 20 0 FAADRP CCOC(=O)CN(CC[NH3+])C(=O)[C@@H]1C[NH2+]CC12CCS(=O)(=O)CC2 ZINC001220583235 793741987 /nfs/dbraw/zinc/74/19/87/793741987.db2.gz GKNPQTSALIPYEC-LBPRGKRZSA-N 2 0 361.464 -1.249 20 0 FAADRP CS(=O)(=O)N(CC[NH3+])CC(=O)NCc1ccccc1N1CC[NH2+]CC1 ZINC001220651239 793750762 /nfs/dbraw/zinc/75/07/62/793750762.db2.gz HQNVSACKHDFUSO-UHFFFAOYSA-N 2 0 369.491 -1.067 20 0 FAADRP CC[N@H+](C)CCC(=O)N[C@@H]1C[NH+](CCCN2C(=O)CNC2=O)C[C@@H]1O ZINC001220688470 793759087 /nfs/dbraw/zinc/75/90/87/793759087.db2.gz HVPJRSGUXMLSEM-OLZOCXBDSA-N 2 0 355.439 -1.569 20 0 FAADRP CN(C)S(=O)(=O)c1ccc(N(CC[NH3+])C(=O)[C@@H](N)C[NH3+])c2nonc21 ZINC001220749656 793769976 /nfs/dbraw/zinc/76/99/76/793769976.db2.gz XGVPBRGKYPRLNP-QMMMGPOBSA-N 2 0 371.423 -1.949 20 0 FAADRP CC(=O)NCCOCC[NH+]1C[C@@H](NC(=O)C[C@H]2CC[N@@H+](C)C2)[C@@H](O)C1 ZINC001220755315 793772301 /nfs/dbraw/zinc/77/23/01/793772301.db2.gz LAQQVJJTTXGPSY-OAGGEKHMSA-N 2 0 356.467 -1.358 20 0 FAADRP CC(=O)NCCOCC[NH+]1C[C@@H](NC(=O)C[C@@H]2CC[N@@H+](C)C2)[C@@H](O)C1 ZINC001220755316 793772184 /nfs/dbraw/zinc/77/21/84/793772184.db2.gz LAQQVJJTTXGPSY-XHSDSOJGSA-N 2 0 356.467 -1.358 20 0 FAADRP [NH3+][C@@H](CN1CCC([NH3+])CC1)C(=O)NCCCN1CCS(=O)(=O)CC1 ZINC001220756583 793772425 /nfs/dbraw/zinc/77/24/25/793772425.db2.gz FYOXUJJAOZOROR-AWEZNQCLSA-N 2 0 361.512 -2.027 20 0 FAADRP [NH3+][C@H](CN1CCC([NH3+])CC1)C(=O)NCCCN1CCS(=O)(=O)CC1 ZINC001220756584 793772092 /nfs/dbraw/zinc/77/20/92/793772092.db2.gz FYOXUJJAOZOROR-CQSZACIVSA-N 2 0 361.512 -2.027 20 0 FAADRP CC(C)COC[C@H](O)C[N@H+]1C[C@@H](NC(=O)COCC[NH+](C)C)[C@@H](O)C1 ZINC001220764345 793774738 /nfs/dbraw/zinc/77/47/38/793774738.db2.gz IJSUCFINCYLOJZ-OAGGEKHMSA-N 2 0 361.483 -1.241 20 0 FAADRP CC(C)COC[C@@H](O)C[N@H+]1C[C@@H](NC(=O)COCC[NH+](C)C)[C@@H](O)C1 ZINC001220764346 793775509 /nfs/dbraw/zinc/77/55/09/793775509.db2.gz IJSUCFINCYLOJZ-XHSDSOJGSA-N 2 0 361.483 -1.241 20 0 FAADRP C[NH+](C)CCOCC(=O)N[C@@H]1C[N@H+](CCCO[C@@H]2CCOC2)C[C@@H]1O ZINC001220764371 793775131 /nfs/dbraw/zinc/77/51/31/793775131.db2.gz IYLPEPJYXGNQSB-OAGGEKHMSA-N 2 0 359.467 -1.079 20 0 FAADRP C[NH+](C)CCOCC(=O)N[C@@H]1C[N@H+](CCCO[C@H]2CCOC2)C[C@@H]1O ZINC001220764372 793775054 /nfs/dbraw/zinc/77/50/54/793775054.db2.gz IYLPEPJYXGNQSB-XHSDSOJGSA-N 2 0 359.467 -1.079 20 0 FAADRP C[NH+](C)CCOCC(=O)N[C@@H]1C[N@H+](CCCN2CCCC2=O)C[C@@H]1O ZINC001220764538 793775183 /nfs/dbraw/zinc/77/51/83/793775183.db2.gz ODJNMJPUPUBTBI-CABCVRRESA-N 2 0 356.467 -1.262 20 0 FAADRP C[NH+](C)CCOCC(=O)N[C@@H]1C[N@H+](C[C@@H](O)Cn2cccn2)C[C@@H]1O ZINC001220764690 793775478 /nfs/dbraw/zinc/77/54/78/793775478.db2.gz SNTRSZBPYVJXHM-KFWWJZLASA-N 2 0 355.439 -2.017 20 0 FAADRP C[NH+](C)CCOCC(=O)N[C@@H]1C[N@H+](C[C@H](O)Cn2cccn2)C[C@@H]1O ZINC001220764691 793775267 /nfs/dbraw/zinc/77/52/67/793775267.db2.gz SNTRSZBPYVJXHM-ZNMIVQPWSA-N 2 0 355.439 -2.017 20 0 FAADRP Cn1ccc(C[N@H+]2C[C@@H](NC(=O)COCC[NH+](C)C)[C@@H](O)C2)cc1=O ZINC001220767177 793775236 /nfs/dbraw/zinc/77/52/36/793775236.db2.gz RHINLSZUOCGEPP-CABCVRRESA-N 2 0 352.435 -1.375 20 0 FAADRP C[NH+](C)CCOCC(=O)N[C@@H]1C[N@H+](C[C@H]2CCc3ncnn32)C[C@@H]1O ZINC001220768482 793775922 /nfs/dbraw/zinc/77/59/22/793775922.db2.gz OBOVNWLHOGENFW-MCIONIFRSA-N 2 0 352.439 -1.495 20 0 FAADRP C[NH+](C)CCOCC(=O)N[C@@H]1C[N@H+](C[C@@H]2CCc3ncnn32)C[C@@H]1O ZINC001220768483 793776131 /nfs/dbraw/zinc/77/61/31/793776131.db2.gz OBOVNWLHOGENFW-MJBXVCDLSA-N 2 0 352.439 -1.495 20 0 FAADRP COCCOC[C@H](O)C[N@H+]1C[C@@H](NC(=O)COCC[NH+](C)C)[C@@H](O)C1 ZINC001220768584 793776196 /nfs/dbraw/zinc/77/61/96/793776196.db2.gz SJTUSQGIPYNDRR-KFWWJZLASA-N 2 0 363.455 -2.250 20 0 FAADRP COCCOC[C@@H](O)C[N@H+]1C[C@@H](NC(=O)COCC[NH+](C)C)[C@@H](O)C1 ZINC001220768585 793775880 /nfs/dbraw/zinc/77/58/80/793775880.db2.gz SJTUSQGIPYNDRR-ZNMIVQPWSA-N 2 0 363.455 -2.250 20 0 FAADRP C[NH+](C)CCOCC(=O)N[C@@H]1C[N@H+](C[C@H]2CCNC(=O)CC2)C[C@@H]1O ZINC001220768705 793775763 /nfs/dbraw/zinc/77/57/63/793775763.db2.gz ZECVEDRXINGXSQ-KFWWJZLASA-N 2 0 356.467 -1.358 20 0 FAADRP C[NH+](C)CCOCC(=O)N[C@@H]1C[N@H+](C[C@@H]2CCNC(=O)CC2)C[C@@H]1O ZINC001220768706 793776286 /nfs/dbraw/zinc/77/62/86/793776286.db2.gz ZECVEDRXINGXSQ-ZNMIVQPWSA-N 2 0 356.467 -1.358 20 0 FAADRP COCCOC[C@H](O)C[N@H+]1C[C@@H](NC(=O)C23CC[NH+](CC2)C3)[C@@H](O)C1 ZINC001220771250 793776057 /nfs/dbraw/zinc/77/60/57/793776057.db2.gz KLDTYGZHFSFIAI-KFWWJZLASA-N 2 0 357.451 -1.733 20 0 FAADRP COCCOC[C@@H](O)C[N@H+]1C[C@@H](NC(=O)C23CC[NH+](CC2)C3)[C@@H](O)C1 ZINC001220771251 793775831 /nfs/dbraw/zinc/77/58/31/793775831.db2.gz KLDTYGZHFSFIAI-ZNMIVQPWSA-N 2 0 357.451 -1.733 20 0 FAADRP COC(=O)[C@H](Cc1cncn1C)NC(=O)[C@@H]([NH3+])CN1CCC([NH3+])CC1 ZINC001220772392 793777361 /nfs/dbraw/zinc/77/73/61/793777361.db2.gz NJMFYKYMNKDNIX-KBPBESRZSA-N 2 0 352.439 -1.629 20 0 FAADRP COC(=O)[C@H](Cc1cncn1C)NC(=O)[C@H]([NH3+])CN1CCC([NH3+])CC1 ZINC001220772393 793777146 /nfs/dbraw/zinc/77/71/46/793777146.db2.gz NJMFYKYMNKDNIX-KGLIPLIRSA-N 2 0 352.439 -1.629 20 0 FAADRP COC(=O)[C@@H](Cc1cncn1C)NC(=O)[C@@H]([NH3+])CN1CCC([NH3+])CC1 ZINC001220772394 793777185 /nfs/dbraw/zinc/77/71/85/793777185.db2.gz NJMFYKYMNKDNIX-UONOGXRCSA-N 2 0 352.439 -1.629 20 0 FAADRP COC(=O)[C@@H](Cc1cncn1C)NC(=O)[C@H]([NH3+])CN1CCC([NH3+])CC1 ZINC001220772395 793777327 /nfs/dbraw/zinc/77/73/27/793777327.db2.gz NJMFYKYMNKDNIX-ZIAGYGMSSA-N 2 0 352.439 -1.629 20 0 FAADRP C[C@H]([NH3+])C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H]1CC[NH2+]C[C@@H]1C(F)(F)F ZINC001220803127 793780089 /nfs/dbraw/zinc/78/00/89/793780089.db2.gz CBJAXQDWKIPIJK-JBDRJPRFSA-N 2 0 353.345 -1.650 20 0 FAADRP C[C@H]([NH3+])C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H]1CC[NH2+]C[C@H]1C(F)(F)F ZINC001220803128 793779858 /nfs/dbraw/zinc/77/98/58/793779858.db2.gz CBJAXQDWKIPIJK-KDXUFGMBSA-N 2 0 353.345 -1.650 20 0 FAADRP C[C@H]([NH3+])C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H]1CC[NH2+]C[C@H]1C(F)(F)F ZINC001220803129 793779773 /nfs/dbraw/zinc/77/97/73/793779773.db2.gz CBJAXQDWKIPIJK-KZVJFYERSA-N 2 0 353.345 -1.650 20 0 FAADRP C[C@H]([NH3+])C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H]1CC[NH2+]C[C@@H]1C(F)(F)F ZINC001220803130 793780130 /nfs/dbraw/zinc/78/01/30/793780130.db2.gz CBJAXQDWKIPIJK-MAUMQABQSA-N 2 0 353.345 -1.650 20 0 FAADRP C[C@H]([NH3+])C(=O)N[C@H](CCC(=O)N[C@H]1CC[NH2+]C[C@@H]1C(F)(F)F)C(N)=O ZINC001220804554 793779839 /nfs/dbraw/zinc/77/98/39/793779839.db2.gz OOUGBWMYRWTTMV-AATLWQCWSA-N 2 0 367.372 -1.260 20 0 FAADRP C[C@H]([NH3+])C(=O)N[C@H](CCC(=O)N[C@@H]1CC[NH2+]C[C@@H]1C(F)(F)F)C(N)=O ZINC001220804562 793779955 /nfs/dbraw/zinc/77/99/55/793779955.db2.gz OOUGBWMYRWTTMV-AXTSPUMRSA-N 2 0 367.372 -1.260 20 0 FAADRP C[C@H]([NH3+])C(=O)N[C@H](CCC(=O)N[C@H]1CC[NH2+]C[C@H]1C(F)(F)F)C(N)=O ZINC001220804564 793780197 /nfs/dbraw/zinc/78/01/97/793780197.db2.gz OOUGBWMYRWTTMV-QCLAVDOMSA-N 2 0 367.372 -1.260 20 0 FAADRP C[C@H]([NH3+])C(=O)N[C@H](CCC(=O)N[C@@H]1CC[NH2+]C[C@H]1C(F)(F)F)C(N)=O ZINC001220804566 793779792 /nfs/dbraw/zinc/77/97/92/793779792.db2.gz OOUGBWMYRWTTMV-SGIHWFKDSA-N 2 0 367.372 -1.260 20 0 FAADRP COCCOC[C@H](O)C[N@H+]1C[C@@H](NC(=O)CCCC[NH+](C)C)[C@@H](O)C1 ZINC001220809258 793779870 /nfs/dbraw/zinc/77/98/70/793779870.db2.gz PSWNQDSBPZVLSV-OAGGEKHMSA-N 2 0 361.483 -1.097 20 0 FAADRP COCCOC[C@@H](O)C[N@H+]1C[C@@H](NC(=O)CCCC[NH+](C)C)[C@@H](O)C1 ZINC001220809259 793780184 /nfs/dbraw/zinc/78/01/84/793780184.db2.gz PSWNQDSBPZVLSV-XHSDSOJGSA-N 2 0 361.483 -1.097 20 0 FAADRP CCC[N@H+](C)CCC(=O)N[C@@H]1C[NH+](C[C@@H](O)COCCOC)C[C@@H]1O ZINC001220825911 793781787 /nfs/dbraw/zinc/78/17/87/793781787.db2.gz JHNWSJVEXYDCFH-OAGGEKHMSA-N 2 0 361.483 -1.097 20 0 FAADRP CCC[N@H+](C)CCC(=O)N[C@@H]1C[NH+](C[C@H](O)COCCOC)C[C@@H]1O ZINC001220825912 793782573 /nfs/dbraw/zinc/78/25/73/793782573.db2.gz JHNWSJVEXYDCFH-XHSDSOJGSA-N 2 0 361.483 -1.097 20 0 FAADRP CCOC(=O)C1=C(NC(=O)[C@@H]2C[N@H+](C)CC3(CC[NH2+]CC3)O2)C[NH2+]C1 ZINC001220827214 793781819 /nfs/dbraw/zinc/78/18/19/793781819.db2.gz KAYBHFMTJSBQKI-AWEZNQCLSA-N 3 0 352.435 -1.024 20 0 FAADRP CCOC(=O)C1=C(NC(=O)[C@H]2C[N@H+](C)CC3(CC[NH2+]CC3)O2)C[NH2+]C1 ZINC001220827215 793782394 /nfs/dbraw/zinc/78/23/94/793782394.db2.gz KAYBHFMTJSBQKI-CQSZACIVSA-N 3 0 352.435 -1.024 20 0 FAADRP CCOC(=O)C1=C(NC(=O)[C@H]2C[NH2+]CC23CCS(=O)(=O)CC3)C[NH2+]C1 ZINC001220827624 793782289 /nfs/dbraw/zinc/78/22/89/793782289.db2.gz VZELZPNTHQHTCP-GFCCVEGCSA-N 2 0 371.459 -1.063 20 0 FAADRP CCOC(=O)C1=C(NC(=O)[C@@H]2C[NH2+]CC23CCS(=O)(=O)CC3)C[NH2+]C1 ZINC001220827625 793782048 /nfs/dbraw/zinc/78/20/48/793782048.db2.gz VZELZPNTHQHTCP-LBPRGKRZSA-N 2 0 371.459 -1.063 20 0 FAADRP CCOC(=O)C1=C(NC(=O)CNC(=O)[C@@H]([NH3+])COC(C)(C)C)C[NH2+]C1 ZINC001220829907 793781642 /nfs/dbraw/zinc/78/16/42/793781642.db2.gz FMWYRGNTDRFZAG-NSHDSACASA-N 2 0 356.423 -1.218 20 0 FAADRP CCOC(=O)C1=C(NC(=O)CC[C@@H](NC(=O)[C@H](C)[NH3+])C(N)=O)C[NH2+]C1 ZINC001220829915 793781836 /nfs/dbraw/zinc/78/18/36/793781836.db2.gz FUDREGBHUKLJGC-WCBMZHEXSA-N 2 0 355.395 -2.380 20 0 FAADRP CCOC(=O)C1=C(NC(=O)[C@@H]2COC(C)(C)N2C(=O)[C@H](C)[NH3+])C[NH2+]C1 ZINC001220830078 793781902 /nfs/dbraw/zinc/78/19/02/793781902.db2.gz MQIMYQGLPDIEMH-CABZTGNLSA-N 2 0 354.407 -1.166 20 0 FAADRP C[C@H](NC(=O)[C@@H]([NH3+])CO)C(=O)n1cc(Br)ccc1=NCC[NH3+] ZINC001220869803 793787703 /nfs/dbraw/zinc/78/77/03/793787703.db2.gz DECFDTBKMZRSQB-WPRPVWTQSA-N 2 0 374.239 -1.426 20 0 FAADRP [NH3+][C@H](CN1CCC([NH3+])CC1)C(=O)NCCOCCN1C(=O)C=CC1=O ZINC001220878720 793788087 /nfs/dbraw/zinc/78/80/87/793788087.db2.gz NYBPAHYLFGDPJP-CYBMUJFWSA-N 2 0 353.423 -2.205 20 0 FAADRP [NH3+][C@@H](CN1CCC([NH3+])CC1)C(=O)NCCOCCN1C(=O)C=CC1=O ZINC001220878721 793788870 /nfs/dbraw/zinc/78/88/70/793788870.db2.gz NYBPAHYLFGDPJP-ZDUSSCGKSA-N 2 0 353.423 -2.205 20 0 FAADRP C[C@H]([NH3+])C(=O)N1[C@H](C(=O)NCCN(CC[NH3+])N(O)N=O)COC1(C)C ZINC001220903335 793793181 /nfs/dbraw/zinc/79/31/81/793793181.db2.gz QFEQURJILWYYDN-UWVGGRQHSA-N 2 0 361.403 -2.038 20 0 FAADRP CC(C)(C)OC[C@H]([NH3+])C(=O)NCC(=O)NCCN(CC[NH3+])N(O)N=O ZINC001220903716 793793309 /nfs/dbraw/zinc/79/33/09/793793309.db2.gz YNVZZRBUJZDGQX-JTQLQIEISA-N 2 0 363.419 -2.091 20 0 FAADRP CS(=O)(=O)N1CCC(CNC(=O)[C@@H]([NH3+])CN2CCC([NH3+])CC2)CC1 ZINC001220926309 793796412 /nfs/dbraw/zinc/79/64/12/793796412.db2.gz GPBLBIAYYQEKAA-AWEZNQCLSA-N 2 0 361.512 -1.475 20 0 FAADRP CS(=O)(=O)N1CCC(CNC(=O)[C@H]([NH3+])CN2CCC([NH3+])CC2)CC1 ZINC001220926310 793796602 /nfs/dbraw/zinc/79/66/02/793796602.db2.gz GPBLBIAYYQEKAA-CQSZACIVSA-N 2 0 361.512 -1.475 20 0 FAADRP C[C@H]([NH3+])C(=O)N[C@@H](CC(N)=O)C(=O)N(C1COC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001220931196 793797216 /nfs/dbraw/zinc/79/72/16/793797216.db2.gz YSNYDYPOTVJCQM-ZPFDUUQYSA-N 2 0 355.439 -1.809 20 0 FAADRP [NH3+][C@@H](CCCNC(=O)c1cnccn1)C(=O)NCCO[C@@H]1CC[NH2+]C1 ZINC001220936701 793800814 /nfs/dbraw/zinc/80/08/14/793800814.db2.gz IIWVIRBVAPTYCS-OLZOCXBDSA-N 2 0 350.423 -1.191 20 0 FAADRP [NH3+][C@@H](CCCNC(=O)c1cnccn1)C(=O)NCCO[C@H]1CC[NH2+]C1 ZINC001220936703 793800870 /nfs/dbraw/zinc/80/08/70/793800870.db2.gz IIWVIRBVAPTYCS-STQMWFEESA-N 2 0 350.423 -1.191 20 0 FAADRP C[C@H](NC(=O)[C@@H]1CCCN1C(=O)C[NH3+])C(=O)NCCO[C@H]1CC[NH2+]C1 ZINC001220936895 793801027 /nfs/dbraw/zinc/80/10/27/793801027.db2.gz JXWXUENMKCANFS-AVGNSLFASA-N 2 0 355.439 -2.065 20 0 FAADRP C[C@H](NC(=O)[C@@H]1CCCN1C(=O)C[NH3+])C(=O)NCCO[C@@H]1CC[NH2+]C1 ZINC001220936898 793800912 /nfs/dbraw/zinc/80/09/12/793800912.db2.gz JXWXUENMKCANFS-XQQFMLRXSA-N 2 0 355.439 -2.065 20 0 FAADRP [NH3+]CCCC[C@H]([NH3+])C(=O)N1CCC[C@H]1C(=O)NCCO[C@@H]1CC[NH2+]C1 ZINC001220937473 793800268 /nfs/dbraw/zinc/80/02/68/793800268.db2.gz SKZXTFMQOBYCLB-ILXRZTDVSA-N 3 0 355.483 -1.072 20 0 FAADRP [NH3+]CCCC[C@H]([NH3+])C(=O)N1CCC[C@H]1C(=O)NCCO[C@H]1CC[NH2+]C1 ZINC001220937474 793800534 /nfs/dbraw/zinc/80/05/34/793800534.db2.gz SKZXTFMQOBYCLB-KKUMJFAQSA-N 3 0 355.483 -1.072 20 0 FAADRP C[C@H](NC(=O)[C@@H]([NH3+])CO)C(=O)N(c1ccncn1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001220941572 793804405 /nfs/dbraw/zinc/80/44/05/793804405.db2.gz UMIQWKMMOMYNCQ-CYDGBPFRSA-N 2 0 350.423 -1.096 20 0 FAADRP Cc1cn([C@H]2C[C@H](NC(=O)C[NH2+]CCC[NH3+])[C@@H](CO)O2)c(=O)[nH]c1=O ZINC001220967078 793806339 /nfs/dbraw/zinc/80/63/39/793806339.db2.gz RBYSMAXSMHAZIG-DMDPSCGWSA-N 2 0 355.395 -2.040 20 0 FAADRP Cc1cn([C@H]2C[C@H](NC(=O)[C@@H]([NH3+])CCC[NH3+])[C@@H](CO)O2)c(=O)[nH]c1=O ZINC001220967296 793807023 /nfs/dbraw/zinc/80/70/23/793807023.db2.gz ZPJDUZYHMCUAQN-NNYUYHANSA-N 2 0 355.395 -1.912 20 0 FAADRP Cc1cn([C@H]2C[C@H](NC(=O)[C@H]([NH3+])CCC[NH3+])[C@@H](CO)O2)c(=O)[nH]c1=O ZINC001220967297 793807171 /nfs/dbraw/zinc/80/71/71/793807171.db2.gz ZPJDUZYHMCUAQN-WRWGMCAJSA-N 2 0 355.395 -1.912 20 0 FAADRP C[C@H](NC(=O)[C@@H]([NH3+])CO)C(=O)N[C@H]1CC[C@H](NC(=O)C[NH+](C)C)CC1 ZINC001221006238 793821404 /nfs/dbraw/zinc/82/14/04/793821404.db2.gz CRUNQQBLQATNJS-CYDGBPFRSA-N 2 0 357.455 -2.084 20 0 FAADRP C[NH+](C)CC(=O)N[C@H]1CC[C@H](NC(=O)[C@H]([NH3+])CCCNC(N)=O)CC1 ZINC001221006658 793821161 /nfs/dbraw/zinc/82/11/61/793821161.db2.gz KXPILSRGCGHBOO-JHJVBQTASA-N 2 0 356.471 -1.133 20 0 FAADRP COCC(=O)N[C@H]1CC[C@H](NC(=O)[C@@H]([NH3+])CN2CCC([NH3+])CC2)CC1 ZINC001221007035 793821474 /nfs/dbraw/zinc/82/14/74/793821474.db2.gz SQPGWHKBQGZXEY-KKUMJFAQSA-N 2 0 355.483 -1.073 20 0 FAADRP COCC(=O)N[C@H]1CC[C@H](NC(=O)[C@H]([NH3+])CN2CCC([NH3+])CC2)CC1 ZINC001221007036 793821209 /nfs/dbraw/zinc/82/12/09/793821209.db2.gz SQPGWHKBQGZXEY-RBSFLKMASA-N 2 0 355.483 -1.073 20 0 FAADRP C[NH+](C)CC(=O)N[C@H]1CC[C@H](NC(=O)[C@@H]2COC3(C[NH2+]C3)CN2)CC1 ZINC001221007150 793821224 /nfs/dbraw/zinc/82/12/24/793821224.db2.gz XTAIPRWYCYEVPJ-IHRRRGAJSA-N 2 0 353.467 -1.578 20 0 FAADRP C[NH+](C)CC(=O)N[C@H]1CC[C@H](NC(=O)[C@H]2COC3(C[NH2+]C3)CN2)CC1 ZINC001221007151 793821334 /nfs/dbraw/zinc/82/13/34/793821334.db2.gz XTAIPRWYCYEVPJ-MGPQQGTHSA-N 2 0 353.467 -1.578 20 0 FAADRP CS(=O)(=O)N(CC[NH3+])CC(=O)N[C@H]1CC[C@H]([NH+]2CCOCC2)CC1 ZINC001221056348 793824760 /nfs/dbraw/zinc/82/47/60/793824760.db2.gz ORBWQIFNHPKKRH-HDJSIYSDSA-N 2 0 362.496 -1.034 20 0 FAADRP CCC(CC)[C@@H](NC(=O)[C@H](CO)[NH2+]C)[C@H]1[C@H]([NH3+])C[C@H](C(=O)OC)[C@H]1O ZINC001221070496 793828572 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JPIUBWVAMBCYBS-AWEZNQCLSA-N 2 0 353.448 -1.506 20 0 FAADRP O=C(NCc1cc(N2CCS(=O)(=O)CC2)cc[nH+]1)[C@H]1C[NH2+]CCN1 ZINC001221148645 793840442 /nfs/dbraw/zinc/84/04/42/793840442.db2.gz JPIUBWVAMBCYBS-CQSZACIVSA-N 2 0 353.448 -1.506 20 0 FAADRP CC(=O)OC[C@H]([NH3+])C(=O)NCc1cc(N2CCS(=O)(=O)CC2)cc[nH+]1 ZINC001221148651 793841001 /nfs/dbraw/zinc/84/10/01/793841001.db2.gz JUKUTXAJFLIXFQ-AWEZNQCLSA-N 2 0 370.431 -1.177 20 0 FAADRP [NH3+]CCC[NH2+]CC(=O)NCc1cc(N2CCS(=O)(=O)CC2)cc[nH+]1 ZINC001221148677 793841191 /nfs/dbraw/zinc/84/11/91/793841191.db2.gz KYSKSPJKPVBSFT-UHFFFAOYSA-N 3 0 355.464 -1.129 20 0 FAADRP O=C(NCc1cc(N2CCS(=O)(=O)CC2)cc[nH+]1)[C@H]1[NH2+]CC[C@@H]1O ZINC001221148931 793840499 /nfs/dbraw/zinc/84/04/99/793840499.db2.gz UKVQPQLNONFMIA-KBPBESRZSA-N 2 0 354.432 -1.345 20 0 FAADRP O=C(NCc1cc(N2CCS(=O)(=O)CC2)cc[nH+]1)[C@H]1[NH2+]CC[C@H]1O ZINC001221148932 793840839 /nfs/dbraw/zinc/84/08/39/793840839.db2.gz UKVQPQLNONFMIA-KGLIPLIRSA-N 2 0 354.432 -1.345 20 0 FAADRP O=C(CN1CC[NH2+]CC1)NCc1cc(N2CCS(=O)(=O)CC2)cc[nH+]1 ZINC001221148940 793840536 /nfs/dbraw/zinc/84/05/36/793840536.db2.gz UMMMDSRRCBMTJE-UHFFFAOYSA-N 2 0 367.475 -1.162 20 0 FAADRP N[C@H]1C[NH2+]C[C@@H]1C(=O)NCc1cc(N2CCS(=O)(=O)CC2)cc[nH+]1 ZINC001221148990 793841140 /nfs/dbraw/zinc/84/11/40/793841140.db2.gz VIJSCLVRXKGMQD-KBPBESRZSA-N 2 0 353.448 -1.521 20 0 FAADRP N[C@@]1(C(=O)NCc2cc(N3CCS(=O)(=O)CC3)cc[nH+]2)CC[NH2+]C1 ZINC001221149148 793841311 /nfs/dbraw/zinc/84/13/11/793841311.db2.gz XVPCHRIWEQIQGQ-HNNXBMFYSA-N 2 0 353.448 -1.377 20 0 FAADRP N[C@]1(C(=O)NCc2cc(N3CCS(=O)(=O)CC3)cc[nH+]2)CC[NH2+]C1 ZINC001221149149 793841076 /nfs/dbraw/zinc/84/10/76/793841076.db2.gz XVPCHRIWEQIQGQ-OAHLLOKOSA-N 2 0 353.448 -1.377 20 0 FAADRP [NH3+]CCC[C@H]([NH3+])C(=O)NCc1cc(N2CCS(=O)(=O)CC2)cc[nH+]1 ZINC001221149151 793840710 /nfs/dbraw/zinc/84/07/10/793840710.db2.gz XVYDDQQRRZSMTH-AWEZNQCLSA-N 3 0 355.464 -1.001 20 0 FAADRP [NH3+]CCC[C@@H]([NH3+])C(=O)NCc1cc(N2CCS(=O)(=O)CC2)cc[nH+]1 ZINC001221149153 793840469 /nfs/dbraw/zinc/84/04/69/793840469.db2.gz XVYDDQQRRZSMTH-CQSZACIVSA-N 3 0 355.464 -1.001 20 0 FAADRP O=C(NCc1cc(N2CCS(=O)(=O)CC2)cc[nH+]1)[C@H]1C[NH2+]C[C@@H]1O ZINC001221149179 793841286 /nfs/dbraw/zinc/84/12/86/793841286.db2.gz YKVBEBSHIMCYAW-KBPBESRZSA-N 2 0 354.432 -1.487 20 0 FAADRP O=C(NCc1cc(N2CCS(=O)(=O)CC2)cc[nH+]1)[C@@H]1C[NH2+]C[C@@H]1O ZINC001221149180 793842703 /nfs/dbraw/zinc/84/27/03/793842703.db2.gz YKVBEBSHIMCYAW-KGLIPLIRSA-N 2 0 354.432 -1.487 20 0 FAADRP O=C(NCc1cc(N2CCS(=O)(=O)CC2)cc[nH+]1)[C@H]1C[NH2+]C[C@H]1O ZINC001221149181 793841971 /nfs/dbraw/zinc/84/19/71/793841971.db2.gz YKVBEBSHIMCYAW-UONOGXRCSA-N 2 0 354.432 -1.487 20 0 FAADRP O=C(NCc1cc(N2CCS(=O)(=O)CC2)cc[nH+]1)[C@@H]1C[NH2+]C[C@H]1O ZINC001221149182 793842675 /nfs/dbraw/zinc/84/26/75/793842675.db2.gz YKVBEBSHIMCYAW-ZIAGYGMSSA-N 2 0 354.432 -1.487 20 0 FAADRP COCCOc1nccc(CNC(=O)[C@@H]([NH3+])CN2CCC([NH3+])CC2)n1 ZINC001221158318 793843459 /nfs/dbraw/zinc/84/34/59/793843459.db2.gz ZIAMWORPESTOAQ-AWEZNQCLSA-N 2 0 352.439 -1.132 20 0 FAADRP COCCOc1nccc(CNC(=O)[C@H]([NH3+])CN2CCC([NH3+])CC2)n1 ZINC001221158319 793843639 /nfs/dbraw/zinc/84/36/39/793843639.db2.gz ZIAMWORPESTOAQ-CQSZACIVSA-N 2 0 352.439 -1.132 20 0 FAADRP COC(=O)[C@H](CCC[NH3+])NC(=O)[C@H]1C[NH2+]CC12CCS(=O)(=O)CC2 ZINC001221187596 793848480 /nfs/dbraw/zinc/84/84/80/793848480.db2.gz BDYQBKVIHWPQIA-NEPJUHHUSA-N 2 0 361.464 -1.203 20 0 FAADRP COC(=O)[C@H](CCC[NH3+])NC(=O)[C@@H]1C[NH2+]CC12CCS(=O)(=O)CC2 ZINC001221187597 793848202 /nfs/dbraw/zinc/84/82/02/793848202.db2.gz BDYQBKVIHWPQIA-RYUDHWBXSA-N 2 0 361.464 -1.203 20 0 FAADRP COC(=O)[C@H](CCC[NH3+])NC(=O)[C@H]1Cn2nnnc2C12CC[NH2+]CC2 ZINC001221188325 793849817 /nfs/dbraw/zinc/84/98/17/793849817.db2.gz SJHVWMKMICUYEM-MNOVXSKESA-N 2 0 351.411 -1.679 20 0 FAADRP COC(=O)[C@H](CCC[NH3+])NC(=O)[C@@H]1Cn2nnnc2C12CC[NH2+]CC2 ZINC001221188326 793849565 /nfs/dbraw/zinc/84/95/65/793849565.db2.gz SJHVWMKMICUYEM-QWRGUYRKSA-N 2 0 351.411 -1.679 20 0 FAADRP COC(=O)[C@H](CCC[NH3+])NC(=O)[C@H]1Cn2cnnc2C12CC[NH2+]CC2 ZINC001221188390 793849826 /nfs/dbraw/zinc/84/98/26/793849826.db2.gz VKSRBHGBXABRET-NEPJUHHUSA-N 2 0 350.423 -1.074 20 0 FAADRP COC(=O)[C@H](CCC[NH3+])NC(=O)[C@@H]1Cn2cnnc2C12CC[NH2+]CC2 ZINC001221188391 793849056 /nfs/dbraw/zinc/84/90/56/793849056.db2.gz VKSRBHGBXABRET-RYUDHWBXSA-N 2 0 350.423 -1.074 20 0 FAADRP CC(C)(C)[NH+]1CC(NC(=O)CNC(=O)CNC(=O)CNC(=O)C[NH3+])C1 ZINC001221194236 793850900 /nfs/dbraw/zinc/85/09/00/793850900.db2.gz NTKZGUZBFCATNW-UHFFFAOYSA-N 2 0 356.427 -3.107 20 0 FAADRP C[N@@H+]1CCC[C@](C)(NC(=O)CNC(=O)CNC(=O)CNC(=O)C[NH3+])C1 ZINC001221240959 793854876 /nfs/dbraw/zinc/85/48/76/793854876.db2.gz IPJLXXKOSOGOLD-HNNXBMFYSA-N 2 0 356.427 -3.106 20 0 FAADRP C[N@@H+]1CCC[C@@](C)(NC(=O)CNC(=O)CNC(=O)CNC(=O)C[NH3+])C1 ZINC001221240960 793853647 /nfs/dbraw/zinc/85/36/47/793853647.db2.gz IPJLXXKOSOGOLD-OAHLLOKOSA-N 2 0 356.427 -3.106 20 0 FAADRP [NH3+]CCCC[C@H]([NH3+])C(=O)N1CCC[C@H]1C(=O)NC1CN(C2COC2)C1 ZINC001221245914 793854455 /nfs/dbraw/zinc/85/44/55/793854455.db2.gz IJIFZPRUKABGSU-GJZGRUSLSA-N 2 0 353.467 -1.367 20 0 FAADRP Nc1cn(C(=O)[C@@H]2CCCN2C(=O)[C@@H]([NH3+])CCCC[NH3+])c(N)nc1=O ZINC001221328848 793856827 /nfs/dbraw/zinc/85/68/27/793856827.db2.gz GRMKEKNSIRLVPX-ONGXEEELSA-N 2 0 351.411 -1.262 20 0 FAADRP CS(=O)(=O)N(CC[NH3+])CC(=O)N1CCC(C2=CC=C(N)C[NH2+]2)CC1 ZINC001221391339 793857741 /nfs/dbraw/zinc/85/77/41/793857741.db2.gz LOECIYPHWQMCCK-UHFFFAOYSA-N 2 0 357.480 -1.225 20 0 FAADRP CC(C)N(C(=O)CNC(=O)CNC(=O)CNC(=O)C[NH3+])C(C)(C)C[NH3+] ZINC001221394311 793858118 /nfs/dbraw/zinc/85/81/18/793858118.db2.gz LYHHNCIKJHAGRP-UHFFFAOYSA-N 2 0 358.443 -2.732 20 0 FAADRP C[NH+]1CCC(CO)(NC(=O)[C@H]2C[NH2+]CC23CCS(=O)(=O)CC3)CC1 ZINC001221403155 793858421 /nfs/dbraw/zinc/85/84/21/793858421.db2.gz RAFOEMPAYNSHSQ-CYBMUJFWSA-N 2 0 359.492 -1.026 20 0 FAADRP C[NH+]1CCC(CO)(NC(=O)[C@@H]2C[NH2+]CC23CCS(=O)(=O)CC3)CC1 ZINC001221403158 793858464 /nfs/dbraw/zinc/85/84/64/793858464.db2.gz RAFOEMPAYNSHSQ-ZDUSSCGKSA-N 2 0 359.492 -1.026 20 0 FAADRP COc1cccc([C@@H](C[NH3+])NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)[NH3+])c1 ZINC001221404532 793857800 /nfs/dbraw/zinc/85/78/00/793857800.db2.gz NCGHUMXCYQNOHD-TVYUQYBPSA-N 2 0 351.407 -1.481 20 0 FAADRP COc1cccc([C@H](C[NH3+])NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)[NH3+])c1 ZINC001221404533 793858512 /nfs/dbraw/zinc/85/85/12/793858512.db2.gz NCGHUMXCYQNOHD-XDTLVQLUSA-N 2 0 351.407 -1.481 20 0 FAADRP C[NH+](C)C[C@@H]1CN(C(=O)NCCN2C(=O)CNC2=O)C[C@H]1C[NH+](C)C ZINC001221874275 793883447 /nfs/dbraw/zinc/88/34/47/793883447.db2.gz CXTKMNAHKFOXQM-CHWSQXEVSA-N 2 0 354.455 -1.081 20 0 FAADRP CNC(=O)NC(=O)C[NH2+][C@@H]1CCCC[C@H]1NC(=O)[C@H]1CN(C)CCO1 ZINC001225524976 793908769 /nfs/dbraw/zinc/90/87/69/793908769.db2.gz KNHHTYRSZHINRW-JHJVBQTASA-N 2 0 355.439 -1.210 20 0 FAADRP CNC(=O)NC(=O)C[NH2+][C@@H]1CCCC[C@H]1NC(=O)[C@@H]1CN(C)CCO1 ZINC001225525029 793908460 /nfs/dbraw/zinc/90/84/60/793908460.db2.gz KNHHTYRSZHINRW-UPJWGTAASA-N 2 0 355.439 -1.210 20 0 FAADRP CN1CCO[C@H](C(=O)N[C@@H]2CCCC[C@H]2[NH2+]CCNS(C)(=O)=O)C1 ZINC001225525219 793908546 /nfs/dbraw/zinc/90/85/46/793908546.db2.gz NMLLPVGMSWWCAW-MCIONIFRSA-N 2 0 362.496 -1.117 20 0 FAADRP CN1CCO[C@@H](C(=O)N[C@@H]2CCCC[C@H]2[NH2+]CCNS(C)(=O)=O)C1 ZINC001225525221 793908320 /nfs/dbraw/zinc/90/83/20/793908320.db2.gz NMLLPVGMSWWCAW-MGPQQGTHSA-N 2 0 362.496 -1.117 20 0 FAADRP C[NH+](C)CCC(=O)N[C@@H]1CCCC[C@H]1[NH2+]CC(=O)N1CCNC(=O)C1 ZINC001228365394 793921230 /nfs/dbraw/zinc/92/12/30/793921230.db2.gz FOGVJRKTMWFGCI-ZIAGYGMSSA-N 2 0 353.467 -1.087 20 0 FAADRP NC(=O)NC(=O)C[NH2+][C@@H]1CCCC[C@H]1NC(=O)CCN1CCOCC1 ZINC001229142381 793925040 /nfs/dbraw/zinc/92/50/40/793925040.db2.gz SEWMFDVLPZPSSB-CHWSQXEVSA-N 2 0 355.439 -1.079 20 0 FAADRP COc1ccc(CN2CC[NH2+]CCNCC[NH2+]CC2)cc1S(N)(=O)=O ZINC001235871834 793951979 /nfs/dbraw/zinc/95/19/79/793951979.db2.gz ZIWJVMLSPFETDI-UHFFFAOYSA-N 2 0 371.507 -1.073 20 0 FAADRP CS(=O)(=O)N1CCC(CN(CCC[NH3+])CC(=O)NCCC[NH3+])CC1 ZINC001236308856 793952218 /nfs/dbraw/zinc/95/22/18/793952218.db2.gz ICDCJGQCFSTCCG-UHFFFAOYSA-N 2 0 363.528 -1.226 20 0 FAADRP CC1(C)O[C@H]([C@H](O)CO)[C@H](CN(CCC[NH3+])CC(=O)NCCC[NH3+])O1 ZINC001236309389 793952087 /nfs/dbraw/zinc/95/20/87/793952087.db2.gz KHTBQQHYSZLXOG-VNHYZAJKSA-N 2 0 362.471 -2.025 20 0 FAADRP CC1(C)O[C@@H]2O[C@@H](CN(CCC[NH3+])CC(=O)NCCC[NH3+])[C@@H](O)[C@@H]2O1 ZINC001236309543 793952505 /nfs/dbraw/zinc/95/25/05/793952505.db2.gz MPKJPAFSFZMYAJ-ATGSNQNLSA-N 2 0 360.455 -1.661 20 0 FAADRP [NH3+]CCOCCOCCOCCOCCNS(=O)(=O)[C@H]1CC[NH2+]C1 ZINC001238469334 793959177 /nfs/dbraw/zinc/95/91/77/793959177.db2.gz WPLTZTGWZWEEJL-AWEZNQCLSA-N 2 0 369.484 -1.707 20 0 FAADRP [NH3+]CCOCCOCCOCCOCCNS(=O)(=O)[C@@H]1CC[NH2+]C1 ZINC001238469340 793958710 /nfs/dbraw/zinc/95/87/10/793958710.db2.gz WPLTZTGWZWEEJL-CQSZACIVSA-N 2 0 369.484 -1.707 20 0 FAADRP [NH3+]CCOCCOCCOCCNS(=O)(=O)CC1CC[NH2+]CC1 ZINC001238614621 793960046 /nfs/dbraw/zinc/96/00/46/793960046.db2.gz NIQJFCBKLRSCQY-UHFFFAOYSA-N 2 0 353.485 -1.086 20 0 FAADRP CN1CCN(CC[NH+](C)C)C(=O)C12CCN(S(=O)(=O)CC[NH3+])CC2 ZINC001239080317 793960904 /nfs/dbraw/zinc/96/09/04/793960904.db2.gz AJNYDLLTYWRUTE-UHFFFAOYSA-N 2 0 361.512 -1.555 20 0 FAADRP C[NH+]1CCN(C[C@H]2Cn3ccnc3CN(S(=O)(=O)CC[NH3+])C2)CC1 ZINC001239081253 793960894 /nfs/dbraw/zinc/96/08/94/793960894.db2.gz JHBWTBQOLLSHNM-AWEZNQCLSA-N 2 0 356.496 -1.149 20 0 FAADRP C[NH+]1CCN(C[C@@H]2Cn3ccnc3CN(S(=O)(=O)CC[NH3+])C2)CC1 ZINC001239081255 793961929 /nfs/dbraw/zinc/96/19/29/793961929.db2.gz JHBWTBQOLLSHNM-CQSZACIVSA-N 2 0 356.496 -1.149 20 0 FAADRP COc1ncccc1S(=O)(=O)N(CCC[NH3+])CC(=O)NCCC[NH3+] ZINC001239130352 793962012 /nfs/dbraw/zinc/96/20/12/793962012.db2.gz ALLJDUCOJSJTNZ-UHFFFAOYSA-N 2 0 359.452 -1.105 20 0 FAADRP COc1ccc(S(=O)(=O)N(CCC[NH3+])CC(=O)NCCC[NH3+])cn1 ZINC001239130517 793961782 /nfs/dbraw/zinc/96/17/82/793961782.db2.gz CEWPJHALKLHBHQ-UHFFFAOYSA-N 2 0 359.452 -1.105 20 0 FAADRP COC(=O)CCCCS(=O)(=O)N(CCC[NH3+])CC(=O)NCCC[NH3+] ZINC001239130572 793962023 /nfs/dbraw/zinc/96/20/23/793962023.db2.gz DMCXGTOASWENFW-UHFFFAOYSA-N 2 0 366.484 -1.225 20 0 FAADRP Cc1nn(C)c(C)c1S(=O)(=O)N(CCC[NH3+])CC(=O)NCCC[NH3+] ZINC001239131337 793961902 /nfs/dbraw/zinc/96/19/02/793961902.db2.gz MLQSXTXIIPUGJG-UHFFFAOYSA-N 2 0 360.484 -1.159 20 0 FAADRP COC(=O)CCCS(=O)(=O)N(CCC[NH3+])CC(=O)NCCC[NH3+] ZINC001239131352 793962029 /nfs/dbraw/zinc/96/20/29/793962029.db2.gz MTTKUZVCXYNNJR-UHFFFAOYSA-N 2 0 352.457 -1.615 20 0 FAADRP CCOC(=O)C(C)(C)S(=O)(=O)N(CCC[NH3+])CC(=O)NCCC[NH3+] ZINC001239131593 793961718 /nfs/dbraw/zinc/96/17/18/793961718.db2.gz RRXMCTDGAGSGED-UHFFFAOYSA-N 2 0 366.484 -1.226 20 0 FAADRP [NH3+]CCCNC(=O)CN(CCC[NH3+])S(=O)(=O)c1cnc(Cl)nc1 ZINC001239131978 793961958 /nfs/dbraw/zinc/96/19/58/793961958.db2.gz YBJXOYALEZIQGP-UHFFFAOYSA-N 2 0 364.859 -1.066 20 0 FAADRP [NH3+]CCCNC(=O)CN(CCC[NH3+])C(=S)NCCCN1CCOCC1 ZINC001239452120 793962137 /nfs/dbraw/zinc/96/21/37/793962137.db2.gz NFSNMSDKIHZSQU-UHFFFAOYSA-N 2 0 374.555 -1.301 20 0 FAADRP C[S@@](=O)CCCNC(=S)N(CCC[NH3+])CC(=O)NCCC[NH3+] ZINC001239453055 793962447 /nfs/dbraw/zinc/96/24/47/793962447.db2.gz SAMDGKRCTJZFAZ-JOCHJYFZSA-N 2 0 351.542 -1.255 20 0 FAADRP C[S@](=O)CCCNC(=S)N(CCC[NH3+])CC(=O)NCCC[NH3+] ZINC001239453056 793962889 /nfs/dbraw/zinc/96/28/89/793962889.db2.gz SAMDGKRCTJZFAZ-QFIPXVFZSA-N 2 0 351.542 -1.255 20 0 FAADRP [NH3+]CCCNC(=O)CN(CCC[NH3+])C(=S)NCCN1CCOCC1 ZINC001239453119 793962897 /nfs/dbraw/zinc/96/28/97/793962897.db2.gz SZQWXMUUFSLSME-UHFFFAOYSA-N 2 0 360.528 -1.691 20 0 FAADRP O=c1cc(C[NH2+]C[C@@H](O)CC2(O)CC[NH2+]CC2)nc2n1CCCNC2 ZINC001245981430 793965204 /nfs/dbraw/zinc/96/52/04/793965204.db2.gz GXEULPVQOJDWMP-AWEZNQCLSA-N 2 0 351.451 -1.308 20 0 FAADRP O=c1cc(C[NH2+]C[C@H](O)CC2(O)CC[NH2+]CC2)nc2n1CCCNC2 ZINC001245981433 793964990 /nfs/dbraw/zinc/96/49/90/793964990.db2.gz GXEULPVQOJDWMP-CQSZACIVSA-N 2 0 351.451 -1.308 20 0 FAADRP O=S(=O)(CC[NH2+]C[C@H](O)CC1(O)CC[NH2+]CC1)N1CCNCC1 ZINC001245989459 793965494 /nfs/dbraw/zinc/96/54/94/793965494.db2.gz GTCWNQLYDRAUIN-CYBMUJFWSA-N 2 0 350.485 -2.324 20 0 FAADRP O=S(=O)(CC[NH2+]C[C@@H](O)CC1(O)CC[NH2+]CC1)N1CCNCC1 ZINC001245989477 793965401 /nfs/dbraw/zinc/96/54/01/793965401.db2.gz GTCWNQLYDRAUIN-ZDUSSCGKSA-N 2 0 350.485 -2.324 20 0 FAADRP O=C(C1CC[NH+](C[C@@H](O)CC2(O)CC[NH2+]CC2)CC1)N1CC[NH2+]CC1 ZINC001246030978 793965935 /nfs/dbraw/zinc/96/59/35/793965935.db2.gz BSWYQFHWLRPKBC-INIZCTEOSA-N 3 0 354.495 -1.004 20 0 FAADRP O=C(C1CC[NH+](C[C@H](O)CC2(O)CC[NH2+]CC2)CC1)N1CC[NH2+]CC1 ZINC001246031480 793965853 /nfs/dbraw/zinc/96/58/53/793965853.db2.gz BSWYQFHWLRPKBC-MRXNPFEDSA-N 3 0 354.495 -1.004 20 0 FAADRP O=C([C@@H]1C[C@@H](N[C@@H]2CCS(=O)(=O)C23C[NH2+]C3)C[NH2+]1)N1CCSC1 ZINC001246149260 793966754 /nfs/dbraw/zinc/96/67/54/793966754.db2.gz UFTQAPMEAALSSW-GRYCIOLGSA-N 2 0 360.505 -1.632 20 0 FAADRP O=C([C@@H]1C[C@H](N[C@@H]2CCS(=O)(=O)C23C[NH2+]C3)C[NH2+]1)N1CCSC1 ZINC001246149284 793966876 /nfs/dbraw/zinc/96/68/76/793966876.db2.gz UFTQAPMEAALSSW-SDDRHHMPSA-N 2 0 360.505 -1.632 20 0 FAADRP O=C([C@@H]1C[C@H](N[C@H]2CCS(=O)(=O)C23C[NH2+]C3)C[NH2+]1)N1CCSC1 ZINC001246149288 793967140 /nfs/dbraw/zinc/96/71/40/793967140.db2.gz UFTQAPMEAALSSW-SRVKXCTJSA-N 2 0 360.505 -1.632 20 0 FAADRP O=C([C@@H]1C[C@@H](N[C@H]2CCS(=O)(=O)C23C[NH2+]C3)C[NH2+]1)N1CCSC1 ZINC001246149291 793966716 /nfs/dbraw/zinc/96/67/16/793966716.db2.gz UFTQAPMEAALSSW-WOPDTQHZSA-N 2 0 360.505 -1.632 20 0 FAADRP [NH3+]CCOCCOCCOCCOCC[NH2+][C@H]1CCNC2(C[NH2+]C2)C1 ZINC001246215810 793966795 /nfs/dbraw/zinc/96/67/95/793966795.db2.gz KFIHHSYZLNZYMU-INIZCTEOSA-N 3 0 360.499 -1.305 20 0 FAADRP [NH3+]CCOCCOCCOCCOCC[NH2+][C@@H]1CCNC2(C[NH2+]C2)C1 ZINC001246215811 793966956 /nfs/dbraw/zinc/96/69/56/793966956.db2.gz KFIHHSYZLNZYMU-MRXNPFEDSA-N 3 0 360.499 -1.305 20 0 FAADRP COC(=O)[C@@H]1C[C@@H]([NH2+]CCOCCOCCOCCOCC[NH3+])CN1 ZINC001246218057 793966994 /nfs/dbraw/zinc/96/69/94/793966994.db2.gz ZJQGBQHMMBRBRN-CABCVRRESA-N 2 0 363.455 -1.495 20 0 FAADRP COC(=O)[C@@H]1C[C@H]([NH2+]CCOCCOCCOCCOCC[NH3+])CN1 ZINC001246218058 793966902 /nfs/dbraw/zinc/96/69/02/793966902.db2.gz ZJQGBQHMMBRBRN-GJZGRUSLSA-N 2 0 363.455 -1.495 20 0 FAADRP COC(=O)[C@H]1C[C@@H]([NH2+]CCOCCOCCOCCOCC[NH3+])CN1 ZINC001246218059 793967029 /nfs/dbraw/zinc/96/70/29/793967029.db2.gz ZJQGBQHMMBRBRN-HUUCEWRRSA-N 2 0 363.455 -1.495 20 0 FAADRP COC(=O)[C@H]1C[C@H]([NH2+]CCOCCOCCOCCOCC[NH3+])CN1 ZINC001246218060 793967349 /nfs/dbraw/zinc/96/73/49/793967349.db2.gz ZJQGBQHMMBRBRN-LSDHHAIUSA-N 2 0 363.455 -1.495 20 0 FAADRP [NH3+]CCOCCOCCOCCOCCOCC[NH2+][C@@H]1CNC(=O)C1 ZINC001246275032 793967153 /nfs/dbraw/zinc/96/71/53/793967153.db2.gz OUGWNFKRVDBBKH-HNNXBMFYSA-N 2 0 363.455 -1.494 20 0 FAADRP [NH3+]CCOCCOCCOCCOCCOCC[NH2+][C@H]1CNC(=O)C1 ZINC001246275040 793967393 /nfs/dbraw/zinc/96/73/93/793967393.db2.gz OUGWNFKRVDBBKH-OAHLLOKOSA-N 2 0 363.455 -1.494 20 0 FAADRP Cc1cn(CC(=O)NCC[NH2+][C@@H]2CCNC3(C[NH2+]C3)C2)c(=O)[nH]c1=O ZINC001246302603 793968073 /nfs/dbraw/zinc/96/80/73/793968073.db2.gz DPIJCOGCOPAENF-GFCCVEGCSA-N 2 0 350.423 -1.943 20 0 FAADRP Cc1cn(CC(=O)NCC[NH2+][C@H]2CCNC3(C[NH2+]C3)C2)c(=O)[nH]c1=O ZINC001246302617 793967738 /nfs/dbraw/zinc/96/77/38/793967738.db2.gz DPIJCOGCOPAENF-LBPRGKRZSA-N 2 0 350.423 -1.943 20 0 FAADRP NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)C[NH2+][C@@H]1CCNC2(C[NH2+]C2)C1 ZINC001246487916 793967779 /nfs/dbraw/zinc/96/77/79/793967779.db2.gz SPKTXIBEXKNALL-NEPJUHHUSA-N 2 0 352.439 -2.738 20 0 FAADRP NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)C[NH2+][C@H]1CCNC2(C[NH2+]C2)C1 ZINC001246487919 793968025 /nfs/dbraw/zinc/96/80/25/793968025.db2.gz SPKTXIBEXKNALL-RYUDHWBXSA-N 2 0 352.439 -2.738 20 0 FAADRP O=C([C@@H]1C[C@H](N2CCOC[C@]3(C[NH2+]CCO3)C2)C[NH2+]1)N1CCSC1 ZINC001246608674 793968659 /nfs/dbraw/zinc/96/86/59/793968659.db2.gz YCUMDKRHTZDVLQ-DZKIICNBSA-N 2 0 356.492 -1.059 20 0 FAADRP O=C([C@@H]1C[C@@H](N2CCOC[C@@]3(C[NH2+]CCO3)C2)C[NH2+]1)N1CCSC1 ZINC001246608683 793968772 /nfs/dbraw/zinc/96/87/72/793968772.db2.gz YCUMDKRHTZDVLQ-IJEWVQPXSA-N 2 0 356.492 -1.059 20 0 FAADRP O=C([C@@H]1C[C@H](N2CCOC[C@@]3(C[NH2+]CCO3)C2)C[NH2+]1)N1CCSC1 ZINC001246608686 793968780 /nfs/dbraw/zinc/96/87/80/793968780.db2.gz YCUMDKRHTZDVLQ-OFQRWUPVSA-N 2 0 356.492 -1.059 20 0 FAADRP O=C([C@@H]1C[C@@H](N2CCOC[C@]3(C[NH2+]CCO3)C2)C[NH2+]1)N1CCSC1 ZINC001246608688 793969013 /nfs/dbraw/zinc/96/90/13/793969013.db2.gz YCUMDKRHTZDVLQ-YCPHGPKFSA-N 2 0 356.492 -1.059 20 0 FAADRP O=C([C@@H]1C[C@H](N2CCO[C@]3(C2)C[NH2+]CCOC3)C[NH2+]1)N1CCSC1 ZINC001246624133 793968763 /nfs/dbraw/zinc/96/87/63/793968763.db2.gz CBEHWMJNXPMNIE-DZKIICNBSA-N 2 0 356.492 -1.059 20 0 FAADRP O=C([C@@H]1C[C@@H](N2CCO[C@@]3(C2)C[NH2+]CCOC3)C[NH2+]1)N1CCSC1 ZINC001246624134 793968818 /nfs/dbraw/zinc/96/88/18/793968818.db2.gz CBEHWMJNXPMNIE-IJEWVQPXSA-N 2 0 356.492 -1.059 20 0 FAADRP O=C([C@@H]1C[C@H](N2CCO[C@@]3(C2)C[NH2+]CCOC3)C[NH2+]1)N1CCSC1 ZINC001246624135 793968971 /nfs/dbraw/zinc/96/89/71/793968971.db2.gz CBEHWMJNXPMNIE-OFQRWUPVSA-N 2 0 356.492 -1.059 20 0 FAADRP O=C([C@@H]1C[C@@H](N2CCO[C@]3(C2)C[NH2+]CCOC3)C[NH2+]1)N1CCSC1 ZINC001246624136 793968622 /nfs/dbraw/zinc/96/86/22/793968622.db2.gz CBEHWMJNXPMNIE-YCPHGPKFSA-N 2 0 356.492 -1.059 20 0 FAADRP O=C([C@@H]1C[C@@H](N2CC(=O)NC3(CC[NH2+]CC3)C2)C[NH2+]1)N1CCSC1 ZINC001246627567 793968458 /nfs/dbraw/zinc/96/84/58/793968458.db2.gz NJCPKJJUBLKJIN-OLZOCXBDSA-N 2 0 353.492 -1.196 20 0 FAADRP O=C([C@@H]1C[C@H](N2CC(=O)NC3(CC[NH2+]CC3)C2)C[NH2+]1)N1CCSC1 ZINC001246627568 793969049 /nfs/dbraw/zinc/96/90/49/793969049.db2.gz NJCPKJJUBLKJIN-STQMWFEESA-N 2 0 353.492 -1.196 20 0 FAADRP O=C([C@@H]1C[C@H](N2CC3(C[NH2+]C3)[C@@]3(CCNC3=O)C2)C[NH2+]1)N1CCSC1 ZINC001246627605 793968892 /nfs/dbraw/zinc/96/88/92/793968892.db2.gz OCHZGMWMXUFPDM-DCGLDWPTSA-N 2 0 365.503 -1.339 20 0 FAADRP O=C([C@@H]1C[C@H](N2CC3(C[NH2+]C3)[C@]3(CCNC3=O)C2)C[NH2+]1)N1CCSC1 ZINC001246627606 793968789 /nfs/dbraw/zinc/96/87/89/793968789.db2.gz OCHZGMWMXUFPDM-GDZNZVCISA-N 2 0 365.503 -1.339 20 0 FAADRP O=C([C@@H]1C[C@@H](N2CC3(C[NH2+]C3)[C@@]3(CCNC3=O)C2)C[NH2+]1)N1CCSC1 ZINC001246627607 793968702 /nfs/dbraw/zinc/96/87/02/793968702.db2.gz OCHZGMWMXUFPDM-IGCXYCKISA-N 2 0 365.503 -1.339 20 0 FAADRP O=C([C@@H]1C[C@@H](N2CC3(C[NH2+]C3)[C@]3(CCNC3=O)C2)C[NH2+]1)N1CCSC1 ZINC001246627608 793968800 /nfs/dbraw/zinc/96/88/00/793968800.db2.gz OCHZGMWMXUFPDM-IIYDPXPESA-N 2 0 365.503 -1.339 20 0 FAADRP CS(=O)(=O)N(Cc1cnc2n1CC[NH2+]CC2)[C@@H]1CCNC2(C[NH2+]C2)C1 ZINC001246735765 793969379 /nfs/dbraw/zinc/96/93/79/793969379.db2.gz LCIOXTRPLFOPJE-CYBMUJFWSA-N 2 0 368.507 -1.116 20 0 FAADRP CS(=O)(=O)N(Cc1cnc2n1CC[NH2+]CC2)[C@H]1CCNC2(C[NH2+]C2)C1 ZINC001246735774 793969870 /nfs/dbraw/zinc/96/98/70/793969870.db2.gz LCIOXTRPLFOPJE-ZDUSSCGKSA-N 2 0 368.507 -1.116 20 0 FAADRP CCN1C[C@@]23C[N@@H+]([C@H]4CCNC5(C[NH2+]C5)C4)C[C@@H](C[C@@H]2S1(=O)=O)O3 ZINC001246749435 793969932 /nfs/dbraw/zinc/96/99/32/793969932.db2.gz BTMSCCUXZPVNFA-FQLMCAECSA-N 2 0 356.492 -1.042 20 0 FAADRP CCN1C[C@@]23C[N@@H+]([C@@H]4CCNC5(C[NH2+]C5)C4)C[C@@H](C[C@@H]2S1(=O)=O)O3 ZINC001246749437 793969835 /nfs/dbraw/zinc/96/98/35/793969835.db2.gz BTMSCCUXZPVNFA-NYTXWWLZSA-N 2 0 356.492 -1.042 20 0 FAADRP COC(=O)[C@@H]1C[C@H](N2CC[NH2+]CCNCC[NH2+]CC2)C[C@@H]1C(=O)OC ZINC001246821125 793969419 /nfs/dbraw/zinc/96/94/19/793969419.db2.gz LZZKDAHNFGIISU-QDMKHBRRSA-N 2 0 356.467 -1.188 20 0 FAADRP COC(=O)[C@@H]1C[C@@H](N2CC[NH2+]CCNCC[NH2+]CC2)C[C@@H]1C(=O)OC ZINC001246821135 793969427 /nfs/dbraw/zinc/96/94/27/793969427.db2.gz LZZKDAHNFGIISU-QKDCVEJESA-N 2 0 356.467 -1.188 20 0 FAADRP O=C([C@@H]1C[C@@H](N2CC[NH2+]CCNCC[NH2+]CC2)C[NH2+]1)N1CCSC1 ZINC001246823242 793969562 /nfs/dbraw/zinc/96/95/62/793969562.db2.gz UVEYFLSLLBDZNI-CABCVRRESA-N 3 0 356.540 -1.666 20 0 FAADRP O=C([C@@H]1C[C@H](N2CC[NH2+]CCNCC[NH2+]CC2)C[NH2+]1)N1CCSC1 ZINC001246823255 793969404 /nfs/dbraw/zinc/96/94/04/793969404.db2.gz UVEYFLSLLBDZNI-GJZGRUSLSA-N 3 0 356.540 -1.666 20 0 FAADRP [NH3+]CCCNC(=O)CN(CCC[NH3+])[C@@H]1C[NH2+][C@H](C(=O)N2CCSC2)C1 ZINC001246927257 793970775 /nfs/dbraw/zinc/97/07/75/793970775.db2.gz XHVGAMWDFSEMLS-KBPBESRZSA-N 3 0 372.539 -1.634 20 0 FAADRP [NH3+]CCCNC(=O)CN(CCC[NH3+])[C@H]1C[NH2+][C@H](C(=O)N2CCSC2)C1 ZINC001246927258 793970860 /nfs/dbraw/zinc/97/08/60/793970860.db2.gz XHVGAMWDFSEMLS-KGLIPLIRSA-N 3 0 372.539 -1.634 20 0 FAADRP C[NH+](C)C[C@@H]1CN(C(=O)NC[C@H]2CC(C(N)=O)=NO2)C[C@H]1C[NH+](C)C ZINC001248643225 793973592 /nfs/dbraw/zinc/97/35/92/793973592.db2.gz SOBKIHYXTPYLPT-JHJVBQTASA-N 2 0 354.455 -1.003 20 0 FAADRP C[NH+](C)C[C@@H]1CN(C(=O)NC[C@@H]2CC(C(N)=O)=NO2)C[C@H]1C[NH+](C)C ZINC001248643226 793973465 /nfs/dbraw/zinc/97/34/65/793973465.db2.gz SOBKIHYXTPYLPT-UPJWGTAASA-N 2 0 354.455 -1.003 20 0 FAADRP COC(=O)[C@@H](O)C[NH+]1CCC2(CC1)C(=O)N(CC[NH+](C)C)CCN2C ZINC001252417805 793983485 /nfs/dbraw/zinc/98/34/85/793983485.db2.gz NGFFLWQJDVFNKY-AWEZNQCLSA-N 2 0 356.467 -1.310 20 0 FAADRP COC(=O)[C@H](O)C[NH+]1CCC2(CC1)C(=O)N(CC[NH+](C)C)CCN2C ZINC001252417806 793983897 /nfs/dbraw/zinc/98/38/97/793983897.db2.gz NGFFLWQJDVFNKY-CQSZACIVSA-N 2 0 356.467 -1.310 20 0 FAADRP [NH3+]CCOCCOCCOCCOCC[NH2+][C@H]1CCS(=O)(=O)C1 ZINC001254322973 793996963 /nfs/dbraw/zinc/99/69/63/793996963.db2.gz YFAJMNXWTUQYQE-AWEZNQCLSA-N 2 0 354.469 -1.212 20 0 FAADRP [NH3+]CCOCCOCCOCCOCC[NH2+][C@@H]1CCS(=O)(=O)C1 ZINC001254322974 793996600 /nfs/dbraw/zinc/99/66/00/793996600.db2.gz YFAJMNXWTUQYQE-CQSZACIVSA-N 2 0 354.469 -1.212 20 0 FAADRP NC(=O)CNC(=O)CNC(=O)C[NH2+]C1CCC([NH+]2CCOCC2)CC1 ZINC001256688246 794011314 /nfs/dbraw/zinc/01/13/14/794011314.db2.gz VEPDFVGXZACNRV-UHFFFAOYSA-N 2 0 355.439 -2.063 20 0 FAADRP COC(=O)CCS(=O)(=O)CC[C@@H](C)[NH2+]CCN(CC[NH3+])N(O)N=O ZINC001257925166 794017810 /nfs/dbraw/zinc/01/78/10/794017810.db2.gz HCTLHRHPVYZFRO-LLVKDONJSA-N 2 0 369.444 -1.119 20 0 FAADRP COC(=O)CCS(=O)(=O)CC[C@H](C)[NH2+]CCN(CC[NH3+])N(O)N=O ZINC001257925173 794017664 /nfs/dbraw/zinc/01/76/64/794017664.db2.gz HCTLHRHPVYZFRO-NSHDSACASA-N 2 0 369.444 -1.119 20 0 FAADRP C[C@H]([NH3+])C[C@H](C)NC(=O)C(=O)N[C@H]1CC[N@H+](CCN2CCOCC2)C1 ZINC001261488284 794043835 /nfs/dbraw/zinc/04/38/35/794043835.db2.gz NJMQNEVHQVORIQ-KKUMJFAQSA-N 2 0 355.483 -1.249 20 0 FAADRP C[C@H](C[C@H](C)[NH3+])NC(=O)C(=O)N[C@@H]1CC[N@H+](CCN2CCOCC2)C1 ZINC001261488285 794043664 /nfs/dbraw/zinc/04/36/64/794043664.db2.gz NJMQNEVHQVORIQ-RRFJBIMHSA-N 2 0 355.483 -1.249 20 0 FAADRP C[C@H]([NH3+])C[C@H](C)NC(=O)C(=O)N[C@@H]1CC[N@H+](CCN2CCOCC2)C1 ZINC001261488286 794043809 /nfs/dbraw/zinc/04/38/09/794043809.db2.gz NJMQNEVHQVORIQ-SOUVJXGZSA-N 2 0 355.483 -1.249 20 0 FAADRP C[C@H](C[C@H](C)[NH3+])NC(=O)C(=O)N[C@H]1CC[N@H+](CCN2CCOCC2)C1 ZINC001261488287 794043772 /nfs/dbraw/zinc/04/37/72/794043772.db2.gz NJMQNEVHQVORIQ-ZNMIVQPWSA-N 2 0 355.483 -1.249 20 0 FAADRP C[NH+](C)CCn1ccc(NC(=O)C(=O)N2CC[N@@H+]3C[C@H](O)C[C@H]3C2)n1 ZINC001261548128 794048226 /nfs/dbraw/zinc/04/82/26/794048226.db2.gz FHSUZJYCOMUXAU-QWHCGFSZSA-N 2 0 350.423 -1.339 20 0 FAADRP CN(CCC[NH3+])C(=O)C(=O)Nc1cnn(CC(=O)NCC[NH+](C)C)c1 ZINC001261630565 794051446 /nfs/dbraw/zinc/05/14/46/794051446.db2.gz PXKUUYYTZGWOLH-UHFFFAOYSA-N 2 0 353.427 -1.693 20 0 FAADRP [NH3+]CCCOCCNC(=O)C(=O)NC1CC[NH+]([C@@H]2CCC[C@@H]2O)CC1 ZINC001261819934 794061515 /nfs/dbraw/zinc/06/15/15/794061515.db2.gz MXVYAWGJIVUEMT-CABCVRRESA-N 2 0 356.467 -1.038 20 0 FAADRP [NH3+]CCCOCCNC(=O)C(=O)NC1CC[NH+]([C@H]2CCC[C@@H]2O)CC1 ZINC001261819935 794061679 /nfs/dbraw/zinc/06/16/79/794061679.db2.gz MXVYAWGJIVUEMT-GJZGRUSLSA-N 2 0 356.467 -1.038 20 0 FAADRP [NH3+]CCCOCCNC(=O)C(=O)NC1CC[NH+]([C@@H]2CCC[C@H]2O)CC1 ZINC001261819936 794061333 /nfs/dbraw/zinc/06/13/33/794061333.db2.gz MXVYAWGJIVUEMT-HUUCEWRRSA-N 2 0 356.467 -1.038 20 0 FAADRP [NH3+]CCCOCCNC(=O)C(=O)NC1CC[NH+]([C@H]2CCC[C@H]2O)CC1 ZINC001261819937 794061524 /nfs/dbraw/zinc/06/15/24/794061524.db2.gz MXVYAWGJIVUEMT-LSDHHAIUSA-N 2 0 356.467 -1.038 20 0 FAADRP C[C@@H]1[NH2+]CC[C@H]1NC(=O)C(=O)N[C@@H]1CC[N@H+](CCN2CCOCC2)C1 ZINC001261820159 794061640 /nfs/dbraw/zinc/06/16/40/794061640.db2.gz RZDFRKFILJMRDD-RRFJBIMHSA-N 2 0 353.467 -1.624 20 0 FAADRP C[C@@H]1[NH2+]CC[C@H]1NC(=O)C(=O)N[C@H]1CC[N@H+](CCN2CCOCC2)C1 ZINC001261820160 794061662 /nfs/dbraw/zinc/06/16/62/794061662.db2.gz RZDFRKFILJMRDD-SOUVJXGZSA-N 2 0 353.467 -1.624 20 0 FAADRP C[N@@H+]1CCN(CCNC(=O)C(=O)NCC2([NH3+])CCOCC2)CC1(C)C ZINC001261820204 794061547 /nfs/dbraw/zinc/06/15/47/794061547.db2.gz SYRBQCVDSDMLQJ-UHFFFAOYSA-N 2 0 355.483 -1.247 20 0 FAADRP Cn1nnc(CNC(=O)C(=O)N2C[C@@H](C[NH+](C)C)[C@H](C[NH+](C)C)C2)n1 ZINC001261954790 794067215 /nfs/dbraw/zinc/06/72/15/794067215.db2.gz LDWPXYAXFJFKAA-VXGBXAGGSA-N 2 0 352.443 -1.976 20 0 FAADRP Cn1cnc(CNC(=O)C(=O)N2C[C@@H](C[NH+](C)C)[C@H](C[NH+](C)C)C2)n1 ZINC001261956249 794067426 /nfs/dbraw/zinc/06/74/26/794067426.db2.gz TUXKCTQKKHQUJL-CHWSQXEVSA-N 2 0 351.455 -1.371 20 0 FAADRP CN(C)C(=O)CC[NH+]1CCC(NC(=O)C(=O)N2CCC[C@@H]2C[NH3+])CC1 ZINC001262058678 794067992 /nfs/dbraw/zinc/06/79/92/794067992.db2.gz DWVJEUNVJKAJHH-CQSZACIVSA-N 2 0 353.467 -1.005 20 0 FAADRP [NH3+]C1CCN(CCNC(=O)C(=O)NCCCC[NH+]2CCOCC2)CC1 ZINC001262543752 794075476 /nfs/dbraw/zinc/07/54/76/794075476.db2.gz KGNIXRKTLMRMGL-UHFFFAOYSA-N 2 0 355.483 -1.246 20 0 FAADRP COCCC[NH+]1CCC(NC(=O)C(=O)N2CCNCC[NH2+]CC2)CC1 ZINC001262544251 794075881 /nfs/dbraw/zinc/07/58/81/794075881.db2.gz XEROPOWTOJWKQF-UHFFFAOYSA-N 2 0 355.483 -1.375 20 0 FAADRP C[N@@H+]1CCC[C@@H](NC(=O)C(=O)NC[C@H]2CC3(CC[NH2+]CC3)C(=O)O2)C1 ZINC001262550742 794075634 /nfs/dbraw/zinc/07/56/34/794075634.db2.gz CFOAJDVTGIOWMC-CHWSQXEVSA-N 2 0 352.435 -1.002 20 0 FAADRP C[N@@H+]1CCC[C@@H](NC(=O)C(=O)NC[C@@H]2CC3(CC[NH2+]CC3)C(=O)O2)C1 ZINC001262550743 794075759 /nfs/dbraw/zinc/07/57/59/794075759.db2.gz CFOAJDVTGIOWMC-OLZOCXBDSA-N 2 0 352.435 -1.002 20 0 FAADRP C[N@@H+]1CCC[C@H](NC(=O)C(=O)NC[C@H]2CC3(CC[NH2+]CC3)C(=O)O2)C1 ZINC001262550744 794075953 /nfs/dbraw/zinc/07/59/53/794075953.db2.gz CFOAJDVTGIOWMC-QWHCGFSZSA-N 2 0 352.435 -1.002 20 0 FAADRP C[N@@H+]1CCC[C@H](NC(=O)C(=O)NC[C@@H]2CC3(CC[NH2+]CC3)C(=O)O2)C1 ZINC001262550745 794075605 /nfs/dbraw/zinc/07/56/05/794075605.db2.gz CFOAJDVTGIOWMC-STQMWFEESA-N 2 0 352.435 -1.002 20 0 FAADRP O=C(C[NH+]1CCC(CO)CC1)N1CCN(C(=O)N2CC[NH2+]CC2)CC1 ZINC001263165255 794077701 /nfs/dbraw/zinc/07/77/01/794077701.db2.gz WORVUWSZFAVGLZ-UHFFFAOYSA-N 2 0 353.467 -1.140 20 0 FAADRP C[NH+](C)C[C@@H]1CN(C(=O)C[C@H]2CNCCS2(=O)=O)C[C@H]1C[NH+](C)C ZINC001263171329 794077494 /nfs/dbraw/zinc/07/74/94/794077494.db2.gz OEIAVZSEBDPETF-KFWWJZLASA-N 2 0 360.524 -1.039 20 0 FAADRP C[NH+](C)C[C@@H]1CN(C(=O)C[C@@H]2CNCCS2(=O)=O)C[C@H]1C[NH+](C)C ZINC001263171330 794077395 /nfs/dbraw/zinc/07/73/95/794077395.db2.gz OEIAVZSEBDPETF-RBSFLKMASA-N 2 0 360.524 -1.039 20 0 FAADRP CCO[C@@H]1CN(C(=O)[C@H](CC)[NH+](C)C)C[C@H]1C[NH2+]CC(=O)NC(N)=O ZINC001264533780 794086313 /nfs/dbraw/zinc/08/63/13/794086313.db2.gz USZAGUIQCVJXQW-FRRDWIJNSA-N 2 0 357.455 -1.025 20 0 FAADRP C[C@@H]1[C@H](C(=O)NC[C@@H](O)C[NH2+]CCCN2C(=O)CNC2=O)CC[N@@H+]1C ZINC001268308371 789674748 /nfs/dbraw/zinc/67/47/48/789674748.db2.gz OVSZNTVCPCHMEU-FRRDWIJNSA-N 2 0 355.439 -1.665 20 0 FAADRP C[C@@H]1[C@H](C(=O)NC[C@H](O)C[NH2+]CCCN2C(=O)CNC2=O)CC[N@@H+]1C ZINC001268308373 789674964 /nfs/dbraw/zinc/67/49/64/789674964.db2.gz OVSZNTVCPCHMEU-JHJVBQTASA-N 2 0 355.439 -1.665 20 0 FAADRP CC[C@@H]1[C@@H](C(=O)NC[C@H](O)C[NH2+]CCN2C(=O)CCC2=O)CC[N@@H+]1C ZINC001268308511 789674943 /nfs/dbraw/zinc/67/49/43/789674943.db2.gz PMYQZAFMEYGFCG-HZSPNIEDSA-N 2 0 354.451 -1.068 20 0 FAADRP CC[C@@H]1[C@@H](C(=O)NC[C@@H](O)C[NH2+]CCN2C(=O)CCC2=O)CC[N@@H+]1C ZINC001268308512 789674634 /nfs/dbraw/zinc/67/46/34/789674634.db2.gz PMYQZAFMEYGFCG-MELADBBJSA-N 2 0 354.451 -1.068 20 0 FAADRP C[C@@H]1[C@H](C(=O)NC[C@]2(O)CC[NH+](CCN3CCNC3=O)C2)CC[N@@H+]1C ZINC001271145303 790344369 /nfs/dbraw/zinc/34/43/69/790344369.db2.gz LTIWYARMQYGRSL-CKEIUWERSA-N 2 0 353.467 -1.095 20 0 FAADRP C[C@@H]1[C@H](C(=O)NC[C@@]2(O)CC[NH+](CCN3CCNC3=O)C2)CC[N@@H+]1C ZINC001271145305 790343559 /nfs/dbraw/zinc/34/35/59/790343559.db2.gz LTIWYARMQYGRSL-CPUCHLNUSA-N 2 0 353.467 -1.095 20 0 FAADRP CCNC(=O)NC(=O)C[NH2+]CCN(CCO)C(=O)[C@@H]1CC[N@H+](C)[C@@H]1C ZINC001272168175 790396728 /nfs/dbraw/zinc/39/67/28/790396728.db2.gz GHRLGHFRYYBJBJ-CHWSQXEVSA-N 2 0 357.455 -1.417 20 0 FAADRP CC[C@@H]1[C@@H](C(=O)N(CCO)CC[NH2+]CC(=O)NC(=O)NC)CC[N@@H+]1C ZINC001272169216 790396197 /nfs/dbraw/zinc/39/61/97/790396197.db2.gz QNQBLBSHTRLOTO-QWHCGFSZSA-N 2 0 357.455 -1.417 20 0 FAADRP C[NH+](C)CCN1C(=O)COCC12CN(C(=O)C1(O)CC[NH+](C)CC1)C2 ZINC001272836156 790516291 /nfs/dbraw/zinc/51/62/91/790516291.db2.gz JIIPUGLQMZRXJT-UHFFFAOYSA-N 2 0 354.451 -1.556 20 0 FAADRP C[NH+](C)CCN1CC2(CN(C(=O)C3(O)CC[NH+](C)CC3)C2)OCC1=O ZINC001272836941 790516547 /nfs/dbraw/zinc/51/65/47/790516547.db2.gz QCKMFWGNNIQZJO-UHFFFAOYSA-N 2 0 354.451 -1.556 20 0 FAADRP CN1CC[N@H+](C)C[C@H]1C(=O)N1CC2(C1)CN(CC[NH+](C)C)C(=O)CO2 ZINC001273128242 790547383 /nfs/dbraw/zinc/54/73/83/790547383.db2.gz KPYTZGMHVJHFND-AWEZNQCLSA-N 2 0 353.467 -1.766 20 0 FAADRP CN1CC[N@H+](C)C[C@@H]1C(=O)N1CC2(C1)CN(CC[NH+](C)C)C(=O)CO2 ZINC001273128243 790546925 /nfs/dbraw/zinc/54/69/25/790546925.db2.gz KPYTZGMHVJHFND-CQSZACIVSA-N 2 0 353.467 -1.766 20 0 FAADRP CN1CC[N@H+](C)C[C@H]1C(=O)N1CC2(C1)COCC(=O)N2CC[NH+](C)C ZINC001273129035 790547210 /nfs/dbraw/zinc/54/72/10/790547210.db2.gz PZVLWUVREXCWGU-AWEZNQCLSA-N 2 0 353.467 -1.766 20 0 FAADRP CN1CC[N@H+](C)C[C@@H]1C(=O)N1CC2(C1)COCC(=O)N2CC[NH+](C)C ZINC001273129037 790546982 /nfs/dbraw/zinc/54/69/82/790546982.db2.gz PZVLWUVREXCWGU-CQSZACIVSA-N 2 0 353.467 -1.766 20 0 FAADRP CC[C@@H]1[C@@H](C(=O)N[C@H](C)C[NH2+]CC(=O)N2CCNC(=O)C2)CC[N@@H+]1C ZINC001274760864 792523406 /nfs/dbraw/zinc/52/34/06/792523406.db2.gz UQLGGLDQUWFAHU-HZSPNIEDSA-N 2 0 353.467 -1.231 20 0 FAADRP C[NH+]1CCN(CCCN2CC[C@@]3(CC[N@H+](C[C@H](O)CO)C3)C2=O)CC1 ZINC001277720317 793941147 /nfs/dbraw/zinc/94/11/47/793941147.db2.gz WOPPBSSBVXVKGY-FUHWJXTLSA-N 2 0 354.495 -1.099 20 0 FAADRP C[NH+]1CCN(CCCN2CC[C@]3(CC[N@H+](C[C@H](O)CO)C3)C2=O)CC1 ZINC001277720318 793941215 /nfs/dbraw/zinc/94/12/15/793941215.db2.gz WOPPBSSBVXVKGY-WMZOPIPTSA-N 2 0 354.495 -1.099 20 0 FAADRP C[C@@H]1[C@H](C(=O)NC[C@@H](CO)[NH2+]CCCN2C(=O)CNC2=O)CC[N@@H+]1C ZINC001278086410 793953128 /nfs/dbraw/zinc/95/31/28/793953128.db2.gz XFLFLPLJOZUHHA-FRRDWIJNSA-N 2 0 355.439 -1.665 20 0 FAADRP C[C@@H]1[C@H](C(=O)NC[C@H](CO)[NH2+]CCCN2C(=O)CNC2=O)CC[N@@H+]1C ZINC001278086412 793953602 /nfs/dbraw/zinc/95/36/02/793953602.db2.gz XFLFLPLJOZUHHA-JHJVBQTASA-N 2 0 355.439 -1.665 20 0 FAADRP CCNC(=O)NC(=O)C[NH2+]C[C@H](O)CN(C)C(=O)[C@@H]1CC[N@H+](C)[C@@H]1C ZINC001278754963 793993405 /nfs/dbraw/zinc/99/34/05/793993405.db2.gz CMYOMYBEMUBPTC-FRRDWIJNSA-N 2 0 357.455 -1.419 20 0 FAADRP CCNC(=O)NC(=O)C[NH2+]C[C@@H](O)CN(C)C(=O)[C@@H]1CC[N@H+](C)[C@@H]1C ZINC001278754971 793993105 /nfs/dbraw/zinc/99/31/05/793993105.db2.gz CMYOMYBEMUBPTC-JHJVBQTASA-N 2 0 357.455 -1.419 20 0 FAADRP CC[C@@H]1[C@@H](C(=O)N(C)C[C@H](O)C[NH2+]CC(=O)NC(=O)NC)CC[N@@H+]1C ZINC001278761876 793993963 /nfs/dbraw/zinc/99/39/63/793993963.db2.gz KBWQKBXIACTHBE-FRRDWIJNSA-N 2 0 357.455 -1.419 20 0 FAADRP CC[C@@H]1[C@@H](C(=O)N(C)C[C@@H](O)C[NH2+]CC(=O)NC(=O)NC)CC[N@@H+]1C ZINC001278761880 793993834 /nfs/dbraw/zinc/99/38/34/793993834.db2.gz KBWQKBXIACTHBE-RWMBFGLXSA-N 2 0 357.455 -1.419 20 0 FAADRP Cn1cc(CN2C[C@@H]3CN(CC[NH+](C)C)C[C@H](C2)O3)c(=O)n(C)c1=O ZINC001279407408 794100537 /nfs/dbraw/zinc/10/05/37/794100537.db2.gz BNQRJUXCXPSWKW-GASCZTMLSA-N 2 0 351.451 -1.469 20 0 FAADRP Cn1cc(C[N@H+]2C[C@@H]3[C@H](C2)OCCN3CC[NH+](C)C)c(=O)n(C)c1=O ZINC001279407621 794101017 /nfs/dbraw/zinc/10/10/17/794101017.db2.gz HXVNOFSHYJXFEM-CABCVRRESA-N 2 0 351.451 -1.469 20 0 FAADRP Cn1cc(C[N@@H+]2C[C@@H]3OCCN(CC[NH+](C)C)[C@H]3C2)c(=O)n(C)c1=O ZINC001279407623 794101047 /nfs/dbraw/zinc/10/10/47/794101047.db2.gz HXVNOFSHYJXFEM-GJZGRUSLSA-N 2 0 351.451 -1.469 20 0 FAADRP CC[C@@H]1[C@@H](C(=O)N(CCO)CC[NH2+][C@@H]2CCC(=O)NC2=O)CC[N@@H+]1C ZINC001279717233 794102977 /nfs/dbraw/zinc/10/29/77/794102977.db2.gz LANMQNRBKQUORZ-BFHYXJOUSA-N 2 0 354.451 -1.068 20 0 FAADRP CC[C@@H]1[C@@H](C(=O)N(CCO)CC[NH2+][C@H]2CCC(=O)NC2=O)CC[N@@H+]1C ZINC001279717234 794103149 /nfs/dbraw/zinc/10/31/49/794103149.db2.gz LANMQNRBKQUORZ-MELADBBJSA-N 2 0 354.451 -1.068 20 0 FAADRP CNC(=O)NC(=O)C[NH2+]C[C@H]1CN(C(=O)[C@@H]2CC[N@H+](C)[C@@H]2C)CCO1 ZINC001280582041 794125672 /nfs/dbraw/zinc/12/56/72/794125672.db2.gz HADDZNGELSSYNR-FRRDWIJNSA-N 2 0 355.439 -1.401 20 0 FAADRP CNC(=O)NC(=O)C[NH2+]C[C@@H]1CN(C(=O)[C@@H]2CC[N@H+](C)[C@@H]2C)CCO1 ZINC001280582042 794125813 /nfs/dbraw/zinc/12/58/13/794125813.db2.gz HADDZNGELSSYNR-JHJVBQTASA-N 2 0 355.439 -1.401 20 0 FAADRP C[C@@H]1[C@H](C(=O)N2CCC(O)(C[NH2+]CC(=O)NC(N)=O)CC2)CC[N@@H+]1C ZINC001281614050 794134657 /nfs/dbraw/zinc/13/46/57/794134657.db2.gz SUBQCWCOJFWEAW-VXGBXAGGSA-N 2 0 355.439 -1.535 20 0 FAADRP C[NH+](C)CCOCC(=O)N1C[C@@H](O)[C@H](NC(=O)C2([NH+](C)C)CCC2)C1 ZINC001281684277 794157158 /nfs/dbraw/zinc/15/71/58/794157158.db2.gz JZPYXLHDXCFPIU-ZIAGYGMSSA-N 2 0 356.467 -1.263 20 0 FAADRP C[NH+](C)CCC(=O)N[C@@H]1CN(C(=O)COC2CC[NH+](C)CC2)C[C@H]1O ZINC001281711225 794167727 /nfs/dbraw/zinc/16/77/27/794167727.db2.gz IOFSDDWDNOTCSN-HUUCEWRRSA-N 2 0 356.467 -1.263 20 0 FAADRP C[C@@H](C(=O)NC(N)=O)[N@H+](C)CCOCCNC(=O)[C@@H]1CC[NH+](C)[C@@H]1C ZINC001283377946 794240813 /nfs/dbraw/zinc/24/08/13/794240813.db2.gz QYSSYGHDQKDECL-FRRDWIJNSA-N 2 0 357.455 -1.025 20 0 FAADRP C[C@H](C(=O)NC(N)=O)[N@H+](C)CCOCCNC(=O)[C@@H]1CC[NH+](C)[C@@H]1C ZINC001283377957 794240943 /nfs/dbraw/zinc/24/09/43/794240943.db2.gz QYSSYGHDQKDECL-JHJVBQTASA-N 2 0 357.455 -1.025 20 0 FAADRP C[C@@H]1[C@H](C(=O)NC[C@@H](CO)[NH2+]CC(=O)NC(=O)NC2CC2)CC[N@@H+]1C ZINC001283759683 794241667 /nfs/dbraw/zinc/24/16/67/794241667.db2.gz JLKSYWGTHJTXTF-KGYLQXTDSA-N 2 0 355.439 -1.619 20 0 FAADRP C[C@@H]1[C@H](C(=O)NC[C@H](CO)[NH2+]CC(=O)NC(=O)NC2CC2)CC[N@@H+]1C ZINC001283759684 794241787 /nfs/dbraw/zinc/24/17/87/794241787.db2.gz JLKSYWGTHJTXTF-RAIGVLPGSA-N 2 0 355.439 -1.619 20 0 FAADRP C[C@@H]1[C@H](C(=O)N(C)C[C@@H](O)C[NH2+]CC(=O)N2CCOCC2)CC[N@@H+]1C ZINC001284418429 794244936 /nfs/dbraw/zinc/24/49/36/794244936.db2.gz SZYZQZBKQIASTB-QLFBSQMISA-N 2 0 356.467 -1.406 20 0 FAADRP C[C@@H]1[C@H](C(=O)N(C)C[C@H](O)C[NH2+]CC(=O)N2CCOCC2)CC[N@@H+]1C ZINC001284418430 794245349 /nfs/dbraw/zinc/24/53/49/794245349.db2.gz SZYZQZBKQIASTB-RBSFLKMASA-N 2 0 356.467 -1.406 20 0 FAADRP C[NH+](C)CCOCC(=O)N1C[C@@H](O)[C@H](NC(=O)C[N@H+](C)C2CCC2)C1 ZINC001289103973 794284978 /nfs/dbraw/zinc/28/49/78/794284978.db2.gz NFRKONNXCDGLQM-HUUCEWRRSA-N 2 0 356.467 -1.263 20 0 FAADRP C[NH+](C)CCOCC(=O)N1C[C@@H](O)[C@H](NC(=O)C2CC[NH+](C)CC2)C1 ZINC001289113181 794285416 /nfs/dbraw/zinc/28/54/16/794285416.db2.gz FLFNTUVIYYDPOP-HUUCEWRRSA-N 2 0 356.467 -1.406 20 0 FAADRP C[NH+](C)CCOCC(=O)N1C[C@@H](O)[C@H](NC(=O)[C@@H]2CCCC[N@@H+]2C)C1 ZINC001289160230 794293607 /nfs/dbraw/zinc/29/36/07/794293607.db2.gz ZSNNJBQMRXEJOW-QLFBSQMISA-N 2 0 356.467 -1.263 20 0 FAADRP CC(C)[C@H](C(=O)N[C@@H]1CN(C(=O)COCC[NH+](C)C)C[C@H]1O)[NH+](C)C ZINC001289182367 794296149 /nfs/dbraw/zinc/29/61/49/794296149.db2.gz WXNOJTGOEFHEFA-IIAWOOMASA-N 2 0 358.483 -1.161 20 0 FAADRP C[C@H](C[NH+]1CCOCC1)C(=O)N[C@@H]1CN(C(=O)CC[NH+](C)C)C[C@@H]1O ZINC001289627384 794325493 /nfs/dbraw/zinc/32/54/93/794325493.db2.gz QWBLSSNQCKLCGN-KFWWJZLASA-N 2 0 356.467 -1.406 20 0 FAADRP C[C@@H](C[NH+]1CCOCC1)C(=O)N[C@@H]1CN(C(=O)CC[NH+](C)C)C[C@@H]1O ZINC001289627385 794325701 /nfs/dbraw/zinc/32/57/01/794325701.db2.gz QWBLSSNQCKLCGN-ZNMIVQPWSA-N 2 0 356.467 -1.406 20 0 FAADRP CC(C)[C@@H](C(=O)N[C@@H]1CN(C(=O)COCC[NH+](C)C)C[C@@H]1O)[NH+](C)C ZINC001289651025 794332399 /nfs/dbraw/zinc/33/23/99/794332399.db2.gz WXNOJTGOEFHEFA-YCPHGPKFSA-N 2 0 358.483 -1.161 20 0 FAADRP NC(=O)N[C@@H](CO)C(=O)NCCC[NH+]1CCN(c2cc[nH+]cc2)CC1 ZINC001292313574 794370315 /nfs/dbraw/zinc/37/03/15/794370315.db2.gz DPCVZUJUJUGYIE-AWEZNQCLSA-N 2 0 350.423 -1.261 20 0 FAADRP NC(=O)N[C@H](CO)C(=O)NCCC[NH+]1CCN(c2cc[nH+]cc2)CC1 ZINC001292313576 794370276 /nfs/dbraw/zinc/37/02/76/794370276.db2.gz DPCVZUJUJUGYIE-CQSZACIVSA-N 2 0 350.423 -1.261 20 0 FAADRP Cn1cc(S(=O)(=O)N2C[C@@H](C[NH+](C)C)[C@H](C[NH+](C)C)C2)c(=O)[nH]c1=O ZINC001309759133 794418260 /nfs/dbraw/zinc/41/82/60/794418260.db2.gz YDPLBBATJRPBSO-VXGBXAGGSA-N 2 0 373.479 -1.154 20 0 FAADRP