smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name C[NH+]1CCN(c2ccc(CNc3ccc(C4CC4)c[nH+]3)cc2)CC1 ZINC001167434522 1082114066 /nfs/dbraw/zinc/11/40/66/1082114066.db2.gz NWEADKBAGQBAHZ-UHFFFAOYSA-N 2 2 322.456 3.323 20 10 DGCDLP C[C@@]1([NH3+])CCC[N@H+](Cc2c(O)ccc(Cl)c2Cl)CC1 ZINC001205288337 1084088732 /nfs/dbraw/zinc/08/87/32/1084088732.db2.gz IVQRLNLSUQENJE-CQSZACIVSA-N 2 2 303.233 3.402 20 10 DGCDLP C[C@@]1([NH3+])CCC[N@@H+](Cc2c(O)ccc(Cl)c2Cl)CC1 ZINC001205288337 1084088741 /nfs/dbraw/zinc/08/87/41/1084088741.db2.gz IVQRLNLSUQENJE-CQSZACIVSA-N 2 2 303.233 3.402 20 10 DGCDLP CCN(CC)c1ccc(C[N@H+](C)C2CC[NH+](C)CC2)c(OC)c1 ZINC001138387350 1091162592 /nfs/dbraw/zinc/16/25/92/1091162592.db2.gz CKXOJOSWCXEBTE-UHFFFAOYSA-N 2 2 319.493 3.067 20 10 DGCDLP CCN(CC)c1ccc(C[N@@H+](C)C2CC[NH+](C)CC2)c(OC)c1 ZINC001138387350 1091162596 /nfs/dbraw/zinc/16/25/96/1091162596.db2.gz CKXOJOSWCXEBTE-UHFFFAOYSA-N 2 2 319.493 3.067 20 10 DGCDLP CCN(CC)c1ccc(C[N@@H+]2C[C@@H](C)CC[C@@H]2C[NH3+])c(OC)c1 ZINC001205817753 1091364100 /nfs/dbraw/zinc/36/41/00/1091364100.db2.gz QVTJELFZFYCFNG-MAUKXSAKSA-N 2 2 319.493 3.101 20 10 DGCDLP CCN(CC)c1ccc(C[N@H+]2C[C@@H](C)CC[C@@H]2C[NH3+])c(OC)c1 ZINC001205817753 1091364111 /nfs/dbraw/zinc/36/41/11/1091364111.db2.gz QVTJELFZFYCFNG-MAUKXSAKSA-N 2 2 319.493 3.101 20 10 DGCDLP COc1ccc2ccc(O)c(C[N@@H+]3C[C@H](C)CC[C@H]3C[NH3+])c2c1 ZINC001205842023 1091376558 /nfs/dbraw/zinc/37/65/58/1091376558.db2.gz MCDSCPSZOVBWGZ-HIFRSBDPSA-N 2 2 314.429 3.113 20 10 DGCDLP COc1ccc2ccc(O)c(C[N@H+]3C[C@H](C)CC[C@H]3C[NH3+])c2c1 ZINC001205842023 1091376567 /nfs/dbraw/zinc/37/65/67/1091376567.db2.gz MCDSCPSZOVBWGZ-HIFRSBDPSA-N 2 2 314.429 3.113 20 10 DGCDLP C[C@H]1CC[C@@H](C[NH3+])C[N@@H+]1Cc1cc(Cl)c(Cl)cc1O ZINC001206811504 1091751319 /nfs/dbraw/zinc/75/13/19/1091751319.db2.gz VQZOMMZBCGPADD-UWVGGRQHSA-N 2 2 303.233 3.258 20 10 DGCDLP C[C@H]1CC[C@@H](C[NH3+])C[N@H+]1Cc1cc(Cl)c(Cl)cc1O ZINC001206811504 1091751324 /nfs/dbraw/zinc/75/13/24/1091751324.db2.gz VQZOMMZBCGPADD-UWVGGRQHSA-N 2 2 303.233 3.258 20 10 DGCDLP Oc1ccc(Cl)c(Cl)c1C[N@@H+]1CC[C@@]2(C1)CCC[NH2+]C2 ZINC001222154739 1095462422 /nfs/dbraw/zinc/46/24/22/1095462422.db2.gz QCKOHOPLOPRVBZ-HNNXBMFYSA-N 2 2 315.244 3.275 20 10 DGCDLP Oc1ccc(Cl)c(Cl)c1C[N@H+]1CC[C@@]2(C1)CCC[NH2+]C2 ZINC001222154739 1095462430 /nfs/dbraw/zinc/46/24/30/1095462430.db2.gz QCKOHOPLOPRVBZ-HNNXBMFYSA-N 2 2 315.244 3.275 20 10 DGCDLP Cc1ccc(C)n1-c1ccc(C[N@@H+]2CC[C@@]3(CCC[NH2+]3)C2)cc1 ZINC001222470860 1095630315 /nfs/dbraw/zinc/63/03/15/1095630315.db2.gz JQIWBPKUYPICNB-FQEVSTJZSA-N 2 2 309.457 3.422 20 10 DGCDLP Cc1ccc(C)n1-c1ccc(C[N@H+]2CC[C@@]3(CCC[NH2+]3)C2)cc1 ZINC001222470860 1095630319 /nfs/dbraw/zinc/63/03/19/1095630319.db2.gz JQIWBPKUYPICNB-FQEVSTJZSA-N 2 2 309.457 3.422 20 10 DGCDLP Cc1cc[nH+]c(N2CC[NH+](Cc3c(C)cc(C)cc3O)CC2)c1 ZINC001231845555 1097862388 /nfs/dbraw/zinc/86/23/88/1097862388.db2.gz AJKBQCDXXCPGKR-UHFFFAOYSA-N 2 2 311.429 3.035 20 10 DGCDLP CC[N@H+](CCC[NH+](C)C)Cc1cccc(C(F)(F)F)c1O ZINC001233419500 1098326033 /nfs/dbraw/zinc/32/60/33/1098326033.db2.gz ZUSRBRUBCLQUBP-UHFFFAOYSA-N 2 2 304.356 3.185 20 10 DGCDLP CC[N@@H+](CCC[NH+](C)C)Cc1cccc(C(F)(F)F)c1O ZINC001233419500 1098326043 /nfs/dbraw/zinc/32/60/43/1098326043.db2.gz ZUSRBRUBCLQUBP-UHFFFAOYSA-N 2 2 304.356 3.185 20 10 DGCDLP Oc1ccc(F)c(Cl)c1C[N@H+](C[C@H]1CCC[NH2+]C1)C1CC1 ZINC001236602513 1099697077 /nfs/dbraw/zinc/69/70/77/1099697077.db2.gz WPXHYNOCLWDUPP-NSHDSACASA-N 2 2 312.816 3.149 20 10 DGCDLP Oc1ccc(F)c(Cl)c1C[N@@H+](C[C@H]1CCC[NH2+]C1)C1CC1 ZINC001236602513 1099697082 /nfs/dbraw/zinc/69/70/82/1099697082.db2.gz WPXHYNOCLWDUPP-NSHDSACASA-N 2 2 312.816 3.149 20 10 DGCDLP CCc1ccc(C[NH+]2CCC(Oc3cc[nH+]cc3)CC2)c(O)c1 ZINC001236783077 1099780224 /nfs/dbraw/zinc/78/02/24/1099780224.db2.gz HVHAGJFSTXFXKY-UHFFFAOYSA-N 2 2 312.413 3.393 20 10 DGCDLP Cc1ccc(C)c(C[NH+]2CC3(C2)CC[N@@H+](C2CCCC2)C3)c1O ZINC001275968735 1104971438 /nfs/dbraw/zinc/97/14/38/1104971438.db2.gz KKPHSVWFWUAEQI-UHFFFAOYSA-N 2 2 314.473 3.459 20 10 DGCDLP Cc1ccc(C)c(C[NH+]2CC3(C2)CC[N@H+](C2CCCC2)C3)c1O ZINC001275968735 1104971443 /nfs/dbraw/zinc/97/14/43/1104971443.db2.gz KKPHSVWFWUAEQI-UHFFFAOYSA-N 2 2 314.473 3.459 20 10 DGCDLP COc1ccc(C[N@@H+]2CCCC[C@@](C)(C[NH3+])C2)c(O)c1Cl ZINC001206574184 1105440924 /nfs/dbraw/zinc/44/09/24/1105440924.db2.gz QCAKBYWXLWNQOY-INIZCTEOSA-N 2 2 312.841 3.005 20 10 DGCDLP COc1ccc(C[N@H+]2CCCC[C@@](C)(C[NH3+])C2)c(O)c1Cl ZINC001206574184 1105440927 /nfs/dbraw/zinc/44/09/27/1105440927.db2.gz QCAKBYWXLWNQOY-INIZCTEOSA-N 2 2 312.841 3.005 20 10 DGCDLP CC[C@@H]([NH2+]CCn1cc[nH+]c1)c1cc(Br)ccc1O ZINC000041119164 183166786 /nfs/dbraw/zinc/16/67/86/183166786.db2.gz RRNLDRJUTVIHND-CYBMUJFWSA-N 2 2 324.222 3.092 20 10 DGCDLP CC[C@@H]([NH2+]C1CC[NH+](CC2CC2)CC1)c1ccc(F)cc1O ZINC000286342029 131231184 /nfs/dbraw/zinc/23/11/84/131231184.db2.gz YIYFAZODUJSCAP-QGZVFWFLSA-N 2 2 306.425 3.446 20 10 DGCDLP Cc1[nH+]ccn1CCC[NH2+]Cc1cc(Cl)cc(Cl)c1O ZINC000263671438 432564277 /nfs/dbraw/zinc/56/42/77/432564277.db2.gz KAMIGVARTBNJOW-UHFFFAOYSA-N 2 2 314.216 3.384 20 10 DGCDLP CCC[NH+]1CCC([N@H+](C)Cc2cc(F)cc(C(C)=O)c2O)CC1 ZINC000177281020 432607481 /nfs/dbraw/zinc/60/74/81/432607481.db2.gz KWBIHRZSUUSLGQ-UHFFFAOYSA-N 2 2 322.424 3.040 20 10 DGCDLP CCC[NH+]1CCC([N@@H+](C)Cc2cc(F)cc(C(C)=O)c2O)CC1 ZINC000177281020 432607485 /nfs/dbraw/zinc/60/74/85/432607485.db2.gz KWBIHRZSUUSLGQ-UHFFFAOYSA-N 2 2 322.424 3.040 20 10 DGCDLP C[C@H](CC[NH+](C)C)[NH2+][C@H](C)c1cc(Br)ccc1O ZINC000273466071 432603128 /nfs/dbraw/zinc/60/31/28/432603128.db2.gz DSVSUGPATZEJIS-GHMZBOCLSA-N 2 2 315.255 3.146 20 10 DGCDLP C[C@@H]([NH2+]Cc1c[nH+]c2n1CCCC2)c1cc(Cl)ccc1O ZINC000375273256 433409186 /nfs/dbraw/zinc/40/91/86/433409186.db2.gz YUNKWZLMLPCCGJ-LLVKDONJSA-N 2 2 305.809 3.429 20 10 DGCDLP C[NH+]1CCC(C)(C[NH2+]Cc2cc(Cl)c(F)cc2O)CC1 ZINC000293535193 433773161 /nfs/dbraw/zinc/77/31/61/433773161.db2.gz FITYQUOOGGGFFH-UHFFFAOYSA-N 2 2 300.805 3.006 20 10 DGCDLP CCN(CC)c1ccc(C[N@@H+]2CC[C@@H](c3[nH+]ccn3C)C2)cc1 ZINC000377890933 434027980 /nfs/dbraw/zinc/02/79/80/434027980.db2.gz ZFVBOWAFVDHUGH-QGZVFWFLSA-N 2 2 312.461 3.256 20 10 DGCDLP CCN(CC)c1ccc(C[N@H+]2CC[C@@H](c3[nH+]ccn3C)C2)cc1 ZINC000377890933 434027985 /nfs/dbraw/zinc/02/79/85/434027985.db2.gz ZFVBOWAFVDHUGH-QGZVFWFLSA-N 2 2 312.461 3.256 20 10 DGCDLP CC[C@@H]([NH2+]CCC[N@@H+]1CCCO[C@H](C)C1)c1ccc(F)cc1O ZINC000287534716 434389186 /nfs/dbraw/zinc/38/91/86/434389186.db2.gz PCOKPDIZORSUQK-RHSMWYFYSA-N 2 2 324.440 3.073 20 10 DGCDLP Oc1cccc2c1[C@@H]([NH2+]Cc1ccccc1Cn1cc[nH+]c1)CC2 ZINC000296138207 434521591 /nfs/dbraw/zinc/52/15/91/434521591.db2.gz WBJDCJHPYUPIAV-SFHVURJKSA-N 2 2 319.408 3.414 20 10 DGCDLP Cn1cc[nH+]c1[C@H]1CC[N@H+](Cc2c(O)ccc3ccccc32)C1 ZINC000372880755 434860199 /nfs/dbraw/zinc/86/01/99/434860199.db2.gz LECIEJSRWNUTRU-HNNXBMFYSA-N 2 2 307.397 3.268 20 10 DGCDLP Cn1cc[nH+]c1[C@H]1CC[N@@H+](Cc2c(O)ccc3ccccc32)C1 ZINC000372880755 434860202 /nfs/dbraw/zinc/86/02/02/434860202.db2.gz LECIEJSRWNUTRU-HNNXBMFYSA-N 2 2 307.397 3.268 20 10 DGCDLP CC[N@@H+]1CC[C@H]2CC[C@@H](C1)[NH+]2Cc1cc(Cl)cc(OC)c1O ZINC000184702200 527900855 /nfs/dbraw/zinc/90/08/55/527900855.db2.gz VSTRXTHRQWCDLW-CABCVRRESA-N 2 2 324.852 3.113 20 10 DGCDLP CC[N@H+]1CC[C@H]2CC[C@@H](C1)[NH+]2Cc1cc(Cl)cc(OC)c1O ZINC000184702200 527900863 /nfs/dbraw/zinc/90/08/63/527900863.db2.gz VSTRXTHRQWCDLW-CABCVRRESA-N 2 2 324.852 3.113 20 10 DGCDLP CC[NH+]1CC[C@H]2CC[C@@H](C1)[N@@H+]2Cc1cc(Cl)cc(OC)c1O ZINC000184702200 527900870 /nfs/dbraw/zinc/90/08/70/527900870.db2.gz VSTRXTHRQWCDLW-CABCVRRESA-N 2 2 324.852 3.113 20 10 DGCDLP CC[NH+]1CC[C@H]2CC[C@@H](C1)[N@H+]2Cc1cc(Cl)cc(OC)c1O ZINC000184702200 527900873 /nfs/dbraw/zinc/90/08/73/527900873.db2.gz VSTRXTHRQWCDLW-CABCVRRESA-N 2 2 324.852 3.113 20 10 DGCDLP CC[C@H](c1ccc(C)cc1O)[N@@H+]1CCc2sc(C[NH3+])nc2C1 ZINC000925751134 618594856 /nfs/dbraw/zinc/59/48/56/618594856.db2.gz KHEQNGLVCKKUAI-CQSZACIVSA-N 2 2 317.458 3.125 20 10 DGCDLP CC[C@H](c1ccc(C)cc1O)[N@H+]1CCc2sc(C[NH3+])nc2C1 ZINC000925751134 618594857 /nfs/dbraw/zinc/59/48/57/618594857.db2.gz KHEQNGLVCKKUAI-CQSZACIVSA-N 2 2 317.458 3.125 20 10 DGCDLP C[NH+](C)CC[C@@H]([NH2+][C@@H]1CCc2cccc(O)c21)c1cccnc1 ZINC000903381372 619768700 /nfs/dbraw/zinc/76/87/00/619768700.db2.gz WBCQKNTVVGNJGZ-IAGOWNOFSA-N 2 2 311.429 3.057 20 10 DGCDLP C[C@@H]([NH2+][C@H](CC[NH+](C)C)c1cccnc1)c1ccc(F)cc1O ZINC000903380775 619768855 /nfs/dbraw/zinc/76/88/55/619768855.db2.gz PHVRYSKDKFLXLE-CXAGYDPISA-N 2 2 317.408 3.270 20 10 DGCDLP CCCC[C@H](C[NH3+])[NH2+][C@H](C)c1ccc(Br)cc1O ZINC000817963206 620894570 /nfs/dbraw/zinc/89/45/70/620894570.db2.gz SFQIRPQCWJIUTB-ZYHUDNBSSA-N 2 2 315.255 3.323 20 10 DGCDLP Cc1cc(O)c(C[NH2+][C@@H](CC[NH+](C)C)c2cccnc2)cc1C ZINC000922628838 621069912 /nfs/dbraw/zinc/06/99/12/621069912.db2.gz URRURQAZZUKDQY-SFHVURJKSA-N 2 2 313.445 3.187 20 10 DGCDLP CC(C)C[NH+]1CCC([NH2+][C@@H](C)c2cc(F)cc(F)c2O)CC1 ZINC000756393717 621635161 /nfs/dbraw/zinc/63/51/61/621635161.db2.gz TULCOGPYRITYFS-LBPRGKRZSA-N 2 2 312.404 3.441 20 10 DGCDLP C[C@@H]1C[C@H]([NH2+]CCCCn2cc[nH+]c2)c2c1c(F)ccc2O ZINC000756458245 621639691 /nfs/dbraw/zinc/63/96/91/621639691.db2.gz KQTADRPKFDZNAU-OCCSQVGLSA-N 2 2 303.381 3.346 20 10 DGCDLP CCN(C)c1ccc([C@H](C)[NH2+][C@H]2CC[N@H+](CC3CC3)C2)cc1 ZINC000765873609 622292177 /nfs/dbraw/zinc/29/21/77/622292177.db2.gz OCNZLAROFHONSN-YJBOKZPZSA-N 2 2 301.478 3.278 20 10 DGCDLP CCN(C)c1ccc([C@H](C)[NH2+][C@H]2CC[N@@H+](CC3CC3)C2)cc1 ZINC000765873609 622292182 /nfs/dbraw/zinc/29/21/82/622292182.db2.gz OCNZLAROFHONSN-YJBOKZPZSA-N 2 2 301.478 3.278 20 10 DGCDLP Oc1cccc(Cl)c1C[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000770374311 622626153 /nfs/dbraw/zinc/62/61/53/622626153.db2.gz LDASYKSYUJFNBL-SUMWQHHRSA-N 2 2 320.864 3.494 20 10 DGCDLP Oc1cccc(Cl)c1C[N@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000770374311 622626158 /nfs/dbraw/zinc/62/61/58/622626158.db2.gz LDASYKSYUJFNBL-SUMWQHHRSA-N 2 2 320.864 3.494 20 10 DGCDLP Oc1cccc(Cl)c1C[NH+]1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000770374311 622626162 /nfs/dbraw/zinc/62/61/62/622626162.db2.gz LDASYKSYUJFNBL-SUMWQHHRSA-N 2 2 320.864 3.494 20 10 DGCDLP Oc1cccc(Cl)c1C[NH+]1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000770374311 622626166 /nfs/dbraw/zinc/62/61/66/622626166.db2.gz LDASYKSYUJFNBL-SUMWQHHRSA-N 2 2 320.864 3.494 20 10 DGCDLP CC1(C)C[NH2+]CC[C@H]([NH2+]Cc2cc(Cl)cc(F)c2O)C1 ZINC000872252091 622868007 /nfs/dbraw/zinc/86/80/07/622868007.db2.gz OWQVUZCCGPFDHS-LBPRGKRZSA-N 2 2 300.805 3.053 20 10 DGCDLP Oc1c(Cl)cccc1C[NH2+][C@@H]1CCCCC12CC[NH2+]CC2 ZINC000873232625 623085203 /nfs/dbraw/zinc/08/52/03/623085203.db2.gz JEVICFLSOZGGLP-OAHLLOKOSA-N 2 2 308.853 3.448 20 10 DGCDLP CC(C)[N@@H+]1CC[C@H](C[NH2+]Cc2c(O)ccc(Cl)c2F)C1 ZINC000790963050 625724817 /nfs/dbraw/zinc/72/48/17/625724817.db2.gz XNGNJOVINQNZEL-LLVKDONJSA-N 2 2 300.805 3.005 20 10 DGCDLP CC(C)[N@H+]1CC[C@H](C[NH2+]Cc2c(O)ccc(Cl)c2F)C1 ZINC000790963050 625724819 /nfs/dbraw/zinc/72/48/19/625724819.db2.gz XNGNJOVINQNZEL-LLVKDONJSA-N 2 2 300.805 3.005 20 10 DGCDLP C[N@H+](CCCn1cc[nH+]c1)Cc1cc(C(C)(C)C)cc(O)c1O ZINC000130590299 625876421 /nfs/dbraw/zinc/87/64/21/625876421.db2.gz MEEHRINZFWXTRW-UHFFFAOYSA-N 2 2 317.433 3.114 20 10 DGCDLP C[N@@H+](CCCn1cc[nH+]c1)Cc1cc(C(C)(C)C)cc(O)c1O ZINC000130590299 625876426 /nfs/dbraw/zinc/87/64/26/625876426.db2.gz MEEHRINZFWXTRW-UHFFFAOYSA-N 2 2 317.433 3.114 20 10 DGCDLP c1cn(C[C@@H]([NH2+]Cc2ccc3c(c2)CCO3)c2ccccc2)c[nH+]1 ZINC000883398258 626672981 /nfs/dbraw/zinc/67/29/81/626672981.db2.gz HZNWTFICDXOJCU-LJQANCHMSA-N 2 2 319.408 3.349 20 10 DGCDLP Cc1cc(Cl)cc([C@H](C)[NH2+][C@@H]2CCn3cc[nH+]c3C2)c1O ZINC000808715532 626853017 /nfs/dbraw/zinc/85/30/17/626853017.db2.gz VLILYIHOQWRABP-WCQYABFASA-N 2 2 305.809 3.216 20 10 DGCDLP C[NH+]1CC[C@H]2[C@H](CCC[N@@H+]2Cc2cc(Cl)c(F)cc2O)C1 ZINC000816611918 627814346 /nfs/dbraw/zinc/81/43/46/627814346.db2.gz AJFHRZIIZQOHTK-ABAIWWIYSA-N 2 2 312.816 3.101 20 10 DGCDLP C[NH+]1CC[C@H]2[C@H](CCC[N@H+]2Cc2cc(Cl)c(F)cc2O)C1 ZINC000816611918 627814348 /nfs/dbraw/zinc/81/43/48/627814348.db2.gz AJFHRZIIZQOHTK-ABAIWWIYSA-N 2 2 312.816 3.101 20 10 DGCDLP COc1ccccc1[C@H](C)[NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000817937985 627966495 /nfs/dbraw/zinc/96/64/95/627966495.db2.gz AWYGRBUSDANTDC-KSSFIOAISA-N 2 2 313.445 3.112 20 10 DGCDLP C[C@H]([NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1)c1cc(F)cc(F)c1 ZINC000817938566 627966806 /nfs/dbraw/zinc/96/68/06/627966806.db2.gz NGKWQHKPIXQQLN-SGTLLEGYSA-N 2 2 319.399 3.381 20 10 DGCDLP C[C@@H]([NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1)c1ccc(F)c(F)c1 ZINC000817938168 627966820 /nfs/dbraw/zinc/96/68/20/627966820.db2.gz GABVGLMDLRQUFL-KZULUSFZSA-N 2 2 319.399 3.381 20 10 DGCDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+][C@H]2CCc3c2cccc3F)cc1 ZINC000817938973 627967445 /nfs/dbraw/zinc/96/74/45/627967445.db2.gz WQVJFQPUHLHANZ-OALUTQOASA-N 2 2 313.420 3.169 20 10 DGCDLP C[C@@H](Cc1cccs1)[NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000817939071 627967508 /nfs/dbraw/zinc/96/75/08/627967508.db2.gz YLZMUOQPXMPCND-SUMWQHHRSA-N 2 2 303.475 3.035 20 10 DGCDLP Cc1nc(C)c([C@H](C)[NH2+]C[C@@H]([NH3+])c2ccc(N(C)C)cc2)s1 ZINC000817938657 627967640 /nfs/dbraw/zinc/96/76/40/627967640.db2.gz OYUOHGYPLIACFH-MEDUHNTESA-N 2 2 318.490 3.177 20 10 DGCDLP Cc1cc([C@H](C)[NH2+]C[C@@H]([NH3+])c2ccc(N(C)C)cc2)cs1 ZINC000817940002 627967947 /nfs/dbraw/zinc/96/79/47/627967947.db2.gz DSRDFWRRSXIWIV-SUMWQHHRSA-N 2 2 303.475 3.473 20 10 DGCDLP CC[C@H]([NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1)c1ccccc1O ZINC000817942302 627968505 /nfs/dbraw/zinc/96/85/05/627968505.db2.gz NZNYXLPMOJJQBB-MSOLQXFVSA-N 2 2 313.445 3.199 20 10 DGCDLP C[C@@H]1Cc2ccccc2[C@H]1[NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000817940733 627968553 /nfs/dbraw/zinc/96/85/53/627968553.db2.gz HMYZVRCSHRITFZ-XMCHAPAWSA-N 2 2 309.457 3.276 20 10 DGCDLP Oc1ccccc1[C@H](CCc1ccccc1)[NH2+][C@H]1CCC[NH2+]C1 ZINC000817942104 627968728 /nfs/dbraw/zinc/96/87/28/627968728.db2.gz WTVRFSKNTMIUPH-HKUYNNGSSA-N 2 2 310.441 3.408 20 10 DGCDLP CC[C@H](Cc1cccs1)[NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000817941118 627968974 /nfs/dbraw/zinc/96/89/74/627968974.db2.gz JCZHDNYUFDHOLB-CRAIPNDOSA-N 2 2 317.502 3.425 20 10 DGCDLP CCC[C@H]([NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1)c1ccccn1 ZINC000817944095 627970015 /nfs/dbraw/zinc/97/00/15/627970015.db2.gz XHEUYSWYRCETRA-MSOLQXFVSA-N 2 2 312.461 3.278 20 10 DGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+][C@@H]2CCCc3ccccc3C2)cc1 ZINC000817944226 627970066 /nfs/dbraw/zinc/97/00/66/627970066.db2.gz YCPSLDQOALGBIK-TZIWHRDSSA-N 2 2 323.484 3.290 20 10 DGCDLP C[C@@H]([NH2+]C[C@@H]1CCC[NH2+]1)c1ccc(N2CCCCCC2)cc1 ZINC000817951228 627972353 /nfs/dbraw/zinc/97/23/53/627972353.db2.gz CBMNVYOILCSFQR-AEFFLSMTSA-N 2 2 301.478 3.470 20 10 DGCDLP CC(C)C[C@@H](C[NH3+])[NH2+][C@H](C)c1ccc(Br)cc1O ZINC000817958981 627975122 /nfs/dbraw/zinc/97/51/22/627975122.db2.gz NXWHBGMXNOMAQD-PWSUYJOCSA-N 2 2 315.255 3.179 20 10 DGCDLP CCCC[C@H](C[NH3+])[NH2+][C@@H](C)c1ccc(Br)cc1O ZINC000817963201 627976719 /nfs/dbraw/zinc/97/67/19/627976719.db2.gz SFQIRPQCWJIUTB-CMPLNLGQSA-N 2 2 315.255 3.323 20 10 DGCDLP CC[C@H]([NH2+][C@H]1C[NH2+]CC[C@H]1C)c1ccc(C(F)(F)F)cc1O ZINC000817969521 627978870 /nfs/dbraw/zinc/97/88/70/627978870.db2.gz VWDJPONNEHHOJN-SWHYSGLUSA-N 2 2 316.367 3.450 20 10 DGCDLP CCO[C@H](C[NH2+][C@H](C)c1ccc2ccccc2c1O)C[NH+](C)C ZINC000926965052 627990699 /nfs/dbraw/zinc/99/06/99/627990699.db2.gz ZWEGWFBGTHJFBH-GDBMZVCRSA-N 2 2 316.445 3.163 20 10 DGCDLP Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@@H]1C[C@H](C)[N@@H+](C2CC2)C1 ZINC000840893472 630373660 /nfs/dbraw/zinc/37/36/60/630373660.db2.gz IYDKLYWBNNTDJG-XYJFISCASA-N 2 2 315.505 3.207 20 10 DGCDLP Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@@H]1C[C@H](C)[N@H+](C2CC2)C1 ZINC000840893472 630373661 /nfs/dbraw/zinc/37/36/61/630373661.db2.gz IYDKLYWBNNTDJG-XYJFISCASA-N 2 2 315.505 3.207 20 10 DGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+]Cc2ccc(C3CC3)cc2)cc1 ZINC000841040867 630400442 /nfs/dbraw/zinc/40/04/42/630400442.db2.gz ARHSRCYEJLWQFU-HXUWFJFHSA-N 2 2 309.457 3.420 20 10 DGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+]Cc2ccnc3ccccc23)cc1 ZINC000841042835 630401390 /nfs/dbraw/zinc/40/13/90/630401390.db2.gz LOWIBFWZHJKERU-LJQANCHMSA-N 2 2 320.440 3.090 20 10 DGCDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+]Cc2cc(F)cc(Cl)c2)cc1 ZINC000841045508 630402026 /nfs/dbraw/zinc/40/20/26/630402026.db2.gz LYWYLCMGYNMIPY-KRWDZBQOSA-N 2 2 321.827 3.335 20 10 DGCDLP Oc1ccc(Cl)c(F)c1C[N@@H+]1CCCC[C@@H]1[C@@H]1CC[NH2+]C1 ZINC000841085713 630405877 /nfs/dbraw/zinc/40/58/77/630405877.db2.gz BJIFPAYFKQCFMY-BXUZGUMPSA-N 2 2 312.816 3.149 20 10 DGCDLP Oc1ccc(Cl)c(F)c1C[N@H+]1CCCC[C@@H]1[C@@H]1CC[NH2+]C1 ZINC000841085713 630405879 /nfs/dbraw/zinc/40/58/79/630405879.db2.gz BJIFPAYFKQCFMY-BXUZGUMPSA-N 2 2 312.816 3.149 20 10 DGCDLP C[C@H]([NH2+]CCc1cn2c([nH+]1)CCCC2)c1ccc(Cl)cc1O ZINC000841745660 630461604 /nfs/dbraw/zinc/46/16/04/630461604.db2.gz RYRHLDHVWAXEDB-LBPRGKRZSA-N 2 2 319.836 3.472 20 10 DGCDLP CC(C)C[N@H+](C)CCC[NH2+][C@H](C)c1cc(F)cc(F)c1O ZINC000846178472 631213963 /nfs/dbraw/zinc/21/39/63/631213963.db2.gz WDISTLWAHGTIJE-GFCCVEGCSA-N 2 2 300.393 3.299 20 10 DGCDLP CC(C)C[N@@H+](C)CCC[NH2+][C@H](C)c1cc(F)cc(F)c1O ZINC000846178472 631213965 /nfs/dbraw/zinc/21/39/65/631213965.db2.gz WDISTLWAHGTIJE-GFCCVEGCSA-N 2 2 300.393 3.299 20 10 DGCDLP c1cc(N2CCCC2)ccc1C[NH2+][C@@H]1CCC[N@@H+]2CCCC[C@H]12 ZINC000848575882 631701403 /nfs/dbraw/zinc/70/14/03/631701403.db2.gz XMVZTKJLJUCHBS-WOJBJXKFSA-N 2 2 313.489 3.393 20 10 DGCDLP c1cc(N2CCCC2)ccc1C[NH2+][C@@H]1CCC[N@H+]2CCCC[C@H]12 ZINC000848575882 631701407 /nfs/dbraw/zinc/70/14/07/631701407.db2.gz XMVZTKJLJUCHBS-WOJBJXKFSA-N 2 2 313.489 3.393 20 10 DGCDLP Cc1cc(N(C)C)ccc1C[NH2+][C@H]1CCC[N@@H+]2CCCC[C@@H]12 ZINC000848927645 631791015 /nfs/dbraw/zinc/79/10/15/631791015.db2.gz JOKFUSKURGAJAO-OALUTQOASA-N 2 2 301.478 3.168 20 10 DGCDLP Cc1cc(N(C)C)ccc1C[NH2+][C@H]1CCC[N@H+]2CCCC[C@@H]12 ZINC000848927645 631791022 /nfs/dbraw/zinc/79/10/22/631791022.db2.gz JOKFUSKURGAJAO-OALUTQOASA-N 2 2 301.478 3.168 20 10 DGCDLP Oc1cc2c(cc1C[NH+]1CCC(n3cc[nH+]c3)CC1)CCCC2 ZINC000160240217 655536418 /nfs/dbraw/zinc/53/64/18/655536418.db2.gz AIYKSZDXZLBAKC-UHFFFAOYSA-N 2 2 311.429 3.305 20 10 DGCDLP Cc1cc[nH+]c(N2CC[NH+](Cc3cc(C)c(C)cc3O)CC2)c1 ZINC000165929602 655992425 /nfs/dbraw/zinc/99/24/25/655992425.db2.gz LUELBHPUEMNVNM-UHFFFAOYSA-N 2 2 311.429 3.035 20 10 DGCDLP CS[C@@H]1CCC[C@@H]([NH2+]C[C@H]([NH3+])c2ccc(N(C)C)cc2)C1 ZINC001579370394 1191974639 /nfs/dbraw/zinc/97/46/39/1191974639.db2.gz QWCLZAFMKXYESQ-OIISXLGYSA-N 2 2 307.507 3.016 20 10 DGCDLP Oc1c(F)cc(Cl)cc1C[NH2+]Cc1cccc2c1CC[NH2+]C2 ZINC001580885883 1192043863 /nfs/dbraw/zinc/04/38/63/1192043863.db2.gz QLBNPLRKUAVMOH-UHFFFAOYSA-N 2 2 320.795 3.120 20 10 DGCDLP CC(C)C[C@@H](C[NH+]1CCCC1)[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC001620945967 1192641271 /nfs/dbraw/zinc/64/12/71/1192641271.db2.gz BKOOYDIUNUMLPV-KRWDZBQOSA-N 2 2 321.484 3.492 20 10 DGCDLP Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@@H]1Cc2ccccc2[C@H]1[NH3+] ZINC001336077225 1178990370 /nfs/dbraw/zinc/99/03/70/1178990370.db2.gz HZMQZVOXDMFSHC-NXOXCILZSA-N 2 2 308.425 3.463 20 10 DGCDLP CCN(CC)c1ccc(C[NH2+]C[C@@]2([NH+](C)C)CCSC2)cc1 ZINC001560363968 1189318271 /nfs/dbraw/zinc/31/82/71/1189318271.db2.gz NKJPSPQRNCNBJG-SFHVURJKSA-N 2 2 321.534 3.060 20 10 DGCDLP CC[NH+](CC)CC[C@H](C)[NH2+]Cc1c(O)ccc(Cl)c1F ZINC001651705782 1195499125 /nfs/dbraw/zinc/49/91/25/1195499125.db2.gz BXUIFSPDBWGAII-NSHDSACASA-N 2 2 302.821 3.395 20 10 DGCDLP COc1ccc(O)c(C[NH2+][C@@H](Cn2cc[nH+]c2)c2ccccc2)c1 ZINC001658788561 1196301484 /nfs/dbraw/zinc/30/14/84/1196301484.db2.gz RDYJHCZPBSQPHQ-SFHVURJKSA-N 2 2 323.396 3.128 20 10 DGCDLP CN(C)c1cc[nH+]c(C[NH2+]Cc2ccc3ccccc3c2O)c1 ZINC001183846510 1084042058 /nfs/dbraw/zinc/04/20/58/1084042058.db2.gz UALNFOVVQIQJHI-UHFFFAOYSA-N 2 2 307.397 3.296 20 10 DGCDLP Oc1c(F)cc(Cl)cc1C[N@@H+]1CCCC2(CC[NH2+]CC2)C1 ZINC001204742218 1085890583 /nfs/dbraw/zinc/89/05/83/1085890583.db2.gz KLRGQMSVWKAXQJ-UHFFFAOYSA-N 2 2 312.816 3.150 20 10 DGCDLP Oc1c(F)cc(Cl)cc1C[N@H+]1CCCC2(CC[NH2+]CC2)C1 ZINC001204742218 1085890596 /nfs/dbraw/zinc/89/05/96/1085890596.db2.gz KLRGQMSVWKAXQJ-UHFFFAOYSA-N 2 2 312.816 3.150 20 10 DGCDLP COc1cccc(C[N@H+](C2CCCC2)C2CC[NH+](C)CC2)c1O ZINC001203601644 1090765674 /nfs/dbraw/zinc/76/56/74/1090765674.db2.gz FBOJRZPPGPUFGE-UHFFFAOYSA-N 2 2 318.461 3.240 20 10 DGCDLP COc1cccc(C[N@@H+](C2CCCC2)C2CC[NH+](C)CC2)c1O ZINC001203601644 1090765678 /nfs/dbraw/zinc/76/56/78/1090765678.db2.gz FBOJRZPPGPUFGE-UHFFFAOYSA-N 2 2 318.461 3.240 20 10 DGCDLP COc1ccc(O)c(C[N@H+](C)Cc2ccc(-n3cc[nH+]c3)cc2)c1 ZINC001203681052 1090779130 /nfs/dbraw/zinc/77/91/30/1090779130.db2.gz MWRXBJZKEOYOEW-UHFFFAOYSA-N 2 2 323.396 3.219 20 10 DGCDLP COc1ccc(O)c(C[N@@H+](C)Cc2ccc(-n3cc[nH+]c3)cc2)c1 ZINC001203681052 1090779133 /nfs/dbraw/zinc/77/91/33/1090779133.db2.gz MWRXBJZKEOYOEW-UHFFFAOYSA-N 2 2 323.396 3.219 20 10 DGCDLP C[C@@H]1CC[N@H+](Cc2c(O)ccc(Cl)c2Cl)C[C@@H]1C[NH3+] ZINC001205317341 1091182616 /nfs/dbraw/zinc/18/26/16/1091182616.db2.gz OCKDREFKXYTYBG-ZJUUUORDSA-N 2 2 303.233 3.116 20 10 DGCDLP C[C@@H]1CC[N@@H+](Cc2c(O)ccc(Cl)c2Cl)C[C@@H]1C[NH3+] ZINC001205317341 1091182619 /nfs/dbraw/zinc/18/26/19/1091182619.db2.gz OCKDREFKXYTYBG-ZJUUUORDSA-N 2 2 303.233 3.116 20 10 DGCDLP C[N@@H+]1CCC[C@H]2C[NH+](Cc3cccc(C(C)(C)C)c3O)C[C@H]21 ZINC001143116417 1092617628 /nfs/dbraw/zinc/61/76/28/1092617628.db2.gz ANFDCINLQIZNDO-WMLDXEAASA-N 2 2 302.462 3.216 20 10 DGCDLP C[N@H+]1CCC[C@H]2C[NH+](Cc3cccc(C(C)(C)C)c3O)C[C@H]21 ZINC001143116417 1092617634 /nfs/dbraw/zinc/61/76/34/1092617634.db2.gz ANFDCINLQIZNDO-WMLDXEAASA-N 2 2 302.462 3.216 20 10 DGCDLP C[NH+]1CCC[C@H]2C[N@H+](Cc3cccc(C(C)(C)C)c3O)C[C@H]21 ZINC001143116417 1092617637 /nfs/dbraw/zinc/61/76/37/1092617637.db2.gz ANFDCINLQIZNDO-WMLDXEAASA-N 2 2 302.462 3.216 20 10 DGCDLP C[NH+]1CCC[C@H]2C[N@@H+](Cc3cccc(C(C)(C)C)c3O)C[C@H]21 ZINC001143116417 1092617640 /nfs/dbraw/zinc/61/76/40/1092617640.db2.gz ANFDCINLQIZNDO-WMLDXEAASA-N 2 2 302.462 3.216 20 10 DGCDLP Oc1ccc(F)c(F)c1C[N@@H+]1CCCC[C@@]2(CCCC[NH2+]C2)C1 ZINC001222171413 1095476383 /nfs/dbraw/zinc/47/63/83/1095476383.db2.gz BJJNKZJTYJDEGE-GOSISDBHSA-N 2 2 324.415 3.416 20 10 DGCDLP Oc1ccc(F)c(F)c1C[N@H+]1CCCC[C@@]2(CCCC[NH2+]C2)C1 ZINC001222171413 1095476388 /nfs/dbraw/zinc/47/63/88/1095476388.db2.gz BJJNKZJTYJDEGE-GOSISDBHSA-N 2 2 324.415 3.416 20 10 DGCDLP Cc1ccc(C)n1-c1ccc(C[NH+]2CC3(C2)CCC[NH2+]C3)cc1 ZINC001222335469 1095556441 /nfs/dbraw/zinc/55/64/41/1095556441.db2.gz PTUXHERDYKGLIH-UHFFFAOYSA-N 2 2 309.457 3.280 20 10 DGCDLP Oc1cc(C(F)(F)F)ccc1C[N@H+]1CCC[C@@]2(CCC[NH2+]2)C1 ZINC001222355713 1095569728 /nfs/dbraw/zinc/56/97/28/1095569728.db2.gz UDLVMWFWAVQZBO-HNNXBMFYSA-N 2 2 314.351 3.129 20 10 DGCDLP Cc1cc(C[N@@H+]2CCC[C@]23CC[NH2+]C3)c(C)n1-c1ccccc1 ZINC001235110336 1098810548 /nfs/dbraw/zinc/81/05/48/1098810548.db2.gz KQJUQLIVJWGNAV-HXUWFJFHSA-N 2 2 309.457 3.422 20 10 DGCDLP Cc1cc(C[N@H+]2CCC[C@]23CC[NH2+]C3)c(C)n1-c1ccccc1 ZINC001235110336 1098810554 /nfs/dbraw/zinc/81/05/54/1098810554.db2.gz KQJUQLIVJWGNAV-HXUWFJFHSA-N 2 2 309.457 3.422 20 10 DGCDLP C[N@H+](CCC1CC[NH2+]CC1)Cc1cc(Cl)cc(F)c1O ZINC001235718032 1099144108 /nfs/dbraw/zinc/14/41/08/1099144108.db2.gz SJAFUTYKRVILDH-UHFFFAOYSA-N 2 2 300.805 3.006 20 10 DGCDLP C[N@@H+](CCC1CC[NH2+]CC1)Cc1cc(Cl)cc(F)c1O ZINC001235718032 1099144113 /nfs/dbraw/zinc/14/41/13/1099144113.db2.gz SJAFUTYKRVILDH-UHFFFAOYSA-N 2 2 300.805 3.006 20 10 DGCDLP CCC[N@H+](Cc1cccc(C(F)(F)F)c1O)C1CC[NH2+]CC1 ZINC001236185164 1099455165 /nfs/dbraw/zinc/45/51/65/1099455165.db2.gz YTBJADFAKRZHHN-UHFFFAOYSA-N 2 2 316.367 3.375 20 10 DGCDLP CCC[N@@H+](Cc1cccc(C(F)(F)F)c1O)C1CC[NH2+]CC1 ZINC001236185164 1099455170 /nfs/dbraw/zinc/45/51/70/1099455170.db2.gz YTBJADFAKRZHHN-UHFFFAOYSA-N 2 2 316.367 3.375 20 10 DGCDLP CC(C)(C)c1ccc(O)c(C[N@H+](C2CC2)[C@@H]2CCC[NH2+]C2)c1 ZINC001236240457 1099495628 /nfs/dbraw/zinc/49/56/28/1099495628.db2.gz MBDXIEXDRMSOPB-QGZVFWFLSA-N 2 2 302.462 3.406 20 10 DGCDLP CC(C)(C)c1ccc(O)c(C[N@@H+](C2CC2)[C@@H]2CCC[NH2+]C2)c1 ZINC001236240457 1099495632 /nfs/dbraw/zinc/49/56/32/1099495632.db2.gz MBDXIEXDRMSOPB-QGZVFWFLSA-N 2 2 302.462 3.406 20 10 DGCDLP CN(C)c1ccc(C[N@H+](C[C@@H]2CCC[NH2+]C2)C2CC2)c(Cl)c1 ZINC001236600024 1099696016 /nfs/dbraw/zinc/69/60/16/1099696016.db2.gz XZSMDURJKQIKRE-CQSZACIVSA-N 2 2 321.896 3.370 20 10 DGCDLP CN(C)c1ccc(C[N@@H+](C[C@@H]2CCC[NH2+]C2)C2CC2)c(Cl)c1 ZINC001236600024 1099696019 /nfs/dbraw/zinc/69/60/19/1099696019.db2.gz XZSMDURJKQIKRE-CQSZACIVSA-N 2 2 321.896 3.370 20 10 DGCDLP Oc1ccc(F)c(Cl)c1C[N@H+](C[C@@H]1CCC[NH2+]C1)C1CC1 ZINC001236602512 1099697732 /nfs/dbraw/zinc/69/77/32/1099697732.db2.gz WPXHYNOCLWDUPP-LLVKDONJSA-N 2 2 312.816 3.149 20 10 DGCDLP Oc1ccc(F)c(Cl)c1C[N@@H+](C[C@@H]1CCC[NH2+]C1)C1CC1 ZINC001236602512 1099697736 /nfs/dbraw/zinc/69/77/36/1099697736.db2.gz WPXHYNOCLWDUPP-LLVKDONJSA-N 2 2 312.816 3.149 20 10 DGCDLP Oc1cc(O)c(C[N@H+]([C@@H]2CC[NH2+]C2)C2CCCCC2)cc1Cl ZINC001236653713 1099725146 /nfs/dbraw/zinc/72/51/46/1099725146.db2.gz MIFHTIDSIRZPHH-CQSZACIVSA-N 2 2 324.852 3.248 20 10 DGCDLP Oc1cc(O)c(C[N@@H+]([C@@H]2CC[NH2+]C2)C2CCCCC2)cc1Cl ZINC001236653713 1099725155 /nfs/dbraw/zinc/72/51/55/1099725155.db2.gz MIFHTIDSIRZPHH-CQSZACIVSA-N 2 2 324.852 3.248 20 10 DGCDLP Cc1cccc(C[NH+]2CC3(C2)CC[N@@H+](C2CCCC2)C3)c1O ZINC001276079682 1105010275 /nfs/dbraw/zinc/01/02/75/1105010275.db2.gz DKRVCELWUHUISC-UHFFFAOYSA-N 2 2 300.446 3.151 20 10 DGCDLP Cc1cccc(C[NH+]2CC3(C2)CC[N@H+](C2CCCC2)C3)c1O ZINC001276079682 1105010281 /nfs/dbraw/zinc/01/02/81/1105010281.db2.gz DKRVCELWUHUISC-UHFFFAOYSA-N 2 2 300.446 3.151 20 10 DGCDLP Cc1ccc(C[NH+]2CC3(C2)CC[N@@H+](C2CCCC2)C3)c(O)c1 ZINC001276168175 1105035422 /nfs/dbraw/zinc/03/54/22/1105035422.db2.gz BTIVHGREKDORRG-UHFFFAOYSA-N 2 2 300.446 3.151 20 10 DGCDLP Cc1ccc(C[NH+]2CC3(C2)CC[N@H+](C2CCCC2)C3)c(O)c1 ZINC001276168175 1105035429 /nfs/dbraw/zinc/03/54/29/1105035429.db2.gz BTIVHGREKDORRG-UHFFFAOYSA-N 2 2 300.446 3.151 20 10 DGCDLP CCC[NH+]1CCC(C[NH2+]Cc2cc(Cl)cc(F)c2O)CC1 ZINC001308253767 1111405258 /nfs/dbraw/zinc/40/52/58/1111405258.db2.gz JRZGLXCDNCTLPO-UHFFFAOYSA-N 2 2 314.832 3.396 20 10 DGCDLP C[C@H](Cn1cc[nH+]c1)[NH2+][C@@H](C)c1ccc(Br)cc1O ZINC000273301162 130105369 /nfs/dbraw/zinc/10/53/69/130105369.db2.gz BNHIOTSIZWRLKU-MNOVXSKESA-N 2 2 324.222 3.091 20 10 DGCDLP Cc1[nH+]ccn1CC[NH2+][C@H](C)c1ccc(Br)cc1O ZINC000273564544 130136446 /nfs/dbraw/zinc/13/64/46/130136446.db2.gz JBFATDUBZMAUSR-SNVBAGLBSA-N 2 2 324.222 3.010 20 10 DGCDLP CC[C@H]([NH2+]CCC[N@@H+]1CCCO[C@@H](C)C1)c1ccc(F)cc1O ZINC000287534719 288040290 /nfs/dbraw/zinc/04/02/90/288040290.db2.gz PCOKPDIZORSUQK-YOEHRIQHSA-N 2 2 324.440 3.073 20 10 DGCDLP CC[C@H]([NH2+]CCC[N@H+]1CCCO[C@@H](C)C1)c1ccc(F)cc1O ZINC000287534719 288040291 /nfs/dbraw/zinc/04/02/91/288040291.db2.gz PCOKPDIZORSUQK-YOEHRIQHSA-N 2 2 324.440 3.073 20 10 DGCDLP Cn1cc[nH+]c1[C@@H]1CC[N@H+](Cc2c(O)ccc3ccccc32)C1 ZINC000372880758 434860086 /nfs/dbraw/zinc/86/00/86/434860086.db2.gz LECIEJSRWNUTRU-OAHLLOKOSA-N 2 2 307.397 3.268 20 10 DGCDLP Cn1cc[nH+]c1[C@@H]1CC[N@@H+](Cc2c(O)ccc3ccccc32)C1 ZINC000372880758 434860089 /nfs/dbraw/zinc/86/00/89/434860089.db2.gz LECIEJSRWNUTRU-OAHLLOKOSA-N 2 2 307.397 3.268 20 10 DGCDLP Cc1ccc([C@@H](C)[NH2+][C@@H](CC[NH+](C)C)c2cccnc2)c(O)c1 ZINC000903379400 619768345 /nfs/dbraw/zinc/76/83/45/619768345.db2.gz GLAKDISMNUEMAK-QAPCUYQASA-N 2 2 313.445 3.439 20 10 DGCDLP C[N@@H+]1CCCC[C@@H](C[NH2+]Cc2c(O)ccc(Cl)c2F)C1 ZINC000858245035 621167903 /nfs/dbraw/zinc/16/79/03/621167903.db2.gz BADONDJGYYXMJF-NSHDSACASA-N 2 2 300.805 3.006 20 10 DGCDLP C[N@H+]1CCCC[C@@H](C[NH2+]Cc2c(O)ccc(Cl)c2F)C1 ZINC000858245035 621167905 /nfs/dbraw/zinc/16/79/05/621167905.db2.gz BADONDJGYYXMJF-NSHDSACASA-N 2 2 300.805 3.006 20 10 DGCDLP COc1cccc([C@@H](C)[NH2+]C[C@@H]2CC[N@@H+]2C2CCCC2)c1O ZINC000858531723 621202316 /nfs/dbraw/zinc/20/23/16/621202316.db2.gz JLUUDQDWUBRQFY-HIFRSBDPSA-N 2 2 304.434 3.068 20 10 DGCDLP COc1cccc([C@@H](C)[NH2+]C[C@@H]2CC[N@H+]2C2CCCC2)c1O ZINC000858531723 621202319 /nfs/dbraw/zinc/20/23/19/621202319.db2.gz JLUUDQDWUBRQFY-HIFRSBDPSA-N 2 2 304.434 3.068 20 10 DGCDLP C[C@@H]1C[C@H]([NH2+][C@H]2CC[N@@H+]3CCCC[C@H]23)c2c1c(F)ccc2O ZINC000756431630 621638091 /nfs/dbraw/zinc/63/80/91/621638091.db2.gz OHSBVKYHPKXZSW-UQOMUDLDSA-N 2 2 304.409 3.296 20 10 DGCDLP C[C@@H]1C[C@H]([NH2+][C@H]2CC[N@H+]3CCCC[C@H]23)c2c1c(F)ccc2O ZINC000756431630 621638093 /nfs/dbraw/zinc/63/80/93/621638093.db2.gz OHSBVKYHPKXZSW-UQOMUDLDSA-N 2 2 304.409 3.296 20 10 DGCDLP CC[C@H]([NH2+][C@@H]1CC[NH2+][C@H]1C)c1ccc(C(F)(F)F)cc1O ZINC000863546572 621682319 /nfs/dbraw/zinc/68/23/19/621682319.db2.gz LFXAZHNRCFKAJL-TVYUQYBPSA-N 2 2 302.340 3.202 20 10 DGCDLP CCN(C)c1ccc([C@@H](C)[NH2+][C@H]2CC[N@H+](CC3CC3)C2)cc1 ZINC000765873607 622292333 /nfs/dbraw/zinc/29/23/33/622292333.db2.gz OCNZLAROFHONSN-QAPCUYQASA-N 2 2 301.478 3.278 20 10 DGCDLP CCN(C)c1ccc([C@@H](C)[NH2+][C@H]2CC[N@@H+](CC3CC3)C2)cc1 ZINC000765873607 622292335 /nfs/dbraw/zinc/29/23/35/622292335.db2.gz OCNZLAROFHONSN-QAPCUYQASA-N 2 2 301.478 3.278 20 10 DGCDLP Oc1ccc(-c2ccccc2)cc1C[NH2+][C@H]1CCn2cc[nH+]c2C1 ZINC000778188745 623622188 /nfs/dbraw/zinc/62/21/88/623622188.db2.gz INGMDFADSUHGQH-SFHVURJKSA-N 2 2 319.408 3.360 20 10 DGCDLP C[NH+]1CCC2(CC1)CC[NH+](Cc1cccc(Cl)c1O)CC2 ZINC000877684828 623992067 /nfs/dbraw/zinc/99/20/67/623992067.db2.gz ZWVBBYSARKADJD-UHFFFAOYSA-N 2 2 308.853 3.353 20 10 DGCDLP C[N@@H+]1CCC[C@@H]1CC[NH+](Cc1ccco1)Cc1ccccc1O ZINC000128379268 624937353 /nfs/dbraw/zinc/93/73/53/624937353.db2.gz IYRJCENYOGDHKR-QGZVFWFLSA-N 2 2 314.429 3.472 20 10 DGCDLP C[N@H+]1CCC[C@@H]1CC[NH+](Cc1ccco1)Cc1ccccc1O ZINC000128379268 624937354 /nfs/dbraw/zinc/93/73/54/624937354.db2.gz IYRJCENYOGDHKR-QGZVFWFLSA-N 2 2 314.429 3.472 20 10 DGCDLP C[NH+]1CCC[C@@H]1CC[N@H+](Cc1ccco1)Cc1ccccc1O ZINC000128379268 624937355 /nfs/dbraw/zinc/93/73/55/624937355.db2.gz IYRJCENYOGDHKR-QGZVFWFLSA-N 2 2 314.429 3.472 20 10 DGCDLP C[NH+]1CCC[C@@H]1CC[N@@H+](Cc1ccco1)Cc1ccccc1O ZINC000128379268 624937357 /nfs/dbraw/zinc/93/73/57/624937357.db2.gz IYRJCENYOGDHKR-QGZVFWFLSA-N 2 2 314.429 3.472 20 10 DGCDLP C[C@H]1CCCC[N@@H+]1CCCC[NH2+]Cc1cc(F)cc(F)c1O ZINC000882892249 625848818 /nfs/dbraw/zinc/84/88/18/625848818.db2.gz RKNJSRVAOGVIMD-ZDUSSCGKSA-N 2 2 312.404 3.415 20 10 DGCDLP C[C@H]1CCCC[N@H+]1CCCC[NH2+]Cc1cc(F)cc(F)c1O ZINC000882892249 625848822 /nfs/dbraw/zinc/84/88/22/625848822.db2.gz RKNJSRVAOGVIMD-ZDUSSCGKSA-N 2 2 312.404 3.415 20 10 DGCDLP C[C@@H]([NH2+]Cc1cc(F)cc(F)c1O)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000883085166 625921543 /nfs/dbraw/zinc/92/15/43/625921543.db2.gz KGOKKKSHFVCPSP-CHWSQXEVSA-N 2 2 324.415 3.413 20 10 DGCDLP C[C@@H]([NH2+]Cc1cc(F)cc(F)c1O)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000883085166 625921548 /nfs/dbraw/zinc/92/15/48/625921548.db2.gz KGOKKKSHFVCPSP-CHWSQXEVSA-N 2 2 324.415 3.413 20 10 DGCDLP C[C@H]([NH2+]Cc1ncc(C[NH+](C)C)s1)c1ccc(N(C)C)cc1 ZINC000796351076 626041376 /nfs/dbraw/zinc/04/13/76/626041376.db2.gz DUXCMCRKKYHGIO-ZDUSSCGKSA-N 2 2 318.490 3.122 20 10 DGCDLP CCN(CC)c1ccc(C[N@H+](C)CCCn2cc[nH+]c2)cc1F ZINC000809752344 626946437 /nfs/dbraw/zinc/94/64/37/626946437.db2.gz BEIHAKJZKNDVIE-UHFFFAOYSA-N 2 2 318.440 3.391 20 10 DGCDLP CCN(CC)c1ccc(C[N@@H+](C)CCCn2cc[nH+]c2)cc1F ZINC000809752344 626946440 /nfs/dbraw/zinc/94/64/40/626946440.db2.gz BEIHAKJZKNDVIE-UHFFFAOYSA-N 2 2 318.440 3.391 20 10 DGCDLP Cc1cc(Cl)cc([C@H](C)[NH2+][C@@H]2CCc3[nH+]c[nH]c3C2)c1O ZINC000810252774 626993212 /nfs/dbraw/zinc/99/32/12/626993212.db2.gz JAGDGZACBXOBJP-CMPLNLGQSA-N 2 2 305.809 3.285 20 10 DGCDLP Cc1cc(C)c([C@@H](C)[NH2+]CCc2cn3c([nH+]2)CCCC3)c(O)c1 ZINC000815558409 627684861 /nfs/dbraw/zinc/68/48/61/627684861.db2.gz BVZWVCUVFUOMEC-OAHLLOKOSA-N 2 2 313.445 3.435 20 10 DGCDLP CC[C@H]([NH2+]C[C@H]1C[NH2+]CCC1(F)F)c1cccc(Cl)c1O ZINC000925779624 627793495 /nfs/dbraw/zinc/79/34/95/627793495.db2.gz YPOKQIRQSBSAOZ-MFKMUULPSA-N 2 2 318.795 3.331 20 10 DGCDLP C[C@@H](C[NH2+]Cc1cc(Cl)c(F)cc1O)C[NH+]1CCCCC1 ZINC000816536800 627803900 /nfs/dbraw/zinc/80/39/00/627803900.db2.gz KIQLLZAMDCYZNO-LBPRGKRZSA-N 2 2 314.832 3.396 20 10 DGCDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+]C2CCC(C(F)F)CC2)cc1 ZINC000817939863 627967198 /nfs/dbraw/zinc/96/71/98/627967198.db2.gz CTEOXDREYURWGN-XUJLQICISA-N 2 2 311.420 3.166 20 10 DGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+][C@@H]2CCc3c2cccc3F)cc1 ZINC000817938975 627967849 /nfs/dbraw/zinc/96/78/49/627967849.db2.gz WQVJFQPUHLHANZ-RTBURBONSA-N 2 2 313.420 3.169 20 10 DGCDLP Cc1ccc(O)c([C@@H](C)[NH2+]C[C@H]([NH3+])c2ccc(N(C)C)cc2)c1 ZINC000817940788 627968698 /nfs/dbraw/zinc/96/86/98/627968698.db2.gz HSXVBHSSCKEOEE-KDOFPFPSSA-N 2 2 313.445 3.117 20 10 DGCDLP CC(C)[C@H]([NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1)c1cccnc1 ZINC000817944143 627970109 /nfs/dbraw/zinc/97/01/09/627970109.db2.gz XOZWQGRAHZERDQ-OALUTQOASA-N 2 2 312.461 3.134 20 10 DGCDLP C[C@@H]([NH2+]C[C@H]1CCCC[NH2+]1)c1ccc(N2CCCCC2)cc1 ZINC000817945853 627970554 /nfs/dbraw/zinc/97/05/54/627970554.db2.gz NINLLWDPKPRFBX-SJLPKXTDSA-N 2 2 301.478 3.470 20 10 DGCDLP C[C@H]([NH2+][C@H]1CC[NH2+][C@H](C)C1)c1cccc(C(F)(F)F)c1O ZINC000817970895 627980310 /nfs/dbraw/zinc/98/03/10/627980310.db2.gz GVZLGZJOHYTVPK-VWYCJHECSA-N 2 2 302.340 3.202 20 10 DGCDLP CC[C@@H]([NH2+]C[C@@H]1C[C@H](F)C[NH2+]1)c1ccc(C(F)(F)F)cc1O ZINC000817976889 627981763 /nfs/dbraw/zinc/98/17/63/627981763.db2.gz WMFFOEIMFYCFQI-GMXVVIOVSA-N 2 2 320.330 3.152 20 10 DGCDLP CN(C)c1ccc(/C=C/C[NH+]2CCC(c3[nH]cc[nH+]3)CC2)cc1 ZINC000835029329 629829070 /nfs/dbraw/zinc/82/90/70/629829070.db2.gz WPBVOLOFWNDCDX-ONEGZZNKSA-N 2 2 310.445 3.369 20 10 DGCDLP CC[C@@H](C[NH2+]C/C=C/c1ccc(N(C)C)cc1)[NH+]1CCCC1 ZINC000835035929 629830695 /nfs/dbraw/zinc/83/06/95/629830695.db2.gz LQGOQYRKMCJNLK-DVBCCOPCSA-N 2 2 301.478 3.230 20 10 DGCDLP CN(C)c1ccc(C[NH2+]C[C@@H]2CCCC[NH2+]2)c(C(F)(F)F)c1 ZINC000841033167 630399448 /nfs/dbraw/zinc/39/94/48/630399448.db2.gz NZQAYIFWXNFMIX-ZDUSSCGKSA-N 2 2 315.383 3.003 20 10 DGCDLP CC(C)c1ccc([C@@H]([NH3+])C[NH2+]Cc2cc(F)ccc2O)cc1 ZINC000841034934 630400067 /nfs/dbraw/zinc/40/00/67/630400067.db2.gz FJJIGRHHHMEQMQ-KRWDZBQOSA-N 2 2 302.393 3.444 20 10 DGCDLP C[C@@H](C[NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1)Cc1ccccc1 ZINC000841046059 630401844 /nfs/dbraw/zinc/40/18/44/630401844.db2.gz VKGYTXBKICKYAK-OXQOHEQNSA-N 2 2 311.473 3.221 20 10 DGCDLP Cc1cccc(C[N@H+](Cc2ccccc2)[C@@H]2CCC[NH2+]C2)c1O ZINC000843051779 630609023 /nfs/dbraw/zinc/60/90/23/630609023.db2.gz DPGVNBBSAGCUID-LJQANCHMSA-N 2 2 310.441 3.455 20 10 DGCDLP Cc1cccc(C[N@@H+](Cc2ccccc2)[C@@H]2CCC[NH2+]C2)c1O ZINC000843051779 630609025 /nfs/dbraw/zinc/60/90/25/630609025.db2.gz DPGVNBBSAGCUID-LJQANCHMSA-N 2 2 310.441 3.455 20 10 DGCDLP C[NH2+]CCC1CC[NH+](Cc2cc(Cl)cc(F)c2O)CC1 ZINC000843057927 630610062 /nfs/dbraw/zinc/61/00/62/630610062.db2.gz ZFEZHACELXSIPE-UHFFFAOYSA-N 2 2 300.805 3.006 20 10 DGCDLP Oc1c(F)cc(Cl)cc1C[N@@H+]1CCC[C@H]([C@@H]2CC[NH2+]C2)C1 ZINC000843124624 630615936 /nfs/dbraw/zinc/61/59/36/630615936.db2.gz DQDSIGPUJYVFNU-NEPJUHHUSA-N 2 2 312.816 3.006 20 10 DGCDLP Oc1c(F)cc(Cl)cc1C[N@H+]1CCC[C@H]([C@@H]2CC[NH2+]C2)C1 ZINC000843124624 630615938 /nfs/dbraw/zinc/61/59/38/630615938.db2.gz DQDSIGPUJYVFNU-NEPJUHHUSA-N 2 2 312.816 3.006 20 10 DGCDLP C[C@@H]1CCC[N@H+](Cc2cc(Cl)cc(F)c2O)[C@@H]1CC[NH3+] ZINC000844902102 630970565 /nfs/dbraw/zinc/97/05/65/630970565.db2.gz NKKKRONGSYQLHW-QMTHXVAHSA-N 2 2 300.805 3.134 20 10 DGCDLP C[C@@H]1CCC[N@@H+](Cc2cc(Cl)cc(F)c2O)[C@@H]1CC[NH3+] ZINC000844902102 630970569 /nfs/dbraw/zinc/97/05/69/630970569.db2.gz NKKKRONGSYQLHW-QMTHXVAHSA-N 2 2 300.805 3.134 20 10 DGCDLP Oc1c(Cl)cccc1C[N@@H+]1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000849350532 631900501 /nfs/dbraw/zinc/90/05/01/631900501.db2.gz PHSNEZKGBNDTSC-AWEZNQCLSA-N 2 2 308.853 3.257 20 10 DGCDLP Oc1c(Cl)cccc1C[N@H+]1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000849350532 631900506 /nfs/dbraw/zinc/90/05/06/631900506.db2.gz PHSNEZKGBNDTSC-AWEZNQCLSA-N 2 2 308.853 3.257 20 10 DGCDLP COc1cc(C[NH2+][C@H](C)Cn2cc[nH+]c2)c(O)c(C(C)(C)C)c1 ZINC000850029947 632033726 /nfs/dbraw/zinc/03/37/26/632033726.db2.gz FRVSCMLEFWNLRE-CYBMUJFWSA-N 2 2 317.433 3.073 20 10 DGCDLP C[C@@H]([NH2+]CC1CC[NH+](CC2CC2)CC1)c1cc(F)cc(F)c1O ZINC000850580817 632200979 /nfs/dbraw/zinc/20/09/79/632200979.db2.gz BJVDWSQBVDSMTQ-GFCCVEGCSA-N 2 2 324.415 3.443 20 10 DGCDLP CC[C@@H]([NH2+][C@@H]1CC[N@H+](CC2CC2)C1)c1ccc(N(C)C)cc1 ZINC000157714756 659094086 /nfs/dbraw/zinc/09/40/86/659094086.db2.gz XFGLFFUEDXRNIC-IEBWSBKVSA-N 2 2 301.478 3.278 20 10 DGCDLP CC[C@@H]([NH2+][C@@H]1CC[N@@H+](CC2CC2)C1)c1ccc(N(C)C)cc1 ZINC000157714756 659094089 /nfs/dbraw/zinc/09/40/89/659094089.db2.gz XFGLFFUEDXRNIC-IEBWSBKVSA-N 2 2 301.478 3.278 20 10 DGCDLP C[C@H](C[NH+](C)C)[C@@H]1CCCC[N@@H+]1Cc1cc(F)cc(F)c1O ZINC001462463397 1182955916 /nfs/dbraw/zinc/95/59/16/1182955916.db2.gz VBQKJLZCGOHQJM-WBMJQRKESA-N 2 2 312.404 3.223 20 10 DGCDLP C[C@H](C[NH+](C)C)[C@@H]1CCCC[N@H+]1Cc1cc(F)cc(F)c1O ZINC001462463397 1182955927 /nfs/dbraw/zinc/95/59/27/1182955927.db2.gz VBQKJLZCGOHQJM-WBMJQRKESA-N 2 2 312.404 3.223 20 10 DGCDLP Cc1cc(N(C)C)ccc1C[NH+]1CCC(c2c[nH+]cn2C)CC1 ZINC001660237909 1196460519 /nfs/dbraw/zinc/46/05/19/1196460519.db2.gz DSNPFJVEJMJDPU-UHFFFAOYSA-N 2 2 312.461 3.174 20 10 DGCDLP C[C@@H]1C[C@@H](C)C[NH+](CCC[NH2+]Cc2cc(F)cc(F)c2O)C1 ZINC001660944790 1196544461 /nfs/dbraw/zinc/54/44/61/1196544461.db2.gz JDSQYVLLPBTTIV-CHWSQXEVSA-N 2 2 312.404 3.128 20 10 DGCDLP C[N@@H+]1CCC[C@H]2C[NH+](Cc3ccc(N4CCCCC4)cc3)C[C@@H]21 ZINC001138220674 1091120158 /nfs/dbraw/zinc/12/01/58/1091120158.db2.gz MAMSWYIXGVPVLI-ICSRJNTNSA-N 2 2 313.489 3.203 20 10 DGCDLP C[N@H+]1CCC[C@H]2C[NH+](Cc3ccc(N4CCCCC4)cc3)C[C@@H]21 ZINC001138220674 1091120165 /nfs/dbraw/zinc/12/01/65/1091120165.db2.gz MAMSWYIXGVPVLI-ICSRJNTNSA-N 2 2 313.489 3.203 20 10 DGCDLP C[NH+]1CCC[C@H]2C[N@H+](Cc3ccc(N4CCCCC4)cc3)C[C@@H]21 ZINC001138220674 1091120170 /nfs/dbraw/zinc/12/01/70/1091120170.db2.gz MAMSWYIXGVPVLI-ICSRJNTNSA-N 2 2 313.489 3.203 20 10 DGCDLP C[NH+]1CCC[C@H]2C[N@@H+](Cc3ccc(N4CCCCC4)cc3)C[C@@H]21 ZINC001138220674 1091120174 /nfs/dbraw/zinc/12/01/74/1091120174.db2.gz MAMSWYIXGVPVLI-ICSRJNTNSA-N 2 2 313.489 3.203 20 10 DGCDLP C[C@H]1CC[N@H+](Cc2cc(Cl)c(Cl)cc2O)C[C@H]1C[NH3+] ZINC001205314549 1091180517 /nfs/dbraw/zinc/18/05/17/1091180517.db2.gz BRPWNWKAFLBRRZ-GXSJLCMTSA-N 2 2 303.233 3.116 20 10 DGCDLP C[C@H]1CC[N@@H+](Cc2cc(Cl)c(Cl)cc2O)C[C@H]1C[NH3+] ZINC001205314549 1091180521 /nfs/dbraw/zinc/18/05/21/1091180521.db2.gz BRPWNWKAFLBRRZ-GXSJLCMTSA-N 2 2 303.233 3.116 20 10 DGCDLP C[C@@H]1C[NH2+]CC[N@H+](Cc2cc(Cl)c(C(C)(C)C)cc2O)C1 ZINC001206286778 1091564125 /nfs/dbraw/zinc/56/41/25/1091564125.db2.gz URMKUOKWVCWPCK-GFCCVEGCSA-N 2 2 310.869 3.384 20 10 DGCDLP COc1ccc(C[N@@H+]2CCC[C@@](C)(C[NH3+])CC2)c(O)c1Cl ZINC001206327463 1091581529 /nfs/dbraw/zinc/58/15/29/1091581529.db2.gz WRKOMLUZJWSVMK-MRXNPFEDSA-N 2 2 312.841 3.005 20 10 DGCDLP COc1ccc(C[N@H+]2CCC[C@@](C)(C[NH3+])CC2)c(O)c1Cl ZINC001206327463 1091581536 /nfs/dbraw/zinc/58/15/36/1091581536.db2.gz WRKOMLUZJWSVMK-MRXNPFEDSA-N 2 2 312.841 3.005 20 10 DGCDLP Oc1cc(F)c(F)cc1C[N@@H+]1CCCC[C@@]2(CCCC[NH2+]C2)C1 ZINC001222166638 1095471613 /nfs/dbraw/zinc/47/16/13/1095471613.db2.gz APMNPTADQVEGGE-GOSISDBHSA-N 2 2 324.415 3.416 20 10 DGCDLP Oc1cc(F)c(F)cc1C[N@H+]1CCCC[C@@]2(CCCC[NH2+]C2)C1 ZINC001222166638 1095471616 /nfs/dbraw/zinc/47/16/16/1095471616.db2.gz APMNPTADQVEGGE-GOSISDBHSA-N 2 2 324.415 3.416 20 10 DGCDLP COc1cc(O)c(C[N@@H+]2CCC[C@]3(CCC[NH2+]C3)C2)cc1Cl ZINC001222270982 1095522770 /nfs/dbraw/zinc/52/27/70/1095522770.db2.gz BOZCRPGQAXXSTE-KRWDZBQOSA-N 2 2 324.852 3.020 20 10 DGCDLP COc1cc(O)c(C[N@H+]2CCC[C@]3(CCC[NH2+]C3)C2)cc1Cl ZINC001222270982 1095522779 /nfs/dbraw/zinc/52/27/79/1095522779.db2.gz BOZCRPGQAXXSTE-KRWDZBQOSA-N 2 2 324.852 3.020 20 10 DGCDLP c1cc(N2CCCC2)ccc1C[N@@H+]1CCC[C@@]2(CCCC[NH2+]2)C1 ZINC001222385873 1095584627 /nfs/dbraw/zinc/58/46/27/1095584627.db2.gz YWSCJUQXVNWIQV-FQEVSTJZSA-N 2 2 313.489 3.395 20 10 DGCDLP c1cc(N2CCCC2)ccc1C[N@H+]1CCC[C@@]2(CCCC[NH2+]2)C1 ZINC001222385873 1095584634 /nfs/dbraw/zinc/58/46/34/1095584634.db2.gz YWSCJUQXVNWIQV-FQEVSTJZSA-N 2 2 313.489 3.395 20 10 DGCDLP C[N@@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1Cc1cccc(F)c1O ZINC001138128357 1095901487 /nfs/dbraw/zinc/90/14/87/1095901487.db2.gz FLIANHQVQQHFHI-HOTGVXAUSA-N 2 2 306.425 3.370 20 10 DGCDLP C[N@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1Cc1cccc(F)c1O ZINC001138128357 1095901495 /nfs/dbraw/zinc/90/14/95/1095901495.db2.gz FLIANHQVQQHFHI-HOTGVXAUSA-N 2 2 306.425 3.370 20 10 DGCDLP C[NH+]1CCC[C@H]1C[C@@H]1CCCC[N@@H+]1Cc1cccc(F)c1O ZINC001138128357 1095901502 /nfs/dbraw/zinc/90/15/02/1095901502.db2.gz FLIANHQVQQHFHI-HOTGVXAUSA-N 2 2 306.425 3.370 20 10 DGCDLP Cc1cc(C)c(C[NH+]2CCC(Oc3cc[nH+]cc3)CC2)c(O)c1 ZINC001231841953 1097860440 /nfs/dbraw/zinc/86/04/40/1097860440.db2.gz HZTNNDFSOPEGDA-UHFFFAOYSA-N 2 2 312.413 3.447 20 10 DGCDLP Cc1cc(O)c(C[NH+]2CCC([NH+]3CCCC3)CC2)cc1Cl ZINC001231869244 1097870221 /nfs/dbraw/zinc/87/02/21/1097870221.db2.gz NJIHHKLIXCFQJP-UHFFFAOYSA-N 2 2 308.853 3.414 20 10 DGCDLP C[N@H+](CCC[NH+]1CCCC1)Cc1cccc(C(F)(F)F)c1O ZINC001233418236 1098324201 /nfs/dbraw/zinc/32/42/01/1098324201.db2.gz YLCJCQRYNLWXPJ-UHFFFAOYSA-N 2 2 316.367 3.329 20 10 DGCDLP C[N@@H+](CCC[NH+]1CCCC1)Cc1cccc(C(F)(F)F)c1O ZINC001233418236 1098324209 /nfs/dbraw/zinc/32/42/09/1098324209.db2.gz YLCJCQRYNLWXPJ-UHFFFAOYSA-N 2 2 316.367 3.329 20 10 DGCDLP CC(C)(C)c1ccc(O)c(C[N@@H+]2CCCC[C@]23CC[NH2+]C3)c1 ZINC001235116153 1098815545 /nfs/dbraw/zinc/81/55/45/1098815545.db2.gz DSWPSRQNHLBIEL-LJQANCHMSA-N 2 2 302.462 3.408 20 10 DGCDLP CC(C)(C)c1ccc(O)c(C[N@H+]2CCCC[C@]23CC[NH2+]C3)c1 ZINC001235116153 1098815557 /nfs/dbraw/zinc/81/55/57/1098815557.db2.gz DSWPSRQNHLBIEL-LJQANCHMSA-N 2 2 302.462 3.408 20 10 DGCDLP CC(C)[N@H+](CC[NH3+])Cc1ccc(OCc2ccccc2)cc1O ZINC001235948151 1099281088 /nfs/dbraw/zinc/28/10/88/1099281088.db2.gz VFXQGIBXFHPVSQ-UHFFFAOYSA-N 2 2 314.429 3.140 20 10 DGCDLP CC(C)[N@@H+](CC[NH3+])Cc1ccc(OCc2ccccc2)cc1O ZINC001235948151 1099281095 /nfs/dbraw/zinc/28/10/95/1099281095.db2.gz VFXQGIBXFHPVSQ-UHFFFAOYSA-N 2 2 314.429 3.140 20 10 DGCDLP CC[N@H+](Cc1cc(-c2ccc(F)cc2)ccc1O)[C@H]1CC[NH2+]C1 ZINC001235973619 1099301431 /nfs/dbraw/zinc/30/14/31/1099301431.db2.gz DTCKRTPROAWGKG-SFHVURJKSA-N 2 2 314.404 3.382 20 10 DGCDLP CC[N@@H+](Cc1cc(-c2ccc(F)cc2)ccc1O)[C@H]1CC[NH2+]C1 ZINC001235973619 1099301443 /nfs/dbraw/zinc/30/14/43/1099301443.db2.gz DTCKRTPROAWGKG-SFHVURJKSA-N 2 2 314.404 3.382 20 10 DGCDLP CCN(CC)c1ccc(C[N@H+](C)[C@@H]2CCCC[C@H]2[NH3+])c(OC)c1 ZINC001236219422 1099475419 /nfs/dbraw/zinc/47/54/19/1099475419.db2.gz VZMSYPYNDVYDIZ-QZTJIDSGSA-N 2 2 319.493 3.243 20 10 DGCDLP CCN(CC)c1ccc(C[N@@H+](C)[C@@H]2CCCC[C@H]2[NH3+])c(OC)c1 ZINC001236219422 1099475424 /nfs/dbraw/zinc/47/54/24/1099475424.db2.gz VZMSYPYNDVYDIZ-QZTJIDSGSA-N 2 2 319.493 3.243 20 10 DGCDLP C[N@@H+]1CC[C@@H]2C[NH+](Cc3cc(Cl)c(Cl)cc3O)C[C@@H]2C1 ZINC001236790959 1099787071 /nfs/dbraw/zinc/78/70/71/1099787071.db2.gz WUZBVSAIPOXSIE-PWSUYJOCSA-N 2 2 315.244 3.083 20 10 DGCDLP C[N@H+]1CC[C@@H]2C[NH+](Cc3cc(Cl)c(Cl)cc3O)C[C@@H]2C1 ZINC001236790959 1099787078 /nfs/dbraw/zinc/78/70/78/1099787078.db2.gz WUZBVSAIPOXSIE-PWSUYJOCSA-N 2 2 315.244 3.083 20 10 DGCDLP C[NH+]1CC[C@@H]2C[N@H+](Cc3cc(Cl)c(Cl)cc3O)C[C@@H]2C1 ZINC001236790959 1099787085 /nfs/dbraw/zinc/78/70/85/1099787085.db2.gz WUZBVSAIPOXSIE-PWSUYJOCSA-N 2 2 315.244 3.083 20 10 DGCDLP C[NH+]1CC[C@@H]2C[N@@H+](Cc3cc(Cl)c(Cl)cc3O)C[C@@H]2C1 ZINC001236790959 1099787094 /nfs/dbraw/zinc/78/70/94/1099787094.db2.gz WUZBVSAIPOXSIE-PWSUYJOCSA-N 2 2 315.244 3.083 20 10 DGCDLP CC[NH+]1CCC([N@H+](C)Cc2cc(F)c(Cl)cc2O)CC1 ZINC001237935922 1100296580 /nfs/dbraw/zinc/29/65/80/1100296580.db2.gz GXICPYFTKDZLGC-UHFFFAOYSA-N 2 2 300.805 3.101 20 10 DGCDLP CC[NH+]1CCC([N@@H+](C)Cc2cc(F)c(Cl)cc2O)CC1 ZINC001237935922 1100296585 /nfs/dbraw/zinc/29/65/85/1100296585.db2.gz GXICPYFTKDZLGC-UHFFFAOYSA-N 2 2 300.805 3.101 20 10 DGCDLP Cc1cc(C)c(O)c2c1CC(C)(C)[C@H]2[NH2+][C@@H]1CC[C@@H](C)[NH2+]C1 ZINC001246525855 1104578135 /nfs/dbraw/zinc/57/81/35/1104578135.db2.gz OJAFNCRIJAZNFW-LBTNJELSSA-N 2 2 302.462 3.363 20 10 DGCDLP Cc1cc(O)c(C[NH+]2CCC(c3c[nH+]cn3C)CC2)cc1Cl ZINC001308982804 1111504388 /nfs/dbraw/zinc/50/43/88/1111504388.db2.gz GXIRHMQQNQDIGY-UHFFFAOYSA-N 2 2 319.836 3.467 20 10 DGCDLP CCCOc1ccc(C[NH+]2CCC(n3cc[nH+]c3)CC2)c(O)c1 ZINC000092648830 185331539 /nfs/dbraw/zinc/33/15/39/185331539.db2.gz YLTJFPUSBGNMLQ-UHFFFAOYSA-N 2 2 315.417 3.215 20 10 DGCDLP C[NH+]1CCC([N@H+](Cc2ccco2)Cc2cc(F)ccc2O)CC1 ZINC000290599134 433114604 /nfs/dbraw/zinc/11/46/04/433114604.db2.gz VTSZHDBYUPCNRW-UHFFFAOYSA-N 2 2 318.392 3.221 20 10 DGCDLP C[NH+]1CCC([N@@H+](Cc2ccco2)Cc2cc(F)ccc2O)CC1 ZINC000290599134 433114612 /nfs/dbraw/zinc/11/46/12/433114612.db2.gz VTSZHDBYUPCNRW-UHFFFAOYSA-N 2 2 318.392 3.221 20 10 DGCDLP Cc1[nH+]ccn1CCCC[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000293640361 433809899 /nfs/dbraw/zinc/80/98/99/433809899.db2.gz NYRPTOQWLNXQIQ-UHFFFAOYSA-N 2 2 311.788 3.260 20 10 DGCDLP CC[C@@H]([NH2+]CCC[N@H+](C)CCOC)c1cccc(Cl)c1O ZINC000287899367 535803592 /nfs/dbraw/zinc/80/35/92/535803592.db2.gz ZMPVTFBDSGDCPZ-OAHLLOKOSA-N 2 2 314.857 3.055 20 10 DGCDLP CC[C@@H]([NH2+]CCC[N@@H+](C)CCOC)c1cccc(Cl)c1O ZINC000287899367 535803593 /nfs/dbraw/zinc/80/35/93/535803593.db2.gz ZMPVTFBDSGDCPZ-OAHLLOKOSA-N 2 2 314.857 3.055 20 10 DGCDLP Cc1ccc(O)c(C[NH2+]Cc2ccccc2Cn2cc[nH+]c2)c1 ZINC000733324358 574615558 /nfs/dbraw/zinc/61/55/58/574615558.db2.gz RLXRGGRVIHYLLD-UHFFFAOYSA-N 2 2 307.397 3.235 20 10 DGCDLP Cc1[nH+]cc(C[NH2+]Cc2cc(C)ccc2O)n1-c1ccccc1 ZINC000742709620 575014105 /nfs/dbraw/zinc/01/41/05/575014105.db2.gz KZYLLDQUZGCJDK-UHFFFAOYSA-N 2 2 307.397 3.485 20 10 DGCDLP COc1cccc(C[NH2+]Cc2c[nH+]c(C)n2-c2ccccc2)c1O ZINC000742709450 575014177 /nfs/dbraw/zinc/01/41/77/575014177.db2.gz GNHQJBJUSQFBTQ-UHFFFAOYSA-N 2 2 323.396 3.185 20 10 DGCDLP Oc1ccc(-c2ccccc2)cc1C[NH2+]CCCn1cc[nH+]c1 ZINC000725841385 575926769 /nfs/dbraw/zinc/92/67/69/575926769.db2.gz CZYFXMNVVSWLEZ-UHFFFAOYSA-N 2 2 307.397 3.436 20 10 DGCDLP C[C@@H]([NH2+]C[C@H]1CCC[N@@H+]1C)c1ccc(N2CCCCC2)cc1 ZINC000154507232 620682825 /nfs/dbraw/zinc/68/28/25/620682825.db2.gz UEEFAXXTFZTOBU-VQIMIIECSA-N 2 2 301.478 3.422 20 10 DGCDLP C[C@@H]([NH2+]C[C@H]1CCC[N@H+]1C)c1ccc(N2CCCCC2)cc1 ZINC000154507232 620682827 /nfs/dbraw/zinc/68/28/27/620682827.db2.gz UEEFAXXTFZTOBU-VQIMIIECSA-N 2 2 301.478 3.422 20 10 DGCDLP Cc1cccc(O)c1CN(c1cccc[nH+]1)[C@H]1CC[C@H]([NH3+])CC1 ZINC000895111204 618539983 /nfs/dbraw/zinc/53/99/83/618539983.db2.gz BRFCCJKRRMQYFM-WKILWMFISA-N 2 2 311.429 3.372 20 10 DGCDLP C[C@H]([NH2+][C@@H](CC[NH+](C)C)c1cccnc1)c1cc(F)ccc1O ZINC000903381875 619769081 /nfs/dbraw/zinc/76/90/81/619769081.db2.gz ZJUPOCXANYVBII-GUYCJALGSA-N 2 2 317.408 3.270 20 10 DGCDLP Cc1[nH+]ccn1CCCC[NH2+][C@@H](C)c1cc(F)cc(F)c1O ZINC000756597478 621651857 /nfs/dbraw/zinc/65/18/57/621651857.db2.gz NKRULGXDCNIDQA-NSHDSACASA-N 2 2 309.360 3.306 20 10 DGCDLP C[C@@H]([NH2+]CC[C@@H]([NH3+])Cc1ccccc1)c1cc(F)cc(F)c1O ZINC000873235257 623085903 /nfs/dbraw/zinc/08/59/03/623085903.db2.gz MXXLIQPANHCAPB-IUODEOHRSA-N 2 2 320.383 3.281 20 10 DGCDLP C[C@@H]([NH2+]Cc1ccccc1Cn1cc[nH+]c1)c1ccccc1O ZINC000783498864 624359294 /nfs/dbraw/zinc/35/92/94/624359294.db2.gz JKZZBTYWEIWJLV-OAHLLOKOSA-N 2 2 307.397 3.488 20 10 DGCDLP c1cn(C[C@H]([NH2+]Cc2ccc3c(c2)CCO3)c2ccccc2)c[nH+]1 ZINC000883398257 626673013 /nfs/dbraw/zinc/67/30/13/626673013.db2.gz HZNWTFICDXOJCU-IBGZPJMESA-N 2 2 319.408 3.349 20 10 DGCDLP C[C@@H]([NH2+][C@H](Cn1cc[nH+]c1)C(C)(C)C)c1c(O)cccc1F ZINC000886509029 627154481 /nfs/dbraw/zinc/15/44/81/627154481.db2.gz XWCOPKKRIAKOCZ-IUODEOHRSA-N 2 2 305.397 3.493 20 10 DGCDLP CC[N@@H+]1CC[C@H](C[NH2+][C@H](C)c2cccc(C(F)(F)F)c2O)C1 ZINC000815560718 627685146 /nfs/dbraw/zinc/68/51/46/627685146.db2.gz NYFNUEYFTAZFIK-VXGBXAGGSA-N 2 2 316.367 3.403 20 10 DGCDLP CC[N@H+]1CC[C@H](C[NH2+][C@H](C)c2cccc(C(F)(F)F)c2O)C1 ZINC000815560718 627685150 /nfs/dbraw/zinc/68/51/50/627685150.db2.gz NYFNUEYFTAZFIK-VXGBXAGGSA-N 2 2 316.367 3.403 20 10 DGCDLP CC(C)C[NH+]1CCC([NH2+]Cc2cc(Cl)c(F)cc2O)CC1 ZINC000816533567 627803449 /nfs/dbraw/zinc/80/34/49/627803449.db2.gz BDPAXJBKZSWFFC-UHFFFAOYSA-N 2 2 314.832 3.395 20 10 DGCDLP CC(C)[N@@H+]1CC[C@H](C[NH2+]Cc2cc(Cl)c(F)cc2O)C1 ZINC000816610373 627814720 /nfs/dbraw/zinc/81/47/20/627814720.db2.gz IMOVWLNFWMDZOU-LLVKDONJSA-N 2 2 300.805 3.005 20 10 DGCDLP CC(C)[N@H+]1CC[C@H](C[NH2+]Cc2cc(Cl)c(F)cc2O)C1 ZINC000816610373 627814721 /nfs/dbraw/zinc/81/47/21/627814721.db2.gz IMOVWLNFWMDZOU-LLVKDONJSA-N 2 2 300.805 3.005 20 10 DGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+]Cc2cccc(C3CC3)c2)cc1 ZINC000817864417 627951057 /nfs/dbraw/zinc/95/10/57/627951057.db2.gz GTYPFISKDQYKKC-HXUWFJFHSA-N 2 2 309.457 3.420 20 10 DGCDLP COc1ccc([C@H](C)[NH2+]C[C@H]([NH3+])c2ccc(N(C)C)cc2)cc1 ZINC000817938362 627966597 /nfs/dbraw/zinc/96/65/97/627966597.db2.gz JKJVGUQYRRGWMK-LIRRHRJNSA-N 2 2 313.445 3.112 20 10 DGCDLP C[C@@H]([NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1)c1ccc(F)c(F)c1 ZINC000817938170 627966750 /nfs/dbraw/zinc/96/67/50/627966750.db2.gz GABVGLMDLRQUFL-XIKOKIGWSA-N 2 2 319.399 3.381 20 10 DGCDLP Cc1ccc2c(c1)CC[C@@H]2[NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000817938557 627966883 /nfs/dbraw/zinc/96/68/83/627966883.db2.gz MZMAICANSUOCOG-UXHICEINSA-N 2 2 309.457 3.338 20 10 DGCDLP C[C@H]([NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1)c1cccc(F)c1 ZINC000817938793 627967376 /nfs/dbraw/zinc/96/73/76/627967376.db2.gz SLMGXSZXBPVSCA-SCLBCKFNSA-N 2 2 301.409 3.242 20 10 DGCDLP Cc1ccsc1[C@@H](C)[NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000817938953 627967594 /nfs/dbraw/zinc/96/75/94/627967594.db2.gz WFFPNQSMCIZVLV-CJNGLKHVSA-N 2 2 303.475 3.473 20 10 DGCDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+][C@@H](Cc2ccccc2)C2CC2)cc1 ZINC000817941904 627968343 /nfs/dbraw/zinc/96/83/43/627968343.db2.gz LRISUMWKTLYADD-SFTDATJTSA-N 2 2 323.484 3.363 20 10 DGCDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+][C@H](Cc2ccccc2)C2CC2)cc1 ZINC000817941898 627968362 /nfs/dbraw/zinc/96/83/62/627968362.db2.gz LRISUMWKTLYADD-LEWJYISDSA-N 2 2 323.484 3.363 20 10 DGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+][C@@H](C2CC2)C2CCCC2)cc1 ZINC000817940877 627968797 /nfs/dbraw/zinc/96/87/97/627968797.db2.gz LTNCDPAEQNGLAX-RTBURBONSA-N 2 2 301.478 3.311 20 10 DGCDLP C[C@H]([NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1)c1ccc(Cl)nc1 ZINC000817944300 627969917 /nfs/dbraw/zinc/96/99/17/627969917.db2.gz ZASUBBGCJZSUED-LRDDRELGSA-N 2 2 318.852 3.152 20 10 DGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+][C@@H](c2cccnc2)C2CCC2)cc1 ZINC000817943263 627970033 /nfs/dbraw/zinc/97/00/33/627970033.db2.gz SXJZCELRPOIATI-WOJBJXKFSA-N 2 2 324.472 3.278 20 10 DGCDLP Oc1ccccc1[C@@H](CCc1ccccc1)[NH2+]CC[NH2+]C1CC1 ZINC000817953355 627973687 /nfs/dbraw/zinc/97/36/87/627973687.db2.gz LDRPMVIVCWTVBI-LJQANCHMSA-N 2 2 310.441 3.408 20 10 DGCDLP CCCC[C@H](C[NH3+])[NH2+][C@H](C)c1cc(Br)ccc1O ZINC000817961682 627976938 /nfs/dbraw/zinc/97/69/38/627976938.db2.gz CGVNXSPYRLWYEF-ZYHUDNBSSA-N 2 2 315.255 3.323 20 10 DGCDLP CCC[NH2+]CC[NH2+][C@@H](CC)c1cc(Br)ccc1O ZINC000817961884 627977166 /nfs/dbraw/zinc/97/71/66/627977166.db2.gz FTJDKOIXXBDMOJ-ZDUSSCGKSA-N 2 2 315.255 3.195 20 10 DGCDLP Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@@H]1C[C@@H](C)[N@@H+](C2CC2)C1 ZINC000840893390 630373868 /nfs/dbraw/zinc/37/38/68/630373868.db2.gz IYDKLYWBNNTDJG-LZLYRXPVSA-N 2 2 315.505 3.207 20 10 DGCDLP Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@@H]1C[C@@H](C)[N@H+](C2CC2)C1 ZINC000840893390 630373870 /nfs/dbraw/zinc/37/38/70/630373870.db2.gz IYDKLYWBNNTDJG-LZLYRXPVSA-N 2 2 315.505 3.207 20 10 DGCDLP CCCC[C@@H](C[NH3+])[NH2+]Cc1cc(C)cc(Br)c1O ZINC000841030760 630398450 /nfs/dbraw/zinc/39/84/50/630398450.db2.gz QKROSDLOAJVPMZ-LBPRGKRZSA-N 2 2 315.255 3.070 20 10 DGCDLP CN(C)c1ccc(C[NH2+]C[C@H]2CCCC[NH2+]2)c(C(F)(F)F)c1 ZINC000841033166 630398915 /nfs/dbraw/zinc/39/89/15/630398915.db2.gz NZQAYIFWXNFMIX-CYBMUJFWSA-N 2 2 315.383 3.003 20 10 DGCDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+]Cc2ccc(Cl)cc2)cc1 ZINC000841041441 630400708 /nfs/dbraw/zinc/40/07/08/630400708.db2.gz CGDVKHRNEWEMKN-KRWDZBQOSA-N 2 2 303.837 3.196 20 10 DGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+]CC(C)(C)c2ccccc2)cc1 ZINC000841044971 630401102 /nfs/dbraw/zinc/40/11/02/630401102.db2.gz HCAZYGAUFCDAIL-LJQANCHMSA-N 2 2 311.473 3.320 20 10 DGCDLP C[C@@H](Cc1ccsc1)[NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000841044742 630401177 /nfs/dbraw/zinc/40/11/77/630401177.db2.gz FKMSMFDWWMHEBS-GUYCJALGSA-N 2 2 303.475 3.035 20 10 DGCDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+]Cc2ccnc3ccccc23)cc1 ZINC000841042834 630401191 /nfs/dbraw/zinc/40/11/91/630401191.db2.gz LOWIBFWZHJKERU-IBGZPJMESA-N 2 2 320.440 3.090 20 10 DGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+]C/C=C/c2ccc(F)cc2)cc1 ZINC000841046053 630401886 /nfs/dbraw/zinc/40/18/86/630401886.db2.gz VJYDAJFRUILBEW-GNAXCBTBSA-N 2 2 313.420 3.195 20 10 DGCDLP CN(C)c1ccc(C[NH2+][C@@H]2CCCC[NH2+]C2)c(C(F)(F)F)c1 ZINC000841089682 630406625 /nfs/dbraw/zinc/40/66/25/630406625.db2.gz JSEMDQDGOVVVKE-CYBMUJFWSA-N 2 2 315.383 3.003 20 10 DGCDLP CN(C)c1ccc(C[N@H+](C)C2(C[NH3+])CCC2)c(C(F)(F)F)c1 ZINC000843124755 630616374 /nfs/dbraw/zinc/61/63/74/630616374.db2.gz GCHWJXJNRYIUSM-UHFFFAOYSA-N 2 2 315.383 3.085 20 10 DGCDLP CN(C)c1ccc(C[N@@H+](C)C2(C[NH3+])CCC2)c(C(F)(F)F)c1 ZINC000843124755 630616375 /nfs/dbraw/zinc/61/63/75/630616375.db2.gz GCHWJXJNRYIUSM-UHFFFAOYSA-N 2 2 315.383 3.085 20 10 DGCDLP Oc1c(Cl)cccc1C[N@@H+]1CCC[C@@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000843126300 630616446 /nfs/dbraw/zinc/61/64/46/630616446.db2.gz ICKNULNJBMIEQK-ZIAGYGMSSA-N 2 2 308.853 3.257 20 10 DGCDLP Oc1c(Cl)cccc1C[N@H+]1CCC[C@@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000843126300 630616447 /nfs/dbraw/zinc/61/64/47/630616447.db2.gz ICKNULNJBMIEQK-ZIAGYGMSSA-N 2 2 308.853 3.257 20 10 DGCDLP c1cc(N2CCCC2)ccc1C[NH2+][C@H]1CCC[N@@H+]2CCCC[C@H]12 ZINC000848575881 631701676 /nfs/dbraw/zinc/70/16/76/631701676.db2.gz XMVZTKJLJUCHBS-VQTJNVASSA-N 2 2 313.489 3.393 20 10 DGCDLP c1cc(N2CCCC2)ccc1C[NH2+][C@H]1CCC[N@H+]2CCCC[C@H]12 ZINC000848575881 631701680 /nfs/dbraw/zinc/70/16/80/631701680.db2.gz XMVZTKJLJUCHBS-VQTJNVASSA-N 2 2 313.489 3.393 20 10 DGCDLP Oc1ccc(Cl)cc1C[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000246867659 655536521 /nfs/dbraw/zinc/53/65/21/655536521.db2.gz SOPIYSCLJJLXOC-SUMWQHHRSA-N 2 2 320.864 3.494 20 10 DGCDLP Oc1ccc(Cl)cc1C[N@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000246867659 655536523 /nfs/dbraw/zinc/53/65/23/655536523.db2.gz SOPIYSCLJJLXOC-SUMWQHHRSA-N 2 2 320.864 3.494 20 10 DGCDLP Oc1ccc(Cl)cc1C[NH+]1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000246867659 655536525 /nfs/dbraw/zinc/53/65/25/655536525.db2.gz SOPIYSCLJJLXOC-SUMWQHHRSA-N 2 2 320.864 3.494 20 10 DGCDLP Oc1ccc(Cl)cc1C[NH+]1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000246867659 655536527 /nfs/dbraw/zinc/53/65/27/655536527.db2.gz SOPIYSCLJJLXOC-SUMWQHHRSA-N 2 2 320.864 3.494 20 10 DGCDLP COc1ccc(O)c([C@H](C)[NH2+][C@H](Cn2cc[nH+]c2)C(C)(C)C)c1 ZINC000319981730 657304267 /nfs/dbraw/zinc/30/42/67/657304267.db2.gz JRGMCEMQTDUTHG-SUMWQHHRSA-N 2 2 317.433 3.363 20 10 DGCDLP Oc1ccc(Cl)cc1C[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000092066532 662327633 /nfs/dbraw/zinc/32/76/33/662327633.db2.gz SOPIYSCLJJLXOC-CXAGYDPISA-N 2 2 320.864 3.494 20 10 DGCDLP Oc1ccc(Cl)cc1C[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000092066532 662327635 /nfs/dbraw/zinc/32/76/35/662327635.db2.gz SOPIYSCLJJLXOC-CXAGYDPISA-N 2 2 320.864 3.494 20 10 DGCDLP Oc1ccc(Cl)cc1C[NH+]1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000092066532 662327639 /nfs/dbraw/zinc/32/76/39/662327639.db2.gz SOPIYSCLJJLXOC-CXAGYDPISA-N 2 2 320.864 3.494 20 10 DGCDLP Oc1ccc(Cl)cc1C[NH+]1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000092066532 662327641 /nfs/dbraw/zinc/32/76/41/662327641.db2.gz SOPIYSCLJJLXOC-CXAGYDPISA-N 2 2 320.864 3.494 20 10 DGCDLP Oc1c(F)cc(F)cc1C[NH2+]CCCCC[NH+]1CCCCC1 ZINC001200114062 1180386159 /nfs/dbraw/zinc/38/61/59/1180386159.db2.gz FWYRDWXQTKOYLB-UHFFFAOYSA-N 2 2 312.404 3.416 20 10 DGCDLP CN(C)c1ccc(/C=C/C[NH2+]C[C@H]2CCCC[N@@H+]2C2CC2)cc1 ZINC001474137482 1183872887 /nfs/dbraw/zinc/87/28/87/1183872887.db2.gz FRXQDLGPWIGAFP-RRFGBZISSA-N 2 2 313.489 3.372 20 10 DGCDLP CN(C)c1ccc(/C=C/C[NH2+]C[C@H]2CCCC[N@H+]2C2CC2)cc1 ZINC001474137482 1183872891 /nfs/dbraw/zinc/87/28/91/1183872891.db2.gz FRXQDLGPWIGAFP-RRFGBZISSA-N 2 2 313.489 3.372 20 10 DGCDLP CC[N@@H+]1CCC[C@H]([NH2+][C@H](C)Cc2ccc(N(C)C)cc2C)C1 ZINC001621396665 1193837226 /nfs/dbraw/zinc/83/72/26/1193837226.db2.gz PNAVXYNQUDEUSE-AEFFLSMTSA-N 2 2 303.494 3.066 20 10 DGCDLP CC[N@H+]1CCC[C@H]([NH2+][C@H](C)Cc2ccc(N(C)C)cc2C)C1 ZINC001621396665 1193837231 /nfs/dbraw/zinc/83/72/31/1193837231.db2.gz PNAVXYNQUDEUSE-AEFFLSMTSA-N 2 2 303.494 3.066 20 10 DGCDLP CC[N@@H+]1CCC[C@@H]([NH2+][C@H](C)Cc2ccc(N(C)C)cc2C)C1 ZINC001621396667 1193837983 /nfs/dbraw/zinc/83/79/83/1193837983.db2.gz PNAVXYNQUDEUSE-SJLPKXTDSA-N 2 2 303.494 3.066 20 10 DGCDLP CC[N@H+]1CCC[C@@H]([NH2+][C@H](C)Cc2ccc(N(C)C)cc2C)C1 ZINC001621396667 1193837984 /nfs/dbraw/zinc/83/79/84/1193837984.db2.gz PNAVXYNQUDEUSE-SJLPKXTDSA-N 2 2 303.494 3.066 20 10 DGCDLP CC(C)[N@@H+]1CCC[C@@H](C[NH2+]Cc2cc(Cl)cc(F)c2O)C1 ZINC001661351178 1196597039 /nfs/dbraw/zinc/59/70/39/1196597039.db2.gz MSRRZMNSRJXQLR-LBPRGKRZSA-N 2 2 314.832 3.395 20 10 DGCDLP CC(C)[N@H+]1CCC[C@@H](C[NH2+]Cc2cc(Cl)cc(F)c2O)C1 ZINC001661351178 1196597040 /nfs/dbraw/zinc/59/70/40/1196597040.db2.gz MSRRZMNSRJXQLR-LBPRGKRZSA-N 2 2 314.832 3.395 20 10 DGCDLP C[NH+](C)CC[C@H]([NH2+]Cc1cc(F)cc(F)c1O)C(C)(C)C ZINC001661416114 1196603668 /nfs/dbraw/zinc/60/36/68/1196603668.db2.gz JPRFEHIPHRTDQC-AWEZNQCLSA-N 2 2 300.393 3.126 20 10 DGCDLP C[C@@]1(C[NH3+])CCC[N@H+](Cc2c(O)ccc(Cl)c2Cl)C1 ZINC001237082551 1099962423 /nfs/dbraw/zinc/96/24/23/1099962423.db2.gz RDXPPARZVWTLCU-AWEZNQCLSA-N 2 2 303.233 3.260 20 10 DGCDLP C[C@@]1(C[NH3+])CCC[N@@H+](Cc2c(O)ccc(Cl)c2Cl)C1 ZINC001237082551 1099962434 /nfs/dbraw/zinc/96/24/34/1099962434.db2.gz RDXPPARZVWTLCU-AWEZNQCLSA-N 2 2 303.233 3.260 20 10 DGCDLP [NH3+][C@H](c1ccccc1O)[C@H]([NH2+][C@@H]1C[C@H]2C[C@H]2C1)c1ccccc1O ZINC001167915125 1084655234 /nfs/dbraw/zinc/65/52/34/1084655234.db2.gz ZQWDATIECIIJAA-MMFWEMPGSA-N 2 2 324.424 3.227 20 10 DGCDLP Cn1c[nH+]cc1-c1cccc(N2C[C@H]([NH3+])Cc3ccccc32)c1 ZINC001162853344 1089992373 /nfs/dbraw/zinc/99/23/73/1089992373.db2.gz HXSIDKJQSRHEID-MRXNPFEDSA-N 2 2 304.397 3.109 20 10 DGCDLP Cc1ccc(C)c(C[NH+]2CCC(Oc3cc[nH+]cc3)CC2)c1O ZINC001140178203 1091792208 /nfs/dbraw/zinc/79/22/08/1091792208.db2.gz CHORKAHDUSNAOU-UHFFFAOYSA-N 2 2 312.413 3.447 20 10 DGCDLP Cc1ccc(C)c(C[N@H+]2CC[C@@H](Oc3cc[nH+]cc3C)C2)c1O ZINC001140185034 1091795139 /nfs/dbraw/zinc/79/51/39/1091795139.db2.gz OPHGXQKUZBNVEJ-MRXNPFEDSA-N 2 2 312.413 3.366 20 10 DGCDLP Cc1ccc(C)c(C[N@@H+]2CC[C@@H](Oc3cc[nH+]cc3C)C2)c1O ZINC001140185034 1091795148 /nfs/dbraw/zinc/79/51/48/1091795148.db2.gz OPHGXQKUZBNVEJ-MRXNPFEDSA-N 2 2 312.413 3.366 20 10 DGCDLP Cc1cc(O)c(C[NH+]2CCC3(CCCC[NH2+]3)CC2)cc1Cl ZINC001222298548 1095537611 /nfs/dbraw/zinc/53/76/11/1095537611.db2.gz ZOQSBFZOWNTNBE-UHFFFAOYSA-N 2 2 308.853 3.462 20 10 DGCDLP c1cc(N2CCCCC2)ccc1C[N@@H+]1CCC[C@@]2(CCC[NH2+]2)C1 ZINC001222346832 1095566417 /nfs/dbraw/zinc/56/64/17/1095566417.db2.gz UGPPHSKBHMHMDK-FQEVSTJZSA-N 2 2 313.489 3.395 20 10 DGCDLP c1cc(N2CCCCC2)ccc1C[N@H+]1CCC[C@@]2(CCC[NH2+]2)C1 ZINC001222346832 1095566430 /nfs/dbraw/zinc/56/64/30/1095566430.db2.gz UGPPHSKBHMHMDK-FQEVSTJZSA-N 2 2 313.489 3.395 20 10 DGCDLP CN1CCCc2cc(C[N@@H+]3CCC[C@]4(CCCC[NH2+]4)C3)ccc21 ZINC001222389656 1095586994 /nfs/dbraw/zinc/58/69/94/1095586994.db2.gz DYFKMVAGRNUTGL-HXUWFJFHSA-N 2 2 313.489 3.177 20 10 DGCDLP CN1CCCc2cc(C[N@H+]3CCC[C@]4(CCCC[NH2+]4)C3)ccc21 ZINC001222389656 1095587003 /nfs/dbraw/zinc/58/70/03/1095587003.db2.gz DYFKMVAGRNUTGL-HXUWFJFHSA-N 2 2 313.489 3.177 20 10 DGCDLP CC(C)(C)c1ccc(O)c(C[NH+]2CCC([NH+]3CCC3)CC2)c1 ZINC001233287372 1098276662 /nfs/dbraw/zinc/27/66/62/1098276662.db2.gz MVPUEJKOILHTJT-UHFFFAOYSA-N 2 2 302.462 3.360 20 10 DGCDLP Oc1cc(C(F)(F)F)ccc1C[NH+]1CCC([NH+]2CCC2)CC1 ZINC001233455516 1098342356 /nfs/dbraw/zinc/34/23/56/1098342356.db2.gz ODXUZGJZVFTAGU-UHFFFAOYSA-N 2 2 314.351 3.081 20 10 DGCDLP CC(C)(C)c1ccc(O)c(C[N@@H+]2CCCC[C@@]23CC[NH2+]C3)c1 ZINC001235116151 1098816552 /nfs/dbraw/zinc/81/65/52/1098816552.db2.gz DSWPSRQNHLBIEL-IBGZPJMESA-N 2 2 302.462 3.408 20 10 DGCDLP CC(C)(C)c1ccc(O)c(C[N@H+]2CCCC[C@@]23CC[NH2+]C3)c1 ZINC001235116151 1098816559 /nfs/dbraw/zinc/81/65/59/1098816559.db2.gz DSWPSRQNHLBIEL-IBGZPJMESA-N 2 2 302.462 3.408 20 10 DGCDLP Oc1c(Cl)cccc1C[N@@H+]1CCCC[C@@H]1C1CC[NH2+]CC1 ZINC001235160725 1098847075 /nfs/dbraw/zinc/84/70/75/1098847075.db2.gz QKVGLJBVHSILAW-MRXNPFEDSA-N 2 2 308.853 3.400 20 10 DGCDLP Oc1c(Cl)cccc1C[N@H+]1CCCC[C@@H]1C1CC[NH2+]CC1 ZINC001235160725 1098847082 /nfs/dbraw/zinc/84/70/82/1098847082.db2.gz QKVGLJBVHSILAW-MRXNPFEDSA-N 2 2 308.853 3.400 20 10 DGCDLP Oc1c(Cl)cccc1C[NH+]1CCC([C@@H]2CCCC[NH2+]2)CC1 ZINC001235243724 1098915377 /nfs/dbraw/zinc/91/53/77/1098915377.db2.gz XSPOMJSXUWUEGU-INIZCTEOSA-N 2 2 308.853 3.400 20 10 DGCDLP Cc1cc(Cl)cc(C[N@@H+]2CCCC[C@](F)(C[NH3+])C2)c1O ZINC001206371694 1099031362 /nfs/dbraw/zinc/03/13/62/1099031362.db2.gz UUKIUVOVNCUSOI-HNNXBMFYSA-N 2 2 300.805 3.007 20 10 DGCDLP Cc1cc(Cl)cc(C[N@H+]2CCCC[C@](F)(C[NH3+])C2)c1O ZINC001206371694 1099031373 /nfs/dbraw/zinc/03/13/73/1099031373.db2.gz UUKIUVOVNCUSOI-HNNXBMFYSA-N 2 2 300.805 3.007 20 10 DGCDLP CC(C)(C)c1ccc(C[NH+]2CCC([NH+]3CCC3)CC2)c(O)c1 ZINC001235679631 1099122535 /nfs/dbraw/zinc/12/25/35/1099122535.db2.gz HEPSZDSNHKFHEX-UHFFFAOYSA-N 2 2 302.462 3.360 20 10 DGCDLP C[N@H+](Cc1c(O)ccc(Cl)c1Cl)C1(C)CC[NH2+]CC1 ZINC001236227026 1099484345 /nfs/dbraw/zinc/48/43/45/1099484345.db2.gz XUOAYXHADZIBDT-UHFFFAOYSA-N 2 2 303.233 3.273 20 10 DGCDLP C[N@@H+](Cc1c(O)ccc(Cl)c1Cl)C1(C)CC[NH2+]CC1 ZINC001236227026 1099484347 /nfs/dbraw/zinc/48/43/47/1099484347.db2.gz XUOAYXHADZIBDT-UHFFFAOYSA-N 2 2 303.233 3.273 20 10 DGCDLP Oc1cccc(F)c1C[N@H+](Cc1ccccc1)C1CC[NH2+]CC1 ZINC001236299701 1099521814 /nfs/dbraw/zinc/52/18/14/1099521814.db2.gz JUYGWHIMPAZRAE-UHFFFAOYSA-N 2 2 314.404 3.286 20 10 DGCDLP Oc1cccc(F)c1C[N@@H+](Cc1ccccc1)C1CC[NH2+]CC1 ZINC001236299701 1099521824 /nfs/dbraw/zinc/52/18/24/1099521824.db2.gz JUYGWHIMPAZRAE-UHFFFAOYSA-N 2 2 314.404 3.286 20 10 DGCDLP CC[N@@H+](Cc1c(O)ccc(Cl)c1Cl)C[C@@H]1CC[NH2+]C1 ZINC001236412112 1099585462 /nfs/dbraw/zinc/58/54/62/1099585462.db2.gz RBKLWURDLDUABU-SNVBAGLBSA-N 2 2 303.233 3.130 20 10 DGCDLP CC[N@H+](Cc1c(O)ccc(Cl)c1Cl)C[C@@H]1CC[NH2+]C1 ZINC001236412112 1099585470 /nfs/dbraw/zinc/58/54/70/1099585470.db2.gz RBKLWURDLDUABU-SNVBAGLBSA-N 2 2 303.233 3.130 20 10 DGCDLP CC[C@H]([NH3+])C[N@H+](C)Cc1cc(OCc2ccccc2)ccc1O ZINC001236884317 1099849188 /nfs/dbraw/zinc/84/91/88/1099849188.db2.gz OHSXBLFEKFCCTC-KRWDZBQOSA-N 2 2 314.429 3.140 20 10 DGCDLP CC[C@H]([NH3+])C[N@@H+](C)Cc1cc(OCc2ccccc2)ccc1O ZINC001236884317 1099849198 /nfs/dbraw/zinc/84/91/98/1099849198.db2.gz OHSXBLFEKFCCTC-KRWDZBQOSA-N 2 2 314.429 3.140 20 10 DGCDLP C[N@@H+]1CC[C@@H]2C[NH+](Cc3c(O)ccc(Cl)c3Cl)C[C@@H]2C1 ZINC001237079283 1099958157 /nfs/dbraw/zinc/95/81/57/1099958157.db2.gz JQFQNPLFLALSTC-MNOVXSKESA-N 2 2 315.244 3.083 20 10 DGCDLP C[N@H+]1CC[C@@H]2C[NH+](Cc3c(O)ccc(Cl)c3Cl)C[C@@H]2C1 ZINC001237079283 1099958165 /nfs/dbraw/zinc/95/81/65/1099958165.db2.gz JQFQNPLFLALSTC-MNOVXSKESA-N 2 2 315.244 3.083 20 10 DGCDLP C[NH+]1CC[C@@H]2C[N@H+](Cc3c(O)ccc(Cl)c3Cl)C[C@@H]2C1 ZINC001237079283 1099958171 /nfs/dbraw/zinc/95/81/71/1099958171.db2.gz JQFQNPLFLALSTC-MNOVXSKESA-N 2 2 315.244 3.083 20 10 DGCDLP C[NH+]1CC[C@@H]2C[N@@H+](Cc3c(O)ccc(Cl)c3Cl)C[C@@H]2C1 ZINC001237079283 1099958181 /nfs/dbraw/zinc/95/81/81/1099958181.db2.gz JQFQNPLFLALSTC-MNOVXSKESA-N 2 2 315.244 3.083 20 10 DGCDLP Cc1cc(Cl)cc(C[N@H+](C2CCC2)[C@H]2CCC[NH2+]C2)c1O ZINC001237161360 1100009576 /nfs/dbraw/zinc/00/95/76/1100009576.db2.gz OMNJRCWIEWMVNU-INIZCTEOSA-N 2 2 308.853 3.461 20 10 DGCDLP Cc1cc(Cl)cc(C[N@@H+](C2CCC2)[C@H]2CCC[NH2+]C2)c1O ZINC001237161360 1100009584 /nfs/dbraw/zinc/00/95/84/1100009584.db2.gz OMNJRCWIEWMVNU-INIZCTEOSA-N 2 2 308.853 3.461 20 10 DGCDLP c1cc(N2CCCCC2)ccc1C[NH2+][C@@H]1CC2CC[NH+](CC2)C1 ZINC001254837185 1106146406 /nfs/dbraw/zinc/14/64/06/1106146406.db2.gz SHKVRQCXYLADOY-LJQANCHMSA-N 2 2 313.489 3.251 20 10 DGCDLP CC[NH+](CC)CC[C@@H](C)[NH2+]Cc1cc(Cl)cc(F)c1O ZINC001308556237 1111443686 /nfs/dbraw/zinc/44/36/86/1111443686.db2.gz XVPQTLGBNPDSTN-LLVKDONJSA-N 2 2 302.821 3.395 20 10 DGCDLP Oc1c(Cl)cc(Cl)cc1C[NH2+]CCC[NH+]1CCCC1 ZINC000021023340 182261425 /nfs/dbraw/zinc/26/14/25/182261425.db2.gz PLQQWLSOXZWCAK-UHFFFAOYSA-N 2 2 303.233 3.275 20 10 DGCDLP C[C@H]1CC[N@H+](Cc2c(O)cccc2Cl)C[C@@H]1n1cc[nH+]c1 ZINC000271228102 432357891 /nfs/dbraw/zinc/35/78/91/432357891.db2.gz BFMFKLMMCFFXLN-WFASDCNBSA-N 2 2 305.809 3.325 20 10 DGCDLP C[C@H]1CC[N@@H+](Cc2c(O)cccc2Cl)C[C@@H]1n1cc[nH+]c1 ZINC000271228102 432357895 /nfs/dbraw/zinc/35/78/95/432357895.db2.gz BFMFKLMMCFFXLN-WFASDCNBSA-N 2 2 305.809 3.325 20 10 DGCDLP C[C@H](CC[NH+](C)C)[NH2+][C@@H](C)c1cc(Br)ccc1O ZINC000273466072 432602802 /nfs/dbraw/zinc/60/28/02/432602802.db2.gz DSVSUGPATZEJIS-MNOVXSKESA-N 2 2 315.255 3.146 20 10 DGCDLP Oc1cccc2c1[C@H]([NH2+]C1CC[NH+](Cc3ccncc3)CC1)CC2 ZINC000296123256 434516572 /nfs/dbraw/zinc/51/65/72/434516572.db2.gz VLIQDSRVMCTMRK-GOSISDBHSA-N 2 2 323.440 3.029 20 10 DGCDLP Oc1cccc2c1[C@H]([NH2+]CCCc1[nH]c3ccccc3[nH+]1)CC2 ZINC000296161357 434527688 /nfs/dbraw/zinc/52/76/88/434527688.db2.gz XHYOWXBUHPZOQT-MRXNPFEDSA-N 2 2 307.397 3.478 20 10 DGCDLP CC[NH+](CC)C[C@H]1CC[N@H+](Cc2ccc(N(C)C)c(F)c2)C1 ZINC000131381804 520742124 /nfs/dbraw/zinc/74/21/24/520742124.db2.gz WBZSXHMGMLNZJV-MRXNPFEDSA-N 2 2 307.457 3.055 20 10 DGCDLP CC[NH+](CC)C[C@H]1CC[N@@H+](Cc2ccc(N(C)C)c(F)c2)C1 ZINC000131381804 520742128 /nfs/dbraw/zinc/74/21/28/520742128.db2.gz WBZSXHMGMLNZJV-MRXNPFEDSA-N 2 2 307.457 3.055 20 10 DGCDLP CC[C@H]([NH2+]CCc1cn2c([nH+]1)CCCC2)c1ccc(F)cc1O ZINC000367613965 522604172 /nfs/dbraw/zinc/60/41/72/522604172.db2.gz GPNVTJOQPBAHPT-INIZCTEOSA-N 2 2 317.408 3.348 20 10 DGCDLP Cc1cc(Cl)cc(C[NH+]2CCC(n3cc[nH+]c3)CC2)c1O ZINC000179903058 524862161 /nfs/dbraw/zinc/86/21/61/524862161.db2.gz QHNSDMUVGLRQCB-UHFFFAOYSA-N 2 2 305.809 3.388 20 10 DGCDLP Oc1c(Cl)cccc1C[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000180766081 526325911 /nfs/dbraw/zinc/32/59/11/526325911.db2.gz FFESWHLGOBAHRX-CXAGYDPISA-N 2 2 320.864 3.494 20 10 DGCDLP Oc1c(Cl)cccc1C[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000180766081 526325917 /nfs/dbraw/zinc/32/59/17/526325917.db2.gz FFESWHLGOBAHRX-CXAGYDPISA-N 2 2 320.864 3.494 20 10 DGCDLP Oc1c(Cl)cccc1C[NH+]1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000180766081 526325924 /nfs/dbraw/zinc/32/59/24/526325924.db2.gz FFESWHLGOBAHRX-CXAGYDPISA-N 2 2 320.864 3.494 20 10 DGCDLP Oc1c(Cl)cccc1C[NH+]1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000180766081 526325928 /nfs/dbraw/zinc/32/59/28/526325928.db2.gz FFESWHLGOBAHRX-CXAGYDPISA-N 2 2 320.864 3.494 20 10 DGCDLP Oc1c(Cl)cccc1C[N@@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000180470895 526327576 /nfs/dbraw/zinc/32/75/76/526327576.db2.gz SYASCRZHDNQBHB-AWEZNQCLSA-N 2 2 308.853 3.353 20 10 DGCDLP Oc1c(Cl)cccc1C[N@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000180470895 526327577 /nfs/dbraw/zinc/32/75/77/526327577.db2.gz SYASCRZHDNQBHB-AWEZNQCLSA-N 2 2 308.853 3.353 20 10 DGCDLP COc1cc(C)cc(C[NH2+][C@H](Cn2cc[nH+]c2)C(C)(C)C)c1O ZINC000894199499 618727106 /nfs/dbraw/zinc/72/71/06/618727106.db2.gz LCSFSSVZVJQAMV-MRXNPFEDSA-N 2 2 317.433 3.110 20 10 DGCDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+]Cc2cccc(Cl)c2)cc1 ZINC000841041451 619243018 /nfs/dbraw/zinc/24/30/18/619243018.db2.gz CJCMKASRNBTLOE-KRWDZBQOSA-N 2 2 303.837 3.196 20 10 DGCDLP C[C@H](C[NH2+][C@H](C)c1cc(F)cc(F)c1O)C[NH+]1CCCCC1 ZINC000756435030 621638182 /nfs/dbraw/zinc/63/81/82/621638182.db2.gz SXCLZDLLVZQCQL-CHWSQXEVSA-N 2 2 312.404 3.443 20 10 DGCDLP C[C@@H]([NH2+]C1CC[NH+](C2CCC2)CC1)c1cc(F)cc(F)c1O ZINC000756489241 621641681 /nfs/dbraw/zinc/64/16/81/621641681.db2.gz HKVODXIQUGIXAP-LLVKDONJSA-N 2 2 310.388 3.338 20 10 DGCDLP CCC[NH+]1CCC(C[NH2+][C@@H](C)c2cc(F)cc(F)c2O)CC1 ZINC000756532809 621645596 /nfs/dbraw/zinc/64/55/96/621645596.db2.gz GJQVKXUEKSIRQT-LBPRGKRZSA-N 2 2 312.404 3.443 20 10 DGCDLP CCOc1ccc(C[NH+]2CCC([NH+]3CCCCC3)CC2)c(O)c1 ZINC000768239720 622447147 /nfs/dbraw/zinc/44/71/47/622447147.db2.gz KQQSYBVJCXFJMS-UHFFFAOYSA-N 2 2 318.461 3.241 20 10 DGCDLP C[C@H]([NH2+]Cc1cccc2c1CC[NH2+]C2)c1cc(F)cc(F)c1O ZINC000873235891 623086930 /nfs/dbraw/zinc/08/69/30/623086930.db2.gz RVOABFKLECNQSU-NSHDSACASA-N 2 2 318.367 3.167 20 10 DGCDLP Oc1c(F)cc(Cl)cc1C[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000775201332 623240908 /nfs/dbraw/zinc/24/09/08/623240908.db2.gz NUNKVJDCWFAKTJ-UHFFFAOYSA-N 2 2 312.816 3.149 20 10 DGCDLP CC[C@H]([NH2+]CCC[N@H+](C)CCOC)c1cc(Cl)ccc1O ZINC000775491622 623279867 /nfs/dbraw/zinc/27/98/67/623279867.db2.gz GFWBLTQLPXPSFH-HNNXBMFYSA-N 2 2 314.857 3.055 20 10 DGCDLP CC[C@H]([NH2+]CCC[N@@H+](C)CCOC)c1cc(Cl)ccc1O ZINC000775491622 623279872 /nfs/dbraw/zinc/27/98/72/623279872.db2.gz GFWBLTQLPXPSFH-HNNXBMFYSA-N 2 2 314.857 3.055 20 10 DGCDLP C[C@H]([NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1)c1c(O)cccc1F ZINC000886639839 627178617 /nfs/dbraw/zinc/17/86/17/627178617.db2.gz MRBKWGMSHOAFDY-DZGCQCFKSA-N 2 2 306.425 3.304 20 10 DGCDLP C[C@H]([NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1)c1c(O)cccc1F ZINC000886639839 627178618 /nfs/dbraw/zinc/17/86/18/627178618.db2.gz MRBKWGMSHOAFDY-DZGCQCFKSA-N 2 2 306.425 3.304 20 10 DGCDLP C[C@H](C[NH2+][C@H](C)c1cccc(C(F)(F)F)c1O)C[NH+](C)C ZINC000815627809 627692813 /nfs/dbraw/zinc/69/28/13/627692813.db2.gz KEFQACVOZNQIIL-GHMZBOCLSA-N 2 2 304.356 3.259 20 10 DGCDLP Cc1ccc([C@@H](C)[N@@H+]2CCc3sc(C[NH3+])nc3C2)c(O)c1C ZINC000925751548 627787747 /nfs/dbraw/zinc/78/77/47/627787747.db2.gz NSTXAYMUJVGMKQ-GFCCVEGCSA-N 2 2 317.458 3.044 20 10 DGCDLP Cc1ccc([C@@H](C)[N@H+]2CCc3sc(C[NH3+])nc3C2)c(O)c1C ZINC000925751548 627787750 /nfs/dbraw/zinc/78/77/50/627787750.db2.gz NSTXAYMUJVGMKQ-GFCCVEGCSA-N 2 2 317.458 3.044 20 10 DGCDLP CC[C@@H]([NH2+]C[C@@H]1C[NH2+]CCC1(F)F)c1cccc(Cl)c1O ZINC000925779623 627793813 /nfs/dbraw/zinc/79/38/13/627793813.db2.gz YPOKQIRQSBSAOZ-GXFFZTMASA-N 2 2 318.795 3.331 20 10 DGCDLP CC(C)[N@@H+]1CC[C@@H](C[NH2+]Cc2cc(Cl)c(F)cc2O)C1 ZINC000816610374 627814454 /nfs/dbraw/zinc/81/44/54/627814454.db2.gz IMOVWLNFWMDZOU-NSHDSACASA-N 2 2 300.805 3.005 20 10 DGCDLP CC(C)[N@H+]1CC[C@@H](C[NH2+]Cc2cc(Cl)c(F)cc2O)C1 ZINC000816610374 627814455 /nfs/dbraw/zinc/81/44/55/627814455.db2.gz IMOVWLNFWMDZOU-NSHDSACASA-N 2 2 300.805 3.005 20 10 DGCDLP CC(=O)c1cc(Cl)cc(C[N@@H+]2C[C@H](C[NH3+])[C@@H](C)C[C@@H]2C)c1O ZINC000817880392 627952807 /nfs/dbraw/zinc/95/28/07/627952807.db2.gz RNAHNRIXWXZKJN-MJVIPROJSA-N 2 2 324.852 3.053 20 10 DGCDLP CC(=O)c1cc(Cl)cc(C[N@H+]2C[C@H](C[NH3+])[C@@H](C)C[C@@H]2C)c1O ZINC000817880392 627952811 /nfs/dbraw/zinc/95/28/11/627952811.db2.gz RNAHNRIXWXZKJN-MJVIPROJSA-N 2 2 324.852 3.053 20 10 DGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+][C@@H](Cc2ccccc2)C2CC2)cc1 ZINC000817941902 627968444 /nfs/dbraw/zinc/96/84/44/627968444.db2.gz LRISUMWKTLYADD-RTWAWAEBSA-N 2 2 323.484 3.363 20 10 DGCDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+][C@@H](C2CC2)C2CCCC2)cc1 ZINC000817940875 627968454 /nfs/dbraw/zinc/96/84/54/627968454.db2.gz LTNCDPAEQNGLAX-RBUKOAKNSA-N 2 2 301.478 3.311 20 10 DGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+]C2CCc3ccccc3CC2)cc1 ZINC000817940717 627968665 /nfs/dbraw/zinc/96/86/65/627968665.db2.gz HJTCROYALJSPAM-OAQYLSRUSA-N 2 2 323.484 3.290 20 10 DGCDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+][C@H]2CCCc3ccccc3C2)cc1 ZINC000817944200 627969756 /nfs/dbraw/zinc/96/97/56/627969756.db2.gz YCPSLDQOALGBIK-FPOVZHCZSA-N 2 2 323.484 3.290 20 10 DGCDLP COc1ccsc1[C@@H](C)[NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000817943863 627969806 /nfs/dbraw/zinc/96/98/06/627969806.db2.gz WEHKLBRCWVTNDS-DOMZBBRYSA-N 2 2 319.474 3.173 20 10 DGCDLP C[C@@H]([NH2+]C[C@H]1CCC[NH2+]1)c1ccc(N2CCCCC2)c(F)c1 ZINC000817952800 627972710 /nfs/dbraw/zinc/97/27/10/627972710.db2.gz SUHLOQFKPPKBLB-GDBMZVCRSA-N 2 2 305.441 3.219 20 10 DGCDLP CC(C)C[C@@H](C[NH3+])[NH2+][C@H](C)c1cc(Br)ccc1O ZINC000817957557 627974638 /nfs/dbraw/zinc/97/46/38/627974638.db2.gz CVYPMLZFZYGNAD-PWSUYJOCSA-N 2 2 315.255 3.179 20 10 DGCDLP CC[C@H]([NH2+][C@@H]1C[NH2+]CC[C@@H]1C)c1ccc(C(F)(F)F)cc1O ZINC000817969520 627978587 /nfs/dbraw/zinc/97/85/87/627978587.db2.gz VWDJPONNEHHOJN-LEWSCRJBSA-N 2 2 316.367 3.450 20 10 DGCDLP Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@H]1C[N@@H+](C2CC2)C[C@H]1C ZINC000840893874 630373847 /nfs/dbraw/zinc/37/38/47/630373847.db2.gz NNWVPLKOMUJRQN-GUXCAODWSA-N 2 2 315.505 3.064 20 10 DGCDLP Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@H]1C[N@H+](C2CC2)C[C@H]1C ZINC000840893874 630373848 /nfs/dbraw/zinc/37/38/48/630373848.db2.gz NNWVPLKOMUJRQN-GUXCAODWSA-N 2 2 315.505 3.064 20 10 DGCDLP CCOc1cccc(C[NH2+]CC[NH2+]C2CCCCCC2)c1O ZINC000841028080 630398305 /nfs/dbraw/zinc/39/83/05/630398305.db2.gz LGHVVIXMBGDUSD-UHFFFAOYSA-N 2 2 306.450 3.193 20 10 DGCDLP CCC([NH3+])(CC)C[NH2+]Cc1cc(C)cc(Br)c1O ZINC000841031430 630398416 /nfs/dbraw/zinc/39/84/16/630398416.db2.gz TXLAVEYHUXKKCT-UHFFFAOYSA-N 2 2 315.255 3.070 20 10 DGCDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+]Cc2nccc3ccccc32)cc1 ZINC000841042323 630400720 /nfs/dbraw/zinc/40/07/20/630400720.db2.gz IANYFTLCCGKXIN-IBGZPJMESA-N 2 2 320.440 3.090 20 10 DGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+]Cc2ccc3ncccc3c2)cc1 ZINC000841040101 630400793 /nfs/dbraw/zinc/40/07/93/630400793.db2.gz IKKCVFXCIRDMSA-LJQANCHMSA-N 2 2 320.440 3.090 20 10 DGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+]Cc2ccc(Cl)s2)cc1 ZINC000841044335 630401031 /nfs/dbraw/zinc/40/10/31/630401031.db2.gz WDUWMBLBHLOXLT-CQSZACIVSA-N 2 2 309.866 3.257 20 10 DGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+][C@@H]2CCCC[C@@H]2C2CC2)cc1 ZINC000841045300 630401255 /nfs/dbraw/zinc/40/12/55/630401255.db2.gz JRVQKYCZJGECGW-GUDVDZBRSA-N 2 2 301.478 3.311 20 10 DGCDLP C[C@@H](C[NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1)c1ccc(F)cc1 ZINC000841042739 630401312 /nfs/dbraw/zinc/40/13/12/630401312.db2.gz NCJUYZMWKSZEES-IFXJQAMLSA-N 2 2 315.436 3.285 20 10 DGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+]Cc2coc3ccccc23)cc1 ZINC000841045680 630402037 /nfs/dbraw/zinc/40/20/37/630402037.db2.gz ODXFQXLGTRRPHH-GOSISDBHSA-N 2 2 309.413 3.288 20 10 DGCDLP COc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCC[N@@H+]3CCCC[C@@H]23)c1 ZINC000848568358 631696391 /nfs/dbraw/zinc/69/63/91/631696391.db2.gz GORKFSLGNMHBTB-XKQJLSEDSA-N 2 2 304.434 3.068 20 10 DGCDLP COc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCC[N@H+]3CCCC[C@@H]23)c1 ZINC000848568358 631696396 /nfs/dbraw/zinc/69/63/96/631696396.db2.gz GORKFSLGNMHBTB-XKQJLSEDSA-N 2 2 304.434 3.068 20 10 DGCDLP Cc1cccc(C[NH2+][C@@H]2C[NH2+]CC[C@@H]2c2ccc(F)cc2)c1O ZINC000849349627 631900552 /nfs/dbraw/zinc/90/05/52/631900552.db2.gz DKPQJBSIHMMCTM-QZTJIDSGSA-N 2 2 314.404 3.075 20 10 DGCDLP Oc1c(Cl)cccc1C[NH+]1CCC([C@@H]2CCC[NH2+]C2)CC1 ZINC000849349519 631900820 /nfs/dbraw/zinc/90/08/20/631900820.db2.gz BXWCWOJCZJTBBL-CQSZACIVSA-N 2 2 308.853 3.257 20 10 DGCDLP Cc1cccc(C[NH2+][C@@H]2C[NH2+]CC[C@@H]2c2cccc(F)c2)c1O ZINC000849350329 631901053 /nfs/dbraw/zinc/90/10/53/631901053.db2.gz XXSFSOCVBVSBQY-QZTJIDSGSA-N 2 2 314.404 3.075 20 10 DGCDLP C[C@H]([NH2+][C@H](Cn1cc[nH+]c1)C(C)(C)C)c1cc(F)ccc1O ZINC000317536497 656628857 /nfs/dbraw/zinc/62/88/57/656628857.db2.gz KXOWZZOBFOXUKX-BLLLJJGKSA-N 2 2 305.397 3.493 20 10 DGCDLP COc1ccc(O)c([C@H](C)[NH2+]Cc2ccc(-n3cc[nH+]c3)cc2)c1 ZINC000182417108 660052365 /nfs/dbraw/zinc/05/23/65/660052365.db2.gz FZTWYPWNHCIAJL-AWEZNQCLSA-N 2 2 323.396 3.437 20 10 DGCDLP Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2[NH2+]Cc1cc(N(C)C)cc[nH+]1 ZINC001331995156 1178332136 /nfs/dbraw/zinc/33/21/36/1178332136.db2.gz BNRCRKQYIVRKHD-BBRMVZONSA-N 2 2 311.429 3.500 20 10 DGCDLP CN(C)c1ccc(/C=C/C[NH+]2CCC(c3c[nH+]cn3C)CC2)cc1 ZINC001462666430 1182983463 /nfs/dbraw/zinc/98/34/63/1182983463.db2.gz KMTNCSZBWUPIQR-SNAWJCMRSA-N 2 2 324.472 3.379 20 10 DGCDLP C[N@@H+]1C[C@]23C[NH+](Cc4ccc(Cl)cc4O)C[C@@]2(C1)CCCC3 ZINC001621571470 1193860097 /nfs/dbraw/zinc/86/00/97/1193860097.db2.gz WIPCXNREOJPPCM-HDICACEKSA-N 2 2 320.864 3.353 20 10 DGCDLP C[N@H+]1C[C@]23C[NH+](Cc4ccc(Cl)cc4O)C[C@@]2(C1)CCCC3 ZINC001621571470 1193860098 /nfs/dbraw/zinc/86/00/98/1193860098.db2.gz WIPCXNREOJPPCM-HDICACEKSA-N 2 2 320.864 3.353 20 10 DGCDLP C[NH+]1C[C@]23C[N@H+](Cc4ccc(Cl)cc4O)C[C@@]2(C1)CCCC3 ZINC001621571470 1193860100 /nfs/dbraw/zinc/86/01/00/1193860100.db2.gz WIPCXNREOJPPCM-HDICACEKSA-N 2 2 320.864 3.353 20 10 DGCDLP C[NH+]1C[C@]23C[N@@H+](Cc4ccc(Cl)cc4O)C[C@@]2(C1)CCCC3 ZINC001621571470 1193860102 /nfs/dbraw/zinc/86/01/02/1193860102.db2.gz WIPCXNREOJPPCM-HDICACEKSA-N 2 2 320.864 3.353 20 10 DGCDLP C[NH+](C)CC1(C[NH2+]Cc2cc(Cl)cc(F)c2O)CCCC1 ZINC001656063684 1195994032 /nfs/dbraw/zinc/99/40/32/1195994032.db2.gz KLNTXWSLBUJAEF-UHFFFAOYSA-N 2 2 314.832 3.396 20 10 DGCDLP COc1ccc(O)c(C[NH2+][C@H](Cn2cc[nH+]c2)c2ccccc2)c1 ZINC001658788558 1196301851 /nfs/dbraw/zinc/30/18/51/1196301851.db2.gz RDYJHCZPBSQPHQ-GOSISDBHSA-N 2 2 323.396 3.128 20 10 DGCDLP C[N@@H+]1CCC[C@H]2C[NH+](Cc3cccc(C(C)(C)C)c3O)C[C@@H]21 ZINC001143116418 1092617850 /nfs/dbraw/zinc/61/78/50/1092617850.db2.gz ANFDCINLQIZNDO-YOEHRIQHSA-N 2 2 302.462 3.216 20 10 DGCDLP C[N@H+]1CCC[C@H]2C[NH+](Cc3cccc(C(C)(C)C)c3O)C[C@@H]21 ZINC001143116418 1092617854 /nfs/dbraw/zinc/61/78/54/1092617854.db2.gz ANFDCINLQIZNDO-YOEHRIQHSA-N 2 2 302.462 3.216 20 10 DGCDLP C[NH+]1CCC[C@H]2C[N@H+](Cc3cccc(C(C)(C)C)c3O)C[C@@H]21 ZINC001143116418 1092617857 /nfs/dbraw/zinc/61/78/57/1092617857.db2.gz ANFDCINLQIZNDO-YOEHRIQHSA-N 2 2 302.462 3.216 20 10 DGCDLP C[NH+]1CCC[C@H]2C[N@@H+](Cc3cccc(C(C)(C)C)c3O)C[C@@H]21 ZINC001143116418 1092617861 /nfs/dbraw/zinc/61/78/61/1092617861.db2.gz ANFDCINLQIZNDO-YOEHRIQHSA-N 2 2 302.462 3.216 20 10 DGCDLP C[N@@H+]1CCC[C@@H]2C[NH+](Cc3cccc(C(C)(C)C)c3O)C[C@H]21 ZINC001143116416 1092618833 /nfs/dbraw/zinc/61/88/33/1092618833.db2.gz ANFDCINLQIZNDO-RHSMWYFYSA-N 2 2 302.462 3.216 20 10 DGCDLP C[N@H+]1CCC[C@@H]2C[NH+](Cc3cccc(C(C)(C)C)c3O)C[C@H]21 ZINC001143116416 1092618838 /nfs/dbraw/zinc/61/88/38/1092618838.db2.gz ANFDCINLQIZNDO-RHSMWYFYSA-N 2 2 302.462 3.216 20 10 DGCDLP C[NH+]1CCC[C@@H]2C[N@H+](Cc3cccc(C(C)(C)C)c3O)C[C@H]21 ZINC001143116416 1092618839 /nfs/dbraw/zinc/61/88/39/1092618839.db2.gz ANFDCINLQIZNDO-RHSMWYFYSA-N 2 2 302.462 3.216 20 10 DGCDLP C[NH+]1CCC[C@@H]2C[N@@H+](Cc3cccc(C(C)(C)C)c3O)C[C@H]21 ZINC001143116416 1092618843 /nfs/dbraw/zinc/61/88/43/1092618843.db2.gz ANFDCINLQIZNDO-RHSMWYFYSA-N 2 2 302.462 3.216 20 10 DGCDLP [NH3+]C[C@H]1CCCC[N@H+](Cc2cc(Cl)c(Cl)cc2O)C1 ZINC001206641428 1092903351 /nfs/dbraw/zinc/90/33/51/1092903351.db2.gz XDPZJTQPRLZDJR-SNVBAGLBSA-N 2 2 303.233 3.260 20 10 DGCDLP [NH3+]C[C@H]1CCCC[N@@H+](Cc2cc(Cl)c(Cl)cc2O)C1 ZINC001206641428 1092903362 /nfs/dbraw/zinc/90/33/62/1092903362.db2.gz XDPZJTQPRLZDJR-SNVBAGLBSA-N 2 2 303.233 3.260 20 10 DGCDLP Cc1cc(C[NH+]2CCC([N@H+](C)C3CC3)CC2)ccc1N(C)C ZINC001139674430 1095053831 /nfs/dbraw/zinc/05/38/31/1095053831.db2.gz ZLXLSWBXRICYHP-UHFFFAOYSA-N 2 2 301.478 3.120 20 10 DGCDLP Cc1cc(C[NH+]2CCC([N@@H+](C)C3CC3)CC2)ccc1N(C)C ZINC001139674430 1095053844 /nfs/dbraw/zinc/05/38/44/1095053844.db2.gz ZLXLSWBXRICYHP-UHFFFAOYSA-N 2 2 301.478 3.120 20 10 DGCDLP Oc1cc(F)c(F)cc1C[N@@H+]1CCCC[C@]2(CCCC[NH2+]C2)C1 ZINC001222166639 1095470948 /nfs/dbraw/zinc/47/09/48/1095470948.db2.gz APMNPTADQVEGGE-SFHVURJKSA-N 2 2 324.415 3.416 20 10 DGCDLP Oc1cc(F)c(F)cc1C[N@H+]1CCCC[C@]2(CCCC[NH2+]C2)C1 ZINC001222166639 1095470955 /nfs/dbraw/zinc/47/09/55/1095470955.db2.gz APMNPTADQVEGGE-SFHVURJKSA-N 2 2 324.415 3.416 20 10 DGCDLP COc1cc(O)c(C[N@@H+]2CCC[C@@]3(CCC[NH2+]C3)C2)c(Cl)c1 ZINC001222277706 1095525098 /nfs/dbraw/zinc/52/50/98/1095525098.db2.gz QQGVRTJRMHWGDR-QGZVFWFLSA-N 2 2 324.852 3.020 20 10 DGCDLP COc1cc(O)c(C[N@H+]2CCC[C@@]3(CCC[NH2+]C3)C2)c(Cl)c1 ZINC001222277706 1095525109 /nfs/dbraw/zinc/52/51/09/1095525109.db2.gz QQGVRTJRMHWGDR-QGZVFWFLSA-N 2 2 324.852 3.020 20 10 DGCDLP CC(C)(C)c1cc(O)c(C[N@@H+]2CC[C@H]3[NH2+]C[C@H]3C2)cc1Cl ZINC001235030109 1098759244 /nfs/dbraw/zinc/75/92/44/1098759244.db2.gz GEAUKUQLOHYIPP-SWLSCSKDSA-N 2 2 308.853 3.137 20 10 DGCDLP CC(C)(C)c1cc(O)c(C[N@H+]2CC[C@H]3[NH2+]C[C@H]3C2)cc1Cl ZINC001235030109 1098759252 /nfs/dbraw/zinc/75/92/52/1098759252.db2.gz GEAUKUQLOHYIPP-SWLSCSKDSA-N 2 2 308.853 3.137 20 10 DGCDLP Cc1ccc(C)n1-c1ccc(C[N@@H+]2C[C@H]3CCC[NH2+][C@H]3C2)cc1 ZINC001235209377 1098879423 /nfs/dbraw/zinc/87/94/23/1098879423.db2.gz NIZVFGLVBAEMML-QUCCMNQESA-N 2 2 309.457 3.278 20 10 DGCDLP Cc1ccc(C)n1-c1ccc(C[N@H+]2C[C@H]3CCC[NH2+][C@H]3C2)cc1 ZINC001235209377 1098879434 /nfs/dbraw/zinc/87/94/34/1098879434.db2.gz NIZVFGLVBAEMML-QUCCMNQESA-N 2 2 309.457 3.278 20 10 DGCDLP Cc1ccc(C)n1-c1ccc(C[N@@H+]2C[C@H]3CC[C@@H](C2)[NH2+]C3)cc1 ZINC001236060853 1099361726 /nfs/dbraw/zinc/36/17/26/1099361726.db2.gz SBOJXNUWLKEKFJ-OALUTQOASA-N 2 2 309.457 3.278 20 10 DGCDLP Cc1ccc(C)n1-c1ccc(C[N@H+]2C[C@H]3CC[C@@H](C2)[NH2+]C3)cc1 ZINC001236060853 1099361738 /nfs/dbraw/zinc/36/17/38/1099361738.db2.gz SBOJXNUWLKEKFJ-OALUTQOASA-N 2 2 309.457 3.278 20 10 DGCDLP CCN(CC)c1ccc(C[N@H+](C)[C@H]2CCCC[C@@H]2[NH3+])c(OC)c1 ZINC001236219423 1099476177 /nfs/dbraw/zinc/47/61/77/1099476177.db2.gz VZMSYPYNDVYDIZ-ROUUACIJSA-N 2 2 319.493 3.243 20 10 DGCDLP CCN(CC)c1ccc(C[N@@H+](C)[C@H]2CCCC[C@@H]2[NH3+])c(OC)c1 ZINC001236219423 1099476182 /nfs/dbraw/zinc/47/61/82/1099476182.db2.gz VZMSYPYNDVYDIZ-ROUUACIJSA-N 2 2 319.493 3.243 20 10 DGCDLP Cc1cccc(O)c1C[N@H+](Cc1ccccc1)[C@@H]1CCC[NH2+]C1 ZINC001236269890 1099512191 /nfs/dbraw/zinc/51/21/91/1099512191.db2.gz IXMFZBGZFVHPBY-GOSISDBHSA-N 2 2 310.441 3.455 20 10 DGCDLP Cc1cccc(O)c1C[N@@H+](Cc1ccccc1)[C@@H]1CCC[NH2+]C1 ZINC001236269890 1099512205 /nfs/dbraw/zinc/51/22/05/1099512205.db2.gz IXMFZBGZFVHPBY-GOSISDBHSA-N 2 2 310.441 3.455 20 10 DGCDLP CC(C)C[N@H+](Cc1cc(F)c(F)cc1O)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236550960 1099677911 /nfs/dbraw/zinc/67/79/11/1099677911.db2.gz FWJSONQQUUVWOA-HDJSIYSDSA-N 2 2 312.404 3.398 20 10 DGCDLP CC(C)C[N@@H+](Cc1cc(F)c(F)cc1O)[C@H]1CC[C@H]([NH3+])CC1 ZINC001236550960 1099677916 /nfs/dbraw/zinc/67/79/16/1099677916.db2.gz FWJSONQQUUVWOA-HDJSIYSDSA-N 2 2 312.404 3.398 20 10 DGCDLP Cc1cc(C)c(O)c2c1CC(C)(C)[C@H]2[NH2+][C@H]1CC[C@@H](C)[NH2+]C1 ZINC001246525852 1104577146 /nfs/dbraw/zinc/57/71/46/1104577146.db2.gz OJAFNCRIJAZNFW-GLJUWKHASA-N 2 2 302.462 3.363 20 10 DGCDLP C[C@@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1ccc(F)c(F)c1O ZINC000278420781 296120771 /nfs/dbraw/zinc/12/07/71/296120771.db2.gz INWNBUCAHVPLGD-LLVKDONJSA-N 2 2 310.388 3.195 20 10 DGCDLP C[C@H]1CC[N@H+](Cc2cc(Cl)ccc2O)C[C@H]1n1cc[nH+]c1 ZINC000246773570 432164991 /nfs/dbraw/zinc/16/49/91/432164991.db2.gz PZHIOQPXSALXDU-SWLSCSKDSA-N 2 2 305.809 3.325 20 10 DGCDLP C[C@H]1CC[N@@H+](Cc2cc(Cl)ccc2O)C[C@H]1n1cc[nH+]c1 ZINC000246773570 432164993 /nfs/dbraw/zinc/16/49/93/432164993.db2.gz PZHIOQPXSALXDU-SWLSCSKDSA-N 2 2 305.809 3.325 20 10 DGCDLP Oc1cccc(Cl)c1C[NH2+]CCCCNc1cccc[nH+]1 ZINC000119027923 431637350 /nfs/dbraw/zinc/63/73/50/431637350.db2.gz AXFRARYNNIYDRZ-UHFFFAOYSA-N 2 2 305.809 3.423 20 10 DGCDLP C[C@@H]1CC[N@H+](Cc2c(O)cccc2Cl)C[C@@H]1n1cc[nH+]c1 ZINC000271228098 432357635 /nfs/dbraw/zinc/35/76/35/432357635.db2.gz BFMFKLMMCFFXLN-DOMZBBRYSA-N 2 2 305.809 3.325 20 10 DGCDLP C[C@@H]1CC[N@@H+](Cc2c(O)cccc2Cl)C[C@@H]1n1cc[nH+]c1 ZINC000271228098 432357638 /nfs/dbraw/zinc/35/76/38/432357638.db2.gz BFMFKLMMCFFXLN-DOMZBBRYSA-N 2 2 305.809 3.325 20 10 DGCDLP Cc1cc(Br)cc([C@@H](C)[NH2+]CCn2cc[nH+]c2)c1O ZINC000186926768 432638758 /nfs/dbraw/zinc/63/87/58/432638758.db2.gz IBWBBUYQEMNUBH-LLVKDONJSA-N 2 2 324.222 3.010 20 10 DGCDLP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2ccc(F)c(F)c2O)C1 ZINC000187701382 432677958 /nfs/dbraw/zinc/67/79/58/432677958.db2.gz UPPBXTYMJZSPLP-STQMWFEESA-N 2 2 312.404 3.441 20 10 DGCDLP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2ccc(F)c(F)c2O)C1 ZINC000187701382 432677962 /nfs/dbraw/zinc/67/79/62/432677962.db2.gz UPPBXTYMJZSPLP-STQMWFEESA-N 2 2 312.404 3.441 20 10 DGCDLP C[C@@H]1CC[N@H+](Cc2cc(Cl)c(F)cc2O)C[C@H]1n1cc[nH+]c1 ZINC000294434603 434111910 /nfs/dbraw/zinc/11/19/10/434111910.db2.gz XNEGPKNLIXEQKY-IAQYHMDHSA-N 2 2 323.799 3.464 20 10 DGCDLP C[C@@H]1CC[N@@H+](Cc2cc(Cl)c(F)cc2O)C[C@H]1n1cc[nH+]c1 ZINC000294434603 434111915 /nfs/dbraw/zinc/11/19/15/434111915.db2.gz XNEGPKNLIXEQKY-IAQYHMDHSA-N 2 2 323.799 3.464 20 10 DGCDLP Cn1cc[nH+]c1[C@H]1CCC[N@H+](Cc2cccc(Cl)c2O)C1 ZINC000365821338 434310994 /nfs/dbraw/zinc/31/09/94/434310994.db2.gz PYOZXPUFEBSEFA-ZDUSSCGKSA-N 2 2 305.809 3.159 20 10 DGCDLP Cn1cc[nH+]c1[C@H]1CCC[N@@H+](Cc2cccc(Cl)c2O)C1 ZINC000365821338 434311001 /nfs/dbraw/zinc/31/10/01/434311001.db2.gz PYOZXPUFEBSEFA-ZDUSSCGKSA-N 2 2 305.809 3.159 20 10 DGCDLP C[C@@H]1CC[N@H+](Cc2cccc(Cl)c2O)C[C@@H]1n1cc[nH+]c1 ZINC000180720054 524512517 /nfs/dbraw/zinc/51/25/17/524512517.db2.gz PNIDRYUWTMGIGT-DOMZBBRYSA-N 2 2 305.809 3.325 20 10 DGCDLP C[C@@H]1CC[N@@H+](Cc2cccc(Cl)c2O)C[C@@H]1n1cc[nH+]c1 ZINC000180720054 524512522 /nfs/dbraw/zinc/51/25/22/524512522.db2.gz PNIDRYUWTMGIGT-DOMZBBRYSA-N 2 2 305.809 3.325 20 10 DGCDLP Cc1cc(O)c(C[NH+]2CC[C@]3(C2)CCC[N@@H+](C)C3)c(Cl)c1 ZINC000840949357 618621489 /nfs/dbraw/zinc/62/14/89/618621489.db2.gz STXHBRCPMWUZLO-QGZVFWFLSA-N 2 2 308.853 3.272 20 10 DGCDLP Cc1cc(O)c(C[NH+]2CC[C@]3(C2)CCC[N@H+](C)C3)c(Cl)c1 ZINC000840949357 618621491 /nfs/dbraw/zinc/62/14/91/618621491.db2.gz STXHBRCPMWUZLO-QGZVFWFLSA-N 2 2 308.853 3.272 20 10 DGCDLP Cc1cc(O)c(C[N@H+]2CC[C@]3(C2)CCC[NH+](C)C3)c(Cl)c1 ZINC000840949357 618621493 /nfs/dbraw/zinc/62/14/93/618621493.db2.gz STXHBRCPMWUZLO-QGZVFWFLSA-N 2 2 308.853 3.272 20 10 DGCDLP Cc1cc(O)c(C[N@@H+]2CC[C@]3(C2)CCC[NH+](C)C3)c(Cl)c1 ZINC000840949357 618621495 /nfs/dbraw/zinc/62/14/95/618621495.db2.gz STXHBRCPMWUZLO-QGZVFWFLSA-N 2 2 308.853 3.272 20 10 DGCDLP CN(C)c1ccc(/C=C\C[NH+]2CCC(C)([NH+]3CCC3)CC2)cc1 ZINC000895670270 618816086 /nfs/dbraw/zinc/81/60/86/618816086.db2.gz DMTFXYPSNAYFAK-XQRVVYSFSA-N 2 2 313.489 3.326 20 10 DGCDLP C[NH+](C)CC[C@@H]([NH2+][C@H]1CCc2cccc(O)c21)c1cccnc1 ZINC000903381374 619768595 /nfs/dbraw/zinc/76/85/95/619768595.db2.gz WBCQKNTVVGNJGZ-SJORKVTESA-N 2 2 311.429 3.057 20 10 DGCDLP CC(=O)c1cc(Cl)cc(C[NH2+][C@@H]2CC[NH2+]C23CCCC3)c1O ZINC000903487016 619781918 /nfs/dbraw/zinc/78/19/18/619781918.db2.gz ZUQBPRIFXFMYBG-OAHLLOKOSA-N 2 2 322.836 3.013 20 10 DGCDLP CC[N@@H+]1CCC[C@H]1C[NH2+][C@@H](C)c1cc2c(cc1O)CCCC2 ZINC000756356368 621630634 /nfs/dbraw/zinc/63/06/34/621630634.db2.gz AKJRDKCWBPVHNR-YOEHRIQHSA-N 2 2 302.462 3.406 20 10 DGCDLP CC[N@H+]1CCC[C@H]1C[NH2+][C@@H](C)c1cc2c(cc1O)CCCC2 ZINC000756356368 621630637 /nfs/dbraw/zinc/63/06/37/621630637.db2.gz AKJRDKCWBPVHNR-YOEHRIQHSA-N 2 2 302.462 3.406 20 10 DGCDLP CC[N@@H+]1CCC[C@H]1C[NH2+][C@H](C)c1cc2c(cc1O)CCCC2 ZINC000756356365 621630702 /nfs/dbraw/zinc/63/07/02/621630702.db2.gz AKJRDKCWBPVHNR-PBHICJAKSA-N 2 2 302.462 3.406 20 10 DGCDLP CC[N@H+]1CCC[C@H]1C[NH2+][C@H](C)c1cc2c(cc1O)CCCC2 ZINC000756356365 621630703 /nfs/dbraw/zinc/63/07/03/621630703.db2.gz AKJRDKCWBPVHNR-PBHICJAKSA-N 2 2 302.462 3.406 20 10 DGCDLP C[C@H]([NH2+]C1CC[NH+](C2CCC2)CC1)c1cc(F)cc(F)c1O ZINC000756489242 621641506 /nfs/dbraw/zinc/64/15/06/621641506.db2.gz HKVODXIQUGIXAP-NSHDSACASA-N 2 2 310.388 3.338 20 10 DGCDLP CC[NH+]1CCC(CC[NH2+][C@@H](C)c2cc(F)cc(F)c2O)CC1 ZINC000756612046 621652676 /nfs/dbraw/zinc/65/26/76/621652676.db2.gz LSNHJBHJHBWESO-LBPRGKRZSA-N 2 2 312.404 3.443 20 10 DGCDLP CN(C)c1ccc(C[NH2+][C@H](Cn2cc[nH+]c2)c2ccccc2)cc1 ZINC000880568858 624979398 /nfs/dbraw/zinc/97/93/98/624979398.db2.gz FJEWIJNGPSBWIB-HXUWFJFHSA-N 2 2 320.440 3.480 20 10 DGCDLP Oc1c(F)cc(F)cc1C[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000883028688 625903325 /nfs/dbraw/zinc/90/33/25/625903325.db2.gz RQVOELBJNUZHBJ-UHFFFAOYSA-N 2 2 310.388 3.167 20 10 DGCDLP Cc1cc(Cl)cc([C@@H](C)[NH2+][C@H]2CCn3cc[nH+]c3C2)c1O ZINC000808715533 626853196 /nfs/dbraw/zinc/85/31/96/626853196.db2.gz VLILYIHOQWRABP-YPMHNXCESA-N 2 2 305.809 3.216 20 10 DGCDLP C[C@H]([NH2+][C@H](Cn1cc[nH+]c1)C(C)(C)C)c1c(O)cccc1F ZINC000886509030 627154592 /nfs/dbraw/zinc/15/45/92/627154592.db2.gz XWCOPKKRIAKOCZ-SWLSCSKDSA-N 2 2 305.397 3.493 20 10 DGCDLP C[C@@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)c1cccc(C(F)(F)F)c1O ZINC000815578309 627687224 /nfs/dbraw/zinc/68/72/24/627687224.db2.gz LWGFLJHDTZDPHS-NEPJUHHUSA-N 2 2 316.367 3.403 20 10 DGCDLP C[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](C)C1)c1cccc(C(F)(F)F)c1O ZINC000815578309 627687228 /nfs/dbraw/zinc/68/72/28/627687228.db2.gz LWGFLJHDTZDPHS-NEPJUHHUSA-N 2 2 316.367 3.403 20 10 DGCDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+]Cc2cccc(C3CC3)c2)cc1 ZINC000817864416 627951532 /nfs/dbraw/zinc/95/15/32/627951532.db2.gz GTYPFISKDQYKKC-FQEVSTJZSA-N 2 2 309.457 3.420 20 10 DGCDLP C[C@H]([NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1)c1ccc(F)c(F)c1 ZINC000817938169 627966828 /nfs/dbraw/zinc/96/68/28/627966828.db2.gz GABVGLMDLRQUFL-SGTLLEGYSA-N 2 2 319.399 3.381 20 10 DGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+][C@H]2CCC[C@H]2CCCF)cc1 ZINC000817939542 627967701 /nfs/dbraw/zinc/96/77/01/627967701.db2.gz CKPXRDZNOFFDJY-JQHSSLGASA-N 2 2 307.457 3.260 20 10 DGCDLP CC[C@@H](Cc1cccs1)[NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000817941121 627968411 /nfs/dbraw/zinc/96/84/11/627968411.db2.gz JCZHDNYUFDHOLB-MAUKXSAKSA-N 2 2 317.502 3.425 20 10 DGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+][C@@H]2CCCNc3ccccc32)cc1 ZINC000817944338 627969521 /nfs/dbraw/zinc/96/95/21/627969521.db2.gz ZIAJYPZQWCDBEU-UYAOXDASSA-N 2 2 324.472 3.289 20 10 DGCDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+][C@H](c2ccccc2)C2CC2)cc1 ZINC000817942608 627969795 /nfs/dbraw/zinc/96/97/95/627969795.db2.gz PWBBQWVDUSEMOG-VQTJNVASSA-N 2 2 309.457 3.493 20 10 DGCDLP CC[C@H]([NH2+]CC[NH2+]C1CC1)c1ccc(C(F)(F)F)cc1O ZINC000817953560 627973319 /nfs/dbraw/zinc/97/33/19/627973319.db2.gz OFRPSKMLVVZLMT-ZDUSSCGKSA-N 2 2 302.340 3.204 20 10 DGCDLP CC[C@@H]([NH2+][C@H](C[NH3+])C1CC1)c1ccc(C(F)(F)F)cc1O ZINC000817959686 627974824 /nfs/dbraw/zinc/97/48/24/627974824.db2.gz GIJGAACJWZEXRK-CHWSQXEVSA-N 2 2 302.340 3.189 20 10 DGCDLP C[C@H]1CC2(C[N@@H+]1Cc1cc(Cl)cc(F)c1O)CC[NH2+]CC2 ZINC000818430864 628022182 /nfs/dbraw/zinc/02/21/82/628022182.db2.gz AEXCBGJRQALTOY-NSHDSACASA-N 2 2 312.816 3.149 20 10 DGCDLP C[C@H]1CC2(C[N@H+]1Cc1cc(Cl)cc(F)c1O)CC[NH2+]CC2 ZINC000818430864 628022186 /nfs/dbraw/zinc/02/21/86/628022186.db2.gz AEXCBGJRQALTOY-NSHDSACASA-N 2 2 312.816 3.149 20 10 DGCDLP Cc1cc(O)c(C[NH+]2CCC(c3[nH]cc[nH+]3)CC2)cc1Cl ZINC000824639083 628679344 /nfs/dbraw/zinc/67/93/44/628679344.db2.gz GBZSVKCEOKRMBA-UHFFFAOYSA-N 2 2 305.809 3.457 20 10 DGCDLP Oc1cccc2c1[C@@H]([NH2+]Cc1cccc(Cn3cc[nH+]c3)c1)CC2 ZINC000834507710 629718945 /nfs/dbraw/zinc/71/89/45/629718945.db2.gz CNKCXWSMMFXVIL-SFHVURJKSA-N 2 2 319.408 3.414 20 10 DGCDLP C[C@H](CCc1ccccc1)[NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000841044574 630401362 /nfs/dbraw/zinc/40/13/62/630401362.db2.gz DIJWMNZSZNUVFA-OXQOHEQNSA-N 2 2 311.473 3.363 20 10 DGCDLP C[C@@H](CCc1ccsc1)[NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000841046136 630401782 /nfs/dbraw/zinc/40/17/82/630401782.db2.gz WWMNZHAFQCMIFE-KBXCAEBGSA-N 2 2 317.502 3.425 20 10 DGCDLP CC[NH2+]CC1CC[NH+](Cc2cc(Cl)cc(F)c2O)CC1 ZINC000843055930 630609433 /nfs/dbraw/zinc/60/94/33/630609433.db2.gz SBXNHWXMTMWCDR-UHFFFAOYSA-N 2 2 300.805 3.006 20 10 DGCDLP C[C@H]([NH2+]CC[NH+]1CCCC1)c1ccc(N2CCCCC2)cc1 ZINC000178311146 656043474 /nfs/dbraw/zinc/04/34/74/656043474.db2.gz AVJKINBZLAQLLQ-KRWDZBQOSA-N 2 2 301.478 3.423 20 10 DGCDLP CCN(CC)c1ccc(C[N@@H+]2CC[C@H](C[NH+](C)CC)C2)cc1F ZINC000093770230 662359927 /nfs/dbraw/zinc/35/99/27/662359927.db2.gz QRJBIIWFDQHJRT-QGZVFWFLSA-N 2 2 321.484 3.446 20 10 DGCDLP CCN(CC)c1ccc(C[N@H+]2CC[C@H](C[NH+](C)CC)C2)cc1F ZINC000093770230 662359929 /nfs/dbraw/zinc/35/99/29/662359929.db2.gz QRJBIIWFDQHJRT-QGZVFWFLSA-N 2 2 321.484 3.446 20 10 DGCDLP CCN(CC)c1ccc(C[NH+]2CC[C@H](C[N@H+](C)CC)C2)cc1F ZINC000093770230 662359930 /nfs/dbraw/zinc/35/99/30/662359930.db2.gz QRJBIIWFDQHJRT-QGZVFWFLSA-N 2 2 321.484 3.446 20 10 DGCDLP CCN(CC)c1ccc(C[NH+]2CC[C@H](C[N@@H+](C)CC)C2)cc1F ZINC000093770230 662359934 /nfs/dbraw/zinc/35/99/34/662359934.db2.gz QRJBIIWFDQHJRT-QGZVFWFLSA-N 2 2 321.484 3.446 20 10 DGCDLP C[C@@H](C[NH2+]Cc1cc(Cl)cc(F)c1O)C[NH+]1CCCCC1 ZINC001461084060 1182765503 /nfs/dbraw/zinc/76/55/03/1182765503.db2.gz FGGRNXLIILPIKC-LBPRGKRZSA-N 2 2 314.832 3.396 20 10 DGCDLP CC[NH+]1CCC(CC[NH2+]Cc2cc(Cl)cc(F)c2O)CC1 ZINC001474023407 1183852694 /nfs/dbraw/zinc/85/26/94/1183852694.db2.gz ACMWGZKWATUIOB-UHFFFAOYSA-N 2 2 314.832 3.396 20 10 DGCDLP CC[N@@H+]1CCC[C@@H]([NH2+][C@@H](C)Cc2ccc(N(C)C)cc2C)C1 ZINC001621396666 1193837515 /nfs/dbraw/zinc/83/75/15/1193837515.db2.gz PNAVXYNQUDEUSE-FUHWJXTLSA-N 2 2 303.494 3.066 20 10 DGCDLP CC[N@H+]1CCC[C@@H]([NH2+][C@@H](C)Cc2ccc(N(C)C)cc2C)C1 ZINC001621396666 1193837517 /nfs/dbraw/zinc/83/75/17/1193837517.db2.gz PNAVXYNQUDEUSE-FUHWJXTLSA-N 2 2 303.494 3.066 20 10 DGCDLP Cn1cc[nH+]c1C[C@@H]1CCC[N@H+](Cc2ccc(Cl)cc2O)C1 ZINC001652177063 1195557735 /nfs/dbraw/zinc/55/77/35/1195557735.db2.gz OISZTHIDOBRXBG-ZDUSSCGKSA-N 2 2 319.836 3.234 20 10 DGCDLP Cn1cc[nH+]c1C[C@@H]1CCC[N@@H+](Cc2ccc(Cl)cc2O)C1 ZINC001652177063 1195557737 /nfs/dbraw/zinc/55/77/37/1195557737.db2.gz OISZTHIDOBRXBG-ZDUSSCGKSA-N 2 2 319.836 3.234 20 10 DGCDLP c1cc2c(cc1C[NH2+]C[C@H]1CC[N@@H+]1C1CCCC1)CCCO2 ZINC001657784748 1196177749 /nfs/dbraw/zinc/17/77/49/1196177749.db2.gz HYAXQCAHMJZJIN-GOSISDBHSA-N 2 2 300.446 3.118 20 10 DGCDLP c1cc2c(cc1C[NH2+]C[C@H]1CC[N@H+]1C1CCCC1)CCCO2 ZINC001657784748 1196177754 /nfs/dbraw/zinc/17/77/54/1196177754.db2.gz HYAXQCAHMJZJIN-GOSISDBHSA-N 2 2 300.446 3.118 20 10 DGCDLP [NH3+][C@H](c1ccccc1O)[C@H]([NH2+][C@H]1C[C@H]2C[C@H]2C1)c1ccccc1O ZINC001167915119 1084654898 /nfs/dbraw/zinc/65/48/98/1084654898.db2.gz ZQWDATIECIIJAA-DIJDKNKZSA-N 2 2 324.424 3.227 20 10 DGCDLP [NH3+][C@H]1CCC[N@H+](Cc2cc(-c3ccc(F)cc3)ccc2O)C1 ZINC001204885247 1091054960 /nfs/dbraw/zinc/05/49/60/1091054960.db2.gz PORYTBJPQUWHMA-KRWDZBQOSA-N 2 2 300.377 3.121 20 10 DGCDLP [NH3+][C@H]1CCC[N@@H+](Cc2cc(-c3ccc(F)cc3)ccc2O)C1 ZINC001204885247 1091054966 /nfs/dbraw/zinc/05/49/66/1091054966.db2.gz PORYTBJPQUWHMA-KRWDZBQOSA-N 2 2 300.377 3.121 20 10 DGCDLP CC(C)[N@H+](Cc1ccc2c(c1)CCCN2C)C1CC[NH+](C)CC1 ZINC001138359653 1091152082 /nfs/dbraw/zinc/15/20/82/1091152082.db2.gz XRCNEGDQIDDLOB-UHFFFAOYSA-N 2 2 315.505 3.374 20 10 DGCDLP CC(C)[N@@H+](Cc1ccc2c(c1)CCCN2C)C1CC[NH+](C)CC1 ZINC001138359653 1091152087 /nfs/dbraw/zinc/15/20/87/1091152087.db2.gz XRCNEGDQIDDLOB-UHFFFAOYSA-N 2 2 315.505 3.374 20 10 DGCDLP C[C@H]1[C@H](C[NH3+])CCC[N@@H+]1Cc1c(O)ccc(Cl)c1Cl ZINC001205916172 1091412284 /nfs/dbraw/zinc/41/22/84/1091412284.db2.gz SGYMDEUOKFJRHH-UWVGGRQHSA-N 2 2 303.233 3.258 20 10 DGCDLP C[C@H]1[C@H](C[NH3+])CCC[N@H+]1Cc1c(O)ccc(Cl)c1Cl ZINC001205916172 1091412294 /nfs/dbraw/zinc/41/22/94/1091412294.db2.gz SGYMDEUOKFJRHH-UWVGGRQHSA-N 2 2 303.233 3.258 20 10 DGCDLP COc1ccc(C[N@@H+]2CCC[C@](C)(C[NH3+])CC2)c(O)c1Cl ZINC001206327461 1091581790 /nfs/dbraw/zinc/58/17/90/1091581790.db2.gz WRKOMLUZJWSVMK-INIZCTEOSA-N 2 2 312.841 3.005 20 10 DGCDLP COc1ccc(C[N@H+]2CCC[C@](C)(C[NH3+])CC2)c(O)c1Cl ZINC001206327461 1091581799 /nfs/dbraw/zinc/58/17/99/1091581799.db2.gz WRKOMLUZJWSVMK-INIZCTEOSA-N 2 2 312.841 3.005 20 10 DGCDLP CC[NH+](CC)C1CC[NH+](Cc2ccc(N(C)C)c(C)c2)CC1 ZINC001139671870 1091637426 /nfs/dbraw/zinc/63/74/26/1091637426.db2.gz PUXSERLNYBXVIC-UHFFFAOYSA-N 2 2 303.494 3.367 20 10 DGCDLP C[C@@]1(C[NH3+])CCCC[N@H+](Cc2cc(Cl)cc(F)c2O)C1 ZINC001206574160 1091674632 /nfs/dbraw/zinc/67/46/32/1091674632.db2.gz PVAPMUZKPQTZOF-HNNXBMFYSA-N 2 2 300.805 3.136 20 10 DGCDLP C[C@@]1(C[NH3+])CCCC[N@@H+](Cc2cc(Cl)cc(F)c2O)C1 ZINC001206574160 1091674636 /nfs/dbraw/zinc/67/46/36/1091674636.db2.gz PVAPMUZKPQTZOF-HNNXBMFYSA-N 2 2 300.805 3.136 20 10 DGCDLP Oc1ccc(F)cc1C[NH+]1CCC2(CCC[N@@H+]2CC2CC2)CC1 ZINC001140063759 1091755029 /nfs/dbraw/zinc/75/50/29/1091755029.db2.gz YWNUSQYYUNXXIL-UHFFFAOYSA-N 2 2 318.436 3.372 20 10 DGCDLP Oc1ccc(F)cc1C[NH+]1CCC2(CCC[N@H+]2CC2CC2)CC1 ZINC001140063759 1091755034 /nfs/dbraw/zinc/75/50/34/1091755034.db2.gz YWNUSQYYUNXXIL-UHFFFAOYSA-N 2 2 318.436 3.372 20 10 DGCDLP C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1cccc(C(F)(F)F)c1O ZINC001276498310 1091772119 /nfs/dbraw/zinc/77/21/19/1091772119.db2.gz UQHVFCSIJNZYKQ-YHWZYXNKSA-N 2 2 314.351 3.126 20 10 DGCDLP C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1cccc(C(F)(F)F)c1O ZINC001276498310 1091772125 /nfs/dbraw/zinc/77/21/25/1091772125.db2.gz UQHVFCSIJNZYKQ-YHWZYXNKSA-N 2 2 314.351 3.126 20 10 DGCDLP CC(C)(C)c1cccc(C[N@@H+]2CCC[C@@]3(CCC[NH2+]3)C2)c1O ZINC001222354215 1095570394 /nfs/dbraw/zinc/57/03/94/1095570394.db2.gz LCHPRYKESGPYFI-IBGZPJMESA-N 2 2 302.462 3.408 20 10 DGCDLP CC(C)(C)c1cccc(C[N@H+]2CCC[C@@]3(CCC[NH2+]3)C2)c1O ZINC001222354215 1095570404 /nfs/dbraw/zinc/57/04/04/1095570404.db2.gz LCHPRYKESGPYFI-IBGZPJMESA-N 2 2 302.462 3.408 20 10 DGCDLP Cc1cc(C)c(C[N@@H+]2CC[C@H](Oc3cc[nH+]cc3C)C2)c(O)c1 ZINC001231850446 1097864179 /nfs/dbraw/zinc/86/41/79/1097864179.db2.gz PUILUCKBQRCBFP-INIZCTEOSA-N 2 2 312.413 3.366 20 10 DGCDLP Cc1cc(C)c(C[N@H+]2CC[C@H](Oc3cc[nH+]cc3C)C2)c(O)c1 ZINC001231850446 1097864184 /nfs/dbraw/zinc/86/41/84/1097864184.db2.gz PUILUCKBQRCBFP-INIZCTEOSA-N 2 2 312.413 3.366 20 10 DGCDLP COc1cc(O)c(C[NH+]2CCC(n3cc[nH+]c3)CC2)cc1Cl ZINC001232268033 1097988820 /nfs/dbraw/zinc/98/88/20/1097988820.db2.gz LITAZBOCLADCRZ-UHFFFAOYSA-N 2 2 321.808 3.088 20 10 DGCDLP C[C@]1(C[NH3+])CCC[N@H+](Cc2cc(F)cc(Cl)c2O)CC1 ZINC001206326938 1098804574 /nfs/dbraw/zinc/80/45/74/1098804574.db2.gz QWBMEHNLZDYSQO-HNNXBMFYSA-N 2 2 300.805 3.136 20 10 DGCDLP C[C@]1(C[NH3+])CCC[N@@H+](Cc2cc(F)cc(Cl)c2O)CC1 ZINC001206326938 1098804590 /nfs/dbraw/zinc/80/45/90/1098804590.db2.gz QWBMEHNLZDYSQO-HNNXBMFYSA-N 2 2 300.805 3.136 20 10 DGCDLP Oc1cc(Cl)c(F)cc1C[N@@H+]1CCCCC12CC[NH2+]CC2 ZINC001235190676 1098868563 /nfs/dbraw/zinc/86/85/63/1098868563.db2.gz HMGAVAJWCKPGDK-UHFFFAOYSA-N 2 2 312.816 3.293 20 10 DGCDLP Oc1cc(Cl)c(F)cc1C[N@H+]1CCCCC12CC[NH2+]CC2 ZINC001235190676 1098868572 /nfs/dbraw/zinc/86/85/72/1098868572.db2.gz HMGAVAJWCKPGDK-UHFFFAOYSA-N 2 2 312.816 3.293 20 10 DGCDLP Oc1cc2c(cc1O)C[N@H+](CCC[NH2+]C1CCCCC1)CCC2 ZINC001236101101 1099389834 /nfs/dbraw/zinc/38/98/34/1099389834.db2.gz UQBKUKLVEYZIPW-UHFFFAOYSA-N 2 2 318.461 3.158 20 10 DGCDLP Oc1cc2c(cc1O)C[N@@H+](CCC[NH2+]C1CCCCC1)CCC2 ZINC001236101101 1099389843 /nfs/dbraw/zinc/38/98/43/1099389843.db2.gz UQBKUKLVEYZIPW-UHFFFAOYSA-N 2 2 318.461 3.158 20 10 DGCDLP Cc1cccc(O)c1C[N@H+](Cc1ccccc1)[C@H]1CCC[NH2+]C1 ZINC001236269891 1099511319 /nfs/dbraw/zinc/51/13/19/1099511319.db2.gz IXMFZBGZFVHPBY-SFHVURJKSA-N 2 2 310.441 3.455 20 10 DGCDLP Cc1cccc(O)c1C[N@@H+](Cc1ccccc1)[C@H]1CCC[NH2+]C1 ZINC001236269891 1099511330 /nfs/dbraw/zinc/51/13/30/1099511330.db2.gz IXMFZBGZFVHPBY-SFHVURJKSA-N 2 2 310.441 3.455 20 10 DGCDLP Cc1cc(F)cc(C[NH+]2CCC([NH+]3CCC(F)CC3)CC2)c1O ZINC001238071052 1100350197 /nfs/dbraw/zinc/35/01/97/1100350197.db2.gz RGWGGXYFBXMVOQ-UHFFFAOYSA-N 2 2 324.415 3.238 20 10 DGCDLP Cc1ccc(NCc2ccc(N3CC[NH+](C)CC3)cc2)c(C)[nH+]1 ZINC001201573242 1102658102 /nfs/dbraw/zinc/65/81/02/1102658102.db2.gz PRFYFAUQIFVVFV-UHFFFAOYSA-N 2 2 310.445 3.062 20 10 DGCDLP CN(C)c1ccc(C[NH+]2CC3(C2)CC[N@H+](C)C3)c2ccccc21 ZINC001275938885 1104962433 /nfs/dbraw/zinc/96/24/33/1104962433.db2.gz ZZCGIXYNTVTVCN-UHFFFAOYSA-N 2 2 309.457 3.043 20 10 DGCDLP CN(C)c1ccc(C[NH+]2CC3(C2)CC[N@@H+](C)C3)c2ccccc21 ZINC001275938885 1104962437 /nfs/dbraw/zinc/96/24/37/1104962437.db2.gz ZZCGIXYNTVTVCN-UHFFFAOYSA-N 2 2 309.457 3.043 20 10 DGCDLP CN(C)c1ccc(C[N@@H+]2CCC[C@@]3(CC[NH+](C)C3)C2)c(Cl)c1 ZINC001276156037 1105033374 /nfs/dbraw/zinc/03/33/74/1105033374.db2.gz MLCJFBKRVPMWII-SFHVURJKSA-N 2 2 321.896 3.324 20 10 DGCDLP CN(C)c1ccc(C[N@H+]2CCC[C@@]3(CC[NH+](C)C3)C2)c(Cl)c1 ZINC001276156037 1105033379 /nfs/dbraw/zinc/03/33/79/1105033379.db2.gz MLCJFBKRVPMWII-SFHVURJKSA-N 2 2 321.896 3.324 20 10 DGCDLP CN(C)c1ccc(C[NH+]2CCC[C@@]3(CC[N@H+](C)C3)C2)c(Cl)c1 ZINC001276156037 1105033383 /nfs/dbraw/zinc/03/33/83/1105033383.db2.gz MLCJFBKRVPMWII-SFHVURJKSA-N 2 2 321.896 3.324 20 10 DGCDLP CN(C)c1ccc(C[NH+]2CCC[C@@]3(CC[N@@H+](C)C3)C2)c(Cl)c1 ZINC001276156037 1105033388 /nfs/dbraw/zinc/03/33/88/1105033388.db2.gz MLCJFBKRVPMWII-SFHVURJKSA-N 2 2 321.896 3.324 20 10 DGCDLP CC(C)(C)[NH+]1CCC([N@@H+]2CCCc3cc(O)c(O)cc3C2)CC1 ZINC001256575642 1106448480 /nfs/dbraw/zinc/44/84/80/1106448480.db2.gz SVMHBKQFPSUMPC-UHFFFAOYSA-N 2 2 318.461 3.109 20 10 DGCDLP CC(C)(C)[NH+]1CCC([N@H+]2CCCc3cc(O)c(O)cc3C2)CC1 ZINC001256575642 1106448481 /nfs/dbraw/zinc/44/84/81/1106448481.db2.gz SVMHBKQFPSUMPC-UHFFFAOYSA-N 2 2 318.461 3.109 20 10 DGCDLP Cn1cc[nH+]c1C[C@H]1CCC[N@H+](Cc2c(O)cccc2Cl)C1 ZINC001319947492 1108708714 /nfs/dbraw/zinc/70/87/14/1108708714.db2.gz UEDXUDOUTXWNFG-CYBMUJFWSA-N 2 2 319.836 3.234 20 10 DGCDLP Cn1cc[nH+]c1C[C@H]1CCC[N@@H+](Cc2c(O)cccc2Cl)C1 ZINC001319947492 1108708719 /nfs/dbraw/zinc/70/87/19/1108708719.db2.gz UEDXUDOUTXWNFG-CYBMUJFWSA-N 2 2 319.836 3.234 20 10 DGCDLP C[C@@H](C[NH2+]Cc1ccc(N2CCCCC2)cc1)Cn1cc[nH+]c1 ZINC000067500812 432032474 /nfs/dbraw/zinc/03/24/74/432032474.db2.gz ZTTXHFFFSPYWHI-KRWDZBQOSA-N 2 2 312.461 3.299 20 10 DGCDLP Cc1cc(Cl)cc(C[NH+]2CCC([NH+]3CCCC3)CC2)c1O ZINC000179670134 432066962 /nfs/dbraw/zinc/06/69/62/432066962.db2.gz PNPCLWKBGKMHLF-UHFFFAOYSA-N 2 2 308.853 3.414 20 10 DGCDLP CCCOc1ccc(C[N@@H+]2CCC[C@H](c3[nH]cc[nH+]3)C2)c(O)c1 ZINC000092073227 400153471 /nfs/dbraw/zinc/15/34/71/400153471.db2.gz RTRUQOYYWKWMAO-HNNXBMFYSA-N 2 2 315.417 3.284 20 10 DGCDLP CCCOc1ccc(C[N@H+]2CCC[C@H](c3[nH]cc[nH+]3)C2)c(O)c1 ZINC000092073227 400153476 /nfs/dbraw/zinc/15/34/76/400153476.db2.gz RTRUQOYYWKWMAO-HNNXBMFYSA-N 2 2 315.417 3.284 20 10 DGCDLP C[N@H+]1CC=C(C[NH2+]Cc2cc(Cl)cc(Cl)c2O)CC1 ZINC000271832661 432426100 /nfs/dbraw/zinc/42/61/00/432426100.db2.gz OZNRPGNZJCNWPF-UHFFFAOYSA-N 2 2 301.217 3.051 20 10 DGCDLP C[N@@H+]1CC=C(C[NH2+]Cc2cc(Cl)cc(Cl)c2O)CC1 ZINC000271832661 432426104 /nfs/dbraw/zinc/42/61/04/432426104.db2.gz OZNRPGNZJCNWPF-UHFFFAOYSA-N 2 2 301.217 3.051 20 10 DGCDLP Oc1ccc(Cl)c(F)c1C[N@@H+]1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000365260152 434296791 /nfs/dbraw/zinc/29/67/91/434296791.db2.gz SNJAXTBBISBYLG-JTQLQIEISA-N 2 2 309.772 3.287 20 10 DGCDLP Oc1ccc(Cl)c(F)c1C[N@H+]1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000365260152 434296798 /nfs/dbraw/zinc/29/67/98/434296798.db2.gz SNJAXTBBISBYLG-JTQLQIEISA-N 2 2 309.772 3.287 20 10 DGCDLP Oc1cccc2c1[C@@H]([NH2+]C1CC[NH+](Cc3ccccn3)CC1)CC2 ZINC000295925921 434445586 /nfs/dbraw/zinc/44/55/86/434445586.db2.gz JXXPINPJXLTBRL-SFHVURJKSA-N 2 2 323.440 3.029 20 10 DGCDLP CC[C@@H]([NH2+]C[C@@H]1CCc2[nH+]ccn2C1)c1ccc(F)cc1O ZINC000287675883 434423885 /nfs/dbraw/zinc/42/38/85/434423885.db2.gz VZPUOQPYEZOQOV-SWLSCSKDSA-N 2 2 303.381 3.031 20 10 DGCDLP COc1cc(Cl)cc(C[NH+]2CCC(n3cc[nH+]c3)CC2)c1O ZINC000184684672 522537135 /nfs/dbraw/zinc/53/71/35/522537135.db2.gz KNWIELKRPQLLDD-UHFFFAOYSA-N 2 2 321.808 3.088 20 10 DGCDLP C[C@H](C[NH2+]Cc1cc(Cl)cc(Cl)c1O)Cn1cc[nH+]c1 ZINC000237532679 524488049 /nfs/dbraw/zinc/48/80/49/524488049.db2.gz DKAKBZKBGUAUEN-SNVBAGLBSA-N 2 2 314.216 3.321 20 10 DGCDLP Oc1ccc(-c2ccccc2)cc1C[NH2+][C@H]1CC[N@@H+](C2CC2)C1 ZINC000729681964 575260338 /nfs/dbraw/zinc/26/03/38/575260338.db2.gz PJSAIXDMOVJPPK-SFHVURJKSA-N 2 2 308.425 3.386 20 10 DGCDLP Oc1ccc(-c2ccccc2)cc1C[NH2+][C@H]1CC[N@H+](C2CC2)C1 ZINC000729681964 575260340 /nfs/dbraw/zinc/26/03/40/575260340.db2.gz PJSAIXDMOVJPPK-SFHVURJKSA-N 2 2 308.425 3.386 20 10 DGCDLP CC(C)(C[NH2+]Cc1cc(Cl)cc(F)c1O)C[NH+]1CCCC1 ZINC000792195113 618434226 /nfs/dbraw/zinc/43/42/26/618434226.db2.gz CNWRVMYBRLWICK-UHFFFAOYSA-N 2 2 314.832 3.396 20 10 DGCDLP C[C@@H]([NH2+]CCC(C)(C)[NH3+])c1cc(Br)c(F)cc1O ZINC000925738273 618591259 /nfs/dbraw/zinc/59/12/59/618591259.db2.gz PSFAWKYVZGQQLW-MRVPVSSYSA-N 2 2 319.218 3.072 20 10 DGCDLP COc1cc(C)cc(C[NH2+][C@@H](Cn2cc[nH+]c2)C(C)(C)C)c1O ZINC000894199496 618727112 /nfs/dbraw/zinc/72/71/12/618727112.db2.gz LCSFSSVZVJQAMV-INIZCTEOSA-N 2 2 317.433 3.110 20 10 DGCDLP Cc1cc(O)c(C[NH+]2CCC(C)([NH+]3CCC3)CC2)cc1Cl ZINC000895670252 618815779 /nfs/dbraw/zinc/81/57/79/618815779.db2.gz DIXMZYIHZUCNEL-UHFFFAOYSA-N 2 2 308.853 3.414 20 10 DGCDLP Cc1cc(O)c(C[NH+]2CCC(C)([NH+]3CCC3)CC2)c(Cl)c1 ZINC000895670318 618815807 /nfs/dbraw/zinc/81/58/07/618815807.db2.gz DRIZCKRMVFULDJ-UHFFFAOYSA-N 2 2 308.853 3.414 20 10 DGCDLP Oc1c(Cl)cccc1C[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000898218694 619222970 /nfs/dbraw/zinc/22/29/70/619222970.db2.gz NAKIAZZWLGBNSL-UHFFFAOYSA-N 2 2 317.820 3.199 20 10 DGCDLP C[C@H](CCc1ccsc1)[NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000841046139 619247372 /nfs/dbraw/zinc/24/73/72/619247372.db2.gz WWMNZHAFQCMIFE-RDTXWAMCSA-N 2 2 317.502 3.425 20 10 DGCDLP Cc1ccc(O)c([C@H](C)[NH2+][C@H](CC[NH+](C)C)c2cccnc2)c1 ZINC000903378468 619768295 /nfs/dbraw/zinc/76/82/95/619768295.db2.gz CJPAQOLGAMFNJI-MAUKXSAKSA-N 2 2 313.445 3.439 20 10 DGCDLP C[C@@H]([NH2+][C@@H](CC[NH+](C)C)c1cccnc1)c1cc(F)ccc1O ZINC000903381872 619769157 /nfs/dbraw/zinc/76/91/57/619769157.db2.gz ZJUPOCXANYVBII-DYVFJYSZSA-N 2 2 317.408 3.270 20 10 DGCDLP C[N@@H+](Cc1ccc(N2CCCCC2)cc1)C[C@H]([NH3+])CC(F)F ZINC000903874008 619827485 /nfs/dbraw/zinc/82/74/85/619827485.db2.gz QKLCRAQNYQUVKV-OAHLLOKOSA-N 2 2 311.420 3.091 20 10 DGCDLP C[N@H+](Cc1ccc(N2CCCCC2)cc1)C[C@H]([NH3+])CC(F)F ZINC000903874008 619827489 /nfs/dbraw/zinc/82/74/89/619827489.db2.gz QKLCRAQNYQUVKV-OAHLLOKOSA-N 2 2 311.420 3.091 20 10 DGCDLP C[NH+](C)CC[C@H]([NH2+]Cc1cc(Cl)ccc1O)c1cccnc1 ZINC000922629862 621070065 /nfs/dbraw/zinc/07/00/65/621070065.db2.gz AEGZPQGIJBNKKZ-INIZCTEOSA-N 2 2 319.836 3.223 20 10 DGCDLP CCC[NH+]1CCC(C[NH2+][C@H](C)c2cc(F)cc(F)c2O)CC1 ZINC000756532808 621645618 /nfs/dbraw/zinc/64/56/18/621645618.db2.gz GJQVKXUEKSIRQT-GFCCVEGCSA-N 2 2 312.404 3.443 20 10 DGCDLP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@@H](C)c2cc(F)cc(F)c2O)C1 ZINC000756546346 621646397 /nfs/dbraw/zinc/64/63/97/621646397.db2.gz OWFDCATVSIKMCA-QWHCGFSZSA-N 2 2 312.404 3.441 20 10 DGCDLP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@@H](C)c2cc(F)cc(F)c2O)C1 ZINC000756546346 621646400 /nfs/dbraw/zinc/64/64/00/621646400.db2.gz OWFDCATVSIKMCA-QWHCGFSZSA-N 2 2 312.404 3.441 20 10 DGCDLP C[C@H]([NH2+][C@H]1CC[C@@H](C)[NH2+]C1)c1ccc(N2CCCCC2)cc1 ZINC000863545397 621682467 /nfs/dbraw/zinc/68/24/67/621682467.db2.gz QRLUIVGEWXFPEZ-RYRKJORJSA-N 2 2 301.478 3.468 20 10 DGCDLP [NH3+]C[C@@H]1C[N@H+](Cc2cccc(Cl)c2O)CC[C@@H]1C(F)(F)F ZINC000863645975 621693278 /nfs/dbraw/zinc/69/32/78/621693278.db2.gz OZHJDYCLPVBECJ-MNOVXSKESA-N 2 2 322.758 3.005 20 10 DGCDLP [NH3+]C[C@@H]1C[N@@H+](Cc2cccc(Cl)c2O)CC[C@@H]1C(F)(F)F ZINC000863645975 621693280 /nfs/dbraw/zinc/69/32/80/621693280.db2.gz OZHJDYCLPVBECJ-MNOVXSKESA-N 2 2 322.758 3.005 20 10 DGCDLP CC[C@H]([NH2+]CCCCn1cc[nH+]c1)c1ccc(N(C)C)cc1 ZINC000765258383 622254893 /nfs/dbraw/zinc/25/48/93/622254893.db2.gz LAQUTEBGJCCTIF-SFHVURJKSA-N 2 2 300.450 3.470 20 10 DGCDLP CN(C)c1ccc(C[N@@H+]2CC[C@H](C[NH+](C)CC3CC3)C2)cc1F ZINC000769516960 622537159 /nfs/dbraw/zinc/53/71/59/622537159.db2.gz WOLMVMUJHLBELL-QGZVFWFLSA-N 2 2 319.468 3.055 20 10 DGCDLP CN(C)c1ccc(C[N@H+]2CC[C@H](C[NH+](C)CC3CC3)C2)cc1F ZINC000769516960 622537162 /nfs/dbraw/zinc/53/71/62/622537162.db2.gz WOLMVMUJHLBELL-QGZVFWFLSA-N 2 2 319.468 3.055 20 10 DGCDLP CN(C)c1ccc(C[NH+]2CC[C@H](C[N@H+](C)CC3CC3)C2)cc1F ZINC000769516960 622537165 /nfs/dbraw/zinc/53/71/65/622537165.db2.gz WOLMVMUJHLBELL-QGZVFWFLSA-N 2 2 319.468 3.055 20 10 DGCDLP CN(C)c1ccc(C[NH+]2CC[C@H](C[N@@H+](C)CC3CC3)C2)cc1F ZINC000769516960 622537169 /nfs/dbraw/zinc/53/71/69/622537169.db2.gz WOLMVMUJHLBELL-QGZVFWFLSA-N 2 2 319.468 3.055 20 10 DGCDLP C[NH+](C)CCC1CC[NH+](Cc2cc(Cl)cc(F)c2O)CC1 ZINC000775663087 623308649 /nfs/dbraw/zinc/30/86/49/623308649.db2.gz KBMHSYAXTJRFHE-UHFFFAOYSA-N 2 2 314.832 3.348 20 10 DGCDLP C[NH+](C)CC1(C[NH2+]Cc2c(O)ccc(Cl)c2F)CCCC1 ZINC000790985764 625731057 /nfs/dbraw/zinc/73/10/57/625731057.db2.gz BRODYUNABNUSME-UHFFFAOYSA-N 2 2 314.832 3.396 20 10 DGCDLP C[C@@H]([NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1)c1c(O)cccc1F ZINC000886639841 627178666 /nfs/dbraw/zinc/17/86/66/627178666.db2.gz MRBKWGMSHOAFDY-UKRRQHHQSA-N 2 2 306.425 3.304 20 10 DGCDLP C[C@@H]([NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1)c1c(O)cccc1F ZINC000886639841 627178669 /nfs/dbraw/zinc/17/86/69/627178669.db2.gz MRBKWGMSHOAFDY-UKRRQHHQSA-N 2 2 306.425 3.304 20 10 DGCDLP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2cc(Cl)c(F)cc2O)C[C@H]1C ZINC000816515145 627800777 /nfs/dbraw/zinc/80/07/77/627800777.db2.gz QTDQMNAASIYZEI-DGCLKSJQSA-N 2 2 314.832 3.489 20 10 DGCDLP CC[N@H+]1CC[C@@H]([NH+](C)Cc2cc(Cl)c(F)cc2O)C[C@H]1C ZINC000816515145 627800778 /nfs/dbraw/zinc/80/07/78/627800778.db2.gz QTDQMNAASIYZEI-DGCLKSJQSA-N 2 2 314.832 3.489 20 10 DGCDLP CC[NH+]1CC[C@@H]([N@H+](C)Cc2cc(Cl)c(F)cc2O)C[C@H]1C ZINC000816515145 627800779 /nfs/dbraw/zinc/80/07/79/627800779.db2.gz QTDQMNAASIYZEI-DGCLKSJQSA-N 2 2 314.832 3.489 20 10 DGCDLP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2cc(Cl)c(F)cc2O)C[C@H]1C ZINC000816515145 627800780 /nfs/dbraw/zinc/80/07/80/627800780.db2.gz QTDQMNAASIYZEI-DGCLKSJQSA-N 2 2 314.832 3.489 20 10 DGCDLP CC[N@@H+]1CCC[C@@H](C[NH2+]Cc2cc(Cl)c(F)cc2O)C1 ZINC000816543520 627804814 /nfs/dbraw/zinc/80/48/14/627804814.db2.gz DMYALFKQYSXFOH-NSHDSACASA-N 2 2 300.805 3.006 20 10 DGCDLP CC[N@H+]1CCC[C@@H](C[NH2+]Cc2cc(Cl)c(F)cc2O)C1 ZINC000816543520 627804819 /nfs/dbraw/zinc/80/48/19/627804819.db2.gz DMYALFKQYSXFOH-NSHDSACASA-N 2 2 300.805 3.006 20 10 DGCDLP Cc1cc(Cl)cc(C[NH+]2CC[C@@]3(C2)CCC[N@@H+](C)C3)c1O ZINC000816643064 627818177 /nfs/dbraw/zinc/81/81/77/627818177.db2.gz UDTJHSMRWPDUAQ-KRWDZBQOSA-N 2 2 308.853 3.272 20 10 DGCDLP Cc1cc(Cl)cc(C[NH+]2CC[C@@]3(C2)CCC[N@H+](C)C3)c1O ZINC000816643064 627818181 /nfs/dbraw/zinc/81/81/81/627818181.db2.gz UDTJHSMRWPDUAQ-KRWDZBQOSA-N 2 2 308.853 3.272 20 10 DGCDLP Cc1cc(Cl)cc(C[N@H+]2CC[C@@]3(C2)CCC[NH+](C)C3)c1O ZINC000816643064 627818185 /nfs/dbraw/zinc/81/81/85/627818185.db2.gz UDTJHSMRWPDUAQ-KRWDZBQOSA-N 2 2 308.853 3.272 20 10 DGCDLP Cc1cc(Cl)cc(C[N@@H+]2CC[C@@]3(C2)CCC[NH+](C)C3)c1O ZINC000816643064 627818189 /nfs/dbraw/zinc/81/81/89/627818189.db2.gz UDTJHSMRWPDUAQ-KRWDZBQOSA-N 2 2 308.853 3.272 20 10 DGCDLP C[C@H]([NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1)c1cc(F)cc(F)c1 ZINC000817938564 627966311 /nfs/dbraw/zinc/96/63/11/627966311.db2.gz NGKWQHKPIXQQLN-KPZWWZAWSA-N 2 2 319.399 3.381 20 10 DGCDLP COc1ccccc1[C@@H](C)[NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000817937986 627966575 /nfs/dbraw/zinc/96/65/75/627966575.db2.gz AWYGRBUSDANTDC-RDTXWAMCSA-N 2 2 313.445 3.112 20 10 DGCDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+][C@@H]2CCCc3ccccc32)cc1 ZINC000817938531 627966675 /nfs/dbraw/zinc/96/66/75/627966675.db2.gz MMOZDKDCAJXQLR-VQTJNVASSA-N 2 2 309.457 3.420 20 10 DGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+][C@@H]2CCCc3ccccc32)cc1 ZINC000817938532 627966756 /nfs/dbraw/zinc/96/67/56/627966756.db2.gz MMOZDKDCAJXQLR-WOJBJXKFSA-N 2 2 309.457 3.420 20 10 DGCDLP Cc1nc(C)c([C@H](C)[NH2+]C[C@H]([NH3+])c2ccc(N(C)C)cc2)s1 ZINC000817938658 627968013 /nfs/dbraw/zinc/96/80/13/627968013.db2.gz OYUOHGYPLIACFH-ZBEGNZNMSA-N 2 2 318.490 3.177 20 10 DGCDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+][C@@H]2CCCNc3ccccc32)cc1 ZINC000817944335 627969535 /nfs/dbraw/zinc/96/95/35/627969535.db2.gz ZIAJYPZQWCDBEU-AZUAARDMSA-N 2 2 324.472 3.289 20 10 DGCDLP CSCC1CCC([NH2+]C[C@H]([NH3+])c2ccc(N(C)C)cc2)CC1 ZINC000817942347 627969938 /nfs/dbraw/zinc/96/99/38/627969938.db2.gz OISOFGHHVJPDFM-PVARCSIZSA-N 2 2 321.534 3.264 20 10 DGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+][C@H]2CCCC23CCCC3)cc1 ZINC000817943309 627970043 /nfs/dbraw/zinc/97/00/43/627970043.db2.gz UGXQBZACARFFNA-MSOLQXFVSA-N 2 2 301.478 3.455 20 10 DGCDLP COc1ccsc1[C@H](C)[NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000817943865 627970050 /nfs/dbraw/zinc/97/00/50/627970050.db2.gz WEHKLBRCWVTNDS-SWLSCSKDSA-N 2 2 319.474 3.173 20 10 DGCDLP C[C@H]([NH2+]C[C@@H]1CCCC[NH2+]1)c1ccc(N2CCCCC2)cc1 ZINC000817945854 627970520 /nfs/dbraw/zinc/97/05/20/627970520.db2.gz NINLLWDPKPRFBX-WMZOPIPTSA-N 2 2 301.478 3.470 20 10 DGCDLP CC[C@H]([NH2+][C@H](C[NH3+])C1CC1)c1ccc(C(F)(F)F)cc1O ZINC000817959688 627975426 /nfs/dbraw/zinc/97/54/26/627975426.db2.gz GIJGAACJWZEXRK-QWHCGFSZSA-N 2 2 302.340 3.189 20 10 DGCDLP C[C@@H]([NH2+]CCC[NH2+]C1CC1)c1cccc(C(F)(F)F)c1O ZINC000817984115 627983373 /nfs/dbraw/zinc/98/33/73/627983373.db2.gz NIXBMAOBOHQDLB-SNVBAGLBSA-N 2 2 302.340 3.204 20 10 DGCDLP Cc1cc(N(C)C)ccc1C[NH2+][C@H](Cn1cc[nH+]c1)C(C)(C)C ZINC000840929924 630379404 /nfs/dbraw/zinc/37/94/04/630379404.db2.gz QOZNPPSKSIQWKB-GOSISDBHSA-N 2 2 314.477 3.462 20 10 DGCDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+]Cc2ccc(C3CC3)cc2)cc1 ZINC000841040866 630400271 /nfs/dbraw/zinc/40/02/71/630400271.db2.gz ARHSRCYEJLWQFU-FQEVSTJZSA-N 2 2 309.457 3.420 20 10 DGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+]Cc2nccc3ccccc32)cc1 ZINC000841042325 630400630 /nfs/dbraw/zinc/40/06/30/630400630.db2.gz IANYFTLCCGKXIN-LJQANCHMSA-N 2 2 320.440 3.090 20 10 DGCDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+]Cc2cnc3ccccc3c2)cc1 ZINC000841044924 630401415 /nfs/dbraw/zinc/40/14/15/630401415.db2.gz FYHJJOXTZDIMAD-IBGZPJMESA-N 2 2 320.440 3.090 20 10 DGCDLP C[C@H](C[NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1)c1ccc(F)cc1 ZINC000841042740 630401418 /nfs/dbraw/zinc/40/14/18/630401418.db2.gz NCJUYZMWKSZEES-KUHUBIRLSA-N 2 2 315.436 3.285 20 10 DGCDLP Oc1ccc(Cl)c(F)c1C[N@@H+]1CCCC[C@H]1[C@H]1CC[NH2+]C1 ZINC000841085714 630405996 /nfs/dbraw/zinc/40/59/96/630405996.db2.gz BJIFPAYFKQCFMY-FZMZJTMJSA-N 2 2 312.816 3.149 20 10 DGCDLP Oc1ccc(Cl)c(F)c1C[N@H+]1CCCC[C@H]1[C@H]1CC[NH2+]C1 ZINC000841085714 630405997 /nfs/dbraw/zinc/40/59/97/630405997.db2.gz BJIFPAYFKQCFMY-FZMZJTMJSA-N 2 2 312.816 3.149 20 10 DGCDLP CC(=O)c1cc(Cl)cc(C[NH2+][C@@H](C[NH3+])C2CCCCC2)c1O ZINC000842475785 630539630 /nfs/dbraw/zinc/53/96/30/630539630.db2.gz CMLKUYGDTOBPEQ-INIZCTEOSA-N 2 2 324.852 3.245 20 10 DGCDLP CN(C)c1ccc(/C=C/C[N@@H+]2CCCC[C@@H]2[C@@H]2CCC[NH2+]2)cc1 ZINC000843048122 630608568 /nfs/dbraw/zinc/60/85/68/630608568.db2.gz OAFVERRODSYCKB-RLWBPELLSA-N 2 2 313.489 3.372 20 10 DGCDLP CN(C)c1ccc(/C=C/C[N@H+]2CCCC[C@@H]2[C@@H]2CCC[NH2+]2)cc1 ZINC000843048122 630608569 /nfs/dbraw/zinc/60/85/69/630608569.db2.gz OAFVERRODSYCKB-RLWBPELLSA-N 2 2 313.489 3.372 20 10 DGCDLP C[C@@H]1CCC[N@H+](Cc2c(O)ccc(Cl)c2F)[C@@H]1CC[NH3+] ZINC000844900687 630970717 /nfs/dbraw/zinc/97/07/17/630970717.db2.gz CQEYFWAGPMEDNQ-ZWNOBZJWSA-N 2 2 300.805 3.134 20 10 DGCDLP COc1cccc([C@@H](C)[NH2+][C@H](Cn2cc[nH+]c2)C(C)(C)C)c1O ZINC000846144940 631211921 /nfs/dbraw/zinc/21/19/21/631211921.db2.gz ODWLNABXYFYLIZ-CZUORRHYSA-N 2 2 317.433 3.363 20 10 DGCDLP CC(C)C[N@H+](C)CCC[NH2+][C@@H](C)c1cc(F)cc(F)c1O ZINC000846178473 631213897 /nfs/dbraw/zinc/21/38/97/631213897.db2.gz WDISTLWAHGTIJE-LBPRGKRZSA-N 2 2 300.393 3.299 20 10 DGCDLP CC(C)C[N@@H+](C)CCC[NH2+][C@@H](C)c1cc(F)cc(F)c1O ZINC000846178473 631213898 /nfs/dbraw/zinc/21/38/98/631213898.db2.gz WDISTLWAHGTIJE-LBPRGKRZSA-N 2 2 300.393 3.299 20 10 DGCDLP C[C@@H]1C[C@H]([NH3+])CC[N@@H+]1Cc1ccc(N(C)C)cc1C(F)(F)F ZINC000846704291 631289875 /nfs/dbraw/zinc/28/98/75/631289875.db2.gz UIQCEXXXLAXETE-DGCLKSJQSA-N 2 2 315.383 3.083 20 10 DGCDLP C[C@@H]1C[C@H]([NH3+])CC[N@H+]1Cc1ccc(N(C)C)cc1C(F)(F)F ZINC000846704291 631289879 /nfs/dbraw/zinc/28/98/79/631289879.db2.gz UIQCEXXXLAXETE-DGCLKSJQSA-N 2 2 315.383 3.083 20 10 DGCDLP C[C@H]1C[C@H]([NH3+])CC[N@@H+]1Cc1ccc(N(C)C)cc1C(F)(F)F ZINC000846704292 631290055 /nfs/dbraw/zinc/29/00/55/631290055.db2.gz UIQCEXXXLAXETE-WCQYABFASA-N 2 2 315.383 3.083 20 10 DGCDLP C[C@H]1C[C@H]([NH3+])CC[N@H+]1Cc1ccc(N(C)C)cc1C(F)(F)F ZINC000846704292 631290060 /nfs/dbraw/zinc/29/00/60/631290060.db2.gz UIQCEXXXLAXETE-WCQYABFASA-N 2 2 315.383 3.083 20 10 DGCDLP COc1cccc([C@H](C)[NH2+][C@H]2CCC[N@@H+]3CCCC[C@@H]23)c1O ZINC000848568258 631697181 /nfs/dbraw/zinc/69/71/81/631697181.db2.gz CFTVSVIUGPYGNU-BPUTZDHNSA-N 2 2 304.434 3.068 20 10 DGCDLP COc1cccc([C@H](C)[NH2+][C@H]2CCC[N@H+]3CCCC[C@@H]23)c1O ZINC000848568258 631697183 /nfs/dbraw/zinc/69/71/83/631697183.db2.gz CFTVSVIUGPYGNU-BPUTZDHNSA-N 2 2 304.434 3.068 20 10 DGCDLP C[C@@H]([NH2+][C@@H](Cn1cc[nH+]c1)C(C)(C)C)c1cc(F)ccc1O ZINC000317536500 656629028 /nfs/dbraw/zinc/62/90/28/656629028.db2.gz KXOWZZOBFOXUKX-WBMJQRKESA-N 2 2 305.397 3.493 20 10 DGCDLP CCN(C)c1ccc([C@@H](C)[NH2+][C@@H]2CC[N@H+](CC3CC3)C2)cc1 ZINC000157650950 659074438 /nfs/dbraw/zinc/07/44/38/659074438.db2.gz OCNZLAROFHONSN-CRAIPNDOSA-N 2 2 301.478 3.278 20 10 DGCDLP CCN(C)c1ccc([C@@H](C)[NH2+][C@@H]2CC[N@@H+](CC3CC3)C2)cc1 ZINC000157650950 659074445 /nfs/dbraw/zinc/07/44/45/659074445.db2.gz OCNZLAROFHONSN-CRAIPNDOSA-N 2 2 301.478 3.278 20 10 DGCDLP [NH3+]C[C@]12C[N@H+](Cc3c(O)ccc(Cl)c3F)C[C@H]1CCCC2 ZINC001580256807 1192016851 /nfs/dbraw/zinc/01/68/51/1192016851.db2.gz YNHAUXUQZFHCCC-BDJLRTHQSA-N 2 2 312.816 3.136 20 10 DGCDLP [NH3+]C[C@]12C[N@@H+](Cc3c(O)ccc(Cl)c3F)C[C@H]1CCCC2 ZINC001580256807 1192016854 /nfs/dbraw/zinc/01/68/54/1192016854.db2.gz YNHAUXUQZFHCCC-BDJLRTHQSA-N 2 2 312.816 3.136 20 10 DGCDLP Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]Cc1cc(N(C)C)cc[nH+]1 ZINC001331995167 1178332471 /nfs/dbraw/zinc/33/24/71/1178332471.db2.gz BNRCRKQYIVRKHD-CJNGLKHVSA-N 2 2 311.429 3.500 20 10 DGCDLP CN(C)c1ccc(/C=C\C[NH2+]C[C@@H]2CCCC[N@@H+]2C2CC2)cc1 ZINC001474137481 1183873309 /nfs/dbraw/zinc/87/33/09/1183873309.db2.gz FRXQDLGPWIGAFP-PRPIBZDOSA-N 2 2 313.489 3.372 20 10 DGCDLP CN(C)c1ccc(/C=C\C[NH2+]C[C@@H]2CCCC[N@H+]2C2CC2)cc1 ZINC001474137481 1183873313 /nfs/dbraw/zinc/87/33/13/1183873313.db2.gz FRXQDLGPWIGAFP-PRPIBZDOSA-N 2 2 313.489 3.372 20 10 DGCDLP c1cc2c(cc1C[NH2+]C[C@@H]1CC[N@@H+]1C1CCCC1)CCCO2 ZINC001657784749 1196178052 /nfs/dbraw/zinc/17/80/52/1196178052.db2.gz HYAXQCAHMJZJIN-SFHVURJKSA-N 2 2 300.446 3.118 20 10 DGCDLP c1cc2c(cc1C[NH2+]C[C@@H]1CC[N@H+]1C1CCCC1)CCCO2 ZINC001657784749 1196178054 /nfs/dbraw/zinc/17/80/54/1196178054.db2.gz HYAXQCAHMJZJIN-SFHVURJKSA-N 2 2 300.446 3.118 20 10 DGCDLP C[N@@H+](Cc1c(O)ccc(Cl)c1Cl)C[C@@H]1CCC[NH2+]C1 ZINC001235957044 1088490024 /nfs/dbraw/zinc/49/00/24/1088490024.db2.gz KBFKEGORZIWYSJ-SNVBAGLBSA-N 2 2 303.233 3.130 20 10 DGCDLP C[N@H+](Cc1c(O)ccc(Cl)c1Cl)C[C@@H]1CCC[NH2+]C1 ZINC001235957044 1088490033 /nfs/dbraw/zinc/49/00/33/1088490033.db2.gz KBFKEGORZIWYSJ-SNVBAGLBSA-N 2 2 303.233 3.130 20 10 DGCDLP CN1CCCc2cc(C[NH+]3CCC([NH+]4CCCC4)CC3)ccc21 ZINC001138354970 1091150041 /nfs/dbraw/zinc/15/00/41/1091150041.db2.gz XCQKTRBKRBEUDQ-UHFFFAOYSA-N 2 2 313.489 3.129 20 10 DGCDLP CC[NH+](CC)C1CC[NH+](Cc2ccc3c(c2)CCCN3C)CC1 ZINC001138357787 1091152362 /nfs/dbraw/zinc/15/23/62/1091152362.db2.gz KHKIGKVYANOTOF-UHFFFAOYSA-N 2 2 315.505 3.375 20 10 DGCDLP C[C@@H]1[C@@H](C[NH3+])CCC[N@@H+]1Cc1cc(Cl)c(Cl)cc1O ZINC001205912747 1091406950 /nfs/dbraw/zinc/40/69/50/1091406950.db2.gz BYDKIBXPMFETHV-NXEZZACHSA-N 2 2 303.233 3.258 20 10 DGCDLP C[C@@H]1[C@@H](C[NH3+])CCC[N@H+]1Cc1cc(Cl)c(Cl)cc1O ZINC001205912747 1091406953 /nfs/dbraw/zinc/40/69/53/1091406953.db2.gz BYDKIBXPMFETHV-NXEZZACHSA-N 2 2 303.233 3.258 20 10 DGCDLP C[C@@H](C[NH+](C)C)[C@@H]1CCCC[N@@H+]1Cc1cc(F)c(F)cc1O ZINC001206800503 1091745290 /nfs/dbraw/zinc/74/52/90/1091745290.db2.gz KTYMWBSRYNNLJV-LRDDRELGSA-N 2 2 312.404 3.223 20 10 DGCDLP C[C@@H](C[NH+](C)C)[C@@H]1CCCC[N@H+]1Cc1cc(F)c(F)cc1O ZINC001206800503 1091745301 /nfs/dbraw/zinc/74/53/01/1091745301.db2.gz KTYMWBSRYNNLJV-LRDDRELGSA-N 2 2 312.404 3.223 20 10 DGCDLP C[C@H]1CC[C@H](C[NH3+])C[N@@H+]1Cc1cc(Cl)c(Cl)cc1O ZINC001206811505 1091751241 /nfs/dbraw/zinc/75/12/41/1091751241.db2.gz VQZOMMZBCGPADD-VHSXEESVSA-N 2 2 303.233 3.258 20 10 DGCDLP C[C@H]1CC[C@H](C[NH3+])C[N@H+]1Cc1cc(Cl)c(Cl)cc1O ZINC001206811505 1091751247 /nfs/dbraw/zinc/75/12/47/1091751247.db2.gz VQZOMMZBCGPADD-VHSXEESVSA-N 2 2 303.233 3.258 20 10 DGCDLP CC(C)(C)c1cccc(C[NH+]2CCC([NH+]3CCC3)CC2)c1O ZINC001143116626 1092618779 /nfs/dbraw/zinc/61/87/79/1092618779.db2.gz GIEXSZGJGGERJE-UHFFFAOYSA-N 2 2 302.462 3.360 20 10 DGCDLP C[NH+](C)[C@@H]1CC[C@H]2C[N@H+](Cc3cccc(Cl)c3O)C[C@H]2C1 ZINC001336889368 1094775076 /nfs/dbraw/zinc/77/50/76/1094775076.db2.gz SQBDVQVXOBIRCF-NWANDNLSSA-N 2 2 308.853 3.208 20 10 DGCDLP C[NH+](C)[C@@H]1CC[C@H]2C[N@@H+](Cc3cccc(Cl)c3O)C[C@H]2C1 ZINC001336889368 1094775083 /nfs/dbraw/zinc/77/50/83/1094775083.db2.gz SQBDVQVXOBIRCF-NWANDNLSSA-N 2 2 308.853 3.208 20 10 DGCDLP Oc1c(C[N@@H+]2CCC[C@]3(CC[NH2+]3)C2)cccc1-c1ccccc1 ZINC001222287530 1095532351 /nfs/dbraw/zinc/53/23/51/1095532351.db2.gz LOYMAFGELTUPPM-FQEVSTJZSA-N 2 2 308.425 3.387 20 10 DGCDLP Oc1c(C[N@H+]2CCC[C@]3(CC[NH2+]3)C2)cccc1-c1ccccc1 ZINC001222287530 1095532362 /nfs/dbraw/zinc/53/23/62/1095532362.db2.gz LOYMAFGELTUPPM-FQEVSTJZSA-N 2 2 308.425 3.387 20 10 DGCDLP CC(C)(C)c1cccc(C[N@@H+]2CC[C@]3(C2)CCCC[NH2+]3)c1O ZINC001222426320 1095607299 /nfs/dbraw/zinc/60/72/99/1095607299.db2.gz APPFBPDBZVRNCX-IBGZPJMESA-N 2 2 302.462 3.408 20 10 DGCDLP CC(C)(C)c1cccc(C[N@H+]2CC[C@]3(C2)CCCC[NH2+]3)c1O ZINC001222426320 1095607305 /nfs/dbraw/zinc/60/73/05/1095607305.db2.gz APPFBPDBZVRNCX-IBGZPJMESA-N 2 2 302.462 3.408 20 10 DGCDLP Cc1cc(C[N@@H+]2CCC[C@@]23CC[NH2+]C3)c(C)n1-c1ccccc1 ZINC001235110335 1098811174 /nfs/dbraw/zinc/81/11/74/1098811174.db2.gz KQJUQLIVJWGNAV-FQEVSTJZSA-N 2 2 309.457 3.422 20 10 DGCDLP Cc1cc(C[N@H+]2CCC[C@@]23CC[NH2+]C3)c(C)n1-c1ccccc1 ZINC001235110335 1098811187 /nfs/dbraw/zinc/81/11/87/1098811187.db2.gz KQJUQLIVJWGNAV-FQEVSTJZSA-N 2 2 309.457 3.422 20 10 DGCDLP Oc1cc(F)cc(F)c1C[NH+]1CCC([C@@H]2CCCC[NH2+]2)CC1 ZINC001235226758 1098898989 /nfs/dbraw/zinc/89/89/89/1098898989.db2.gz FGRYNABBOBKFCJ-INIZCTEOSA-N 2 2 310.388 3.025 20 10 DGCDLP Oc1c(C[N@@H+]2C[C@H]3CC[C@@H](C2)[NH2+]C3)cccc1-c1ccccc1 ZINC001236061266 1099360690 /nfs/dbraw/zinc/36/06/90/1099360690.db2.gz ZXYWFGMCSSUVSE-YJBOKZPZSA-N 2 2 308.425 3.243 20 10 DGCDLP Oc1c(C[N@H+]2C[C@H]3CC[C@@H](C2)[NH2+]C3)cccc1-c1ccccc1 ZINC001236061266 1099360703 /nfs/dbraw/zinc/36/07/03/1099360703.db2.gz ZXYWFGMCSSUVSE-YJBOKZPZSA-N 2 2 308.425 3.243 20 10 DGCDLP C[N@H+](Cc1cc(Cl)c(Cl)cc1O)[C@H]1CCCC[C@H]1[NH3+] ZINC001236215021 1099472292 /nfs/dbraw/zinc/47/22/92/1099472292.db2.gz GZMPWERFYQSJSR-OLZOCXBDSA-N 2 2 303.233 3.401 20 10 DGCDLP C[N@@H+](Cc1cc(Cl)c(Cl)cc1O)[C@H]1CCCC[C@H]1[NH3+] ZINC001236215021 1099472300 /nfs/dbraw/zinc/47/23/00/1099472300.db2.gz GZMPWERFYQSJSR-OLZOCXBDSA-N 2 2 303.233 3.401 20 10 DGCDLP [NH3+]C[C@H]1CCC[N@@H+]1Cc1cc(-c2ccc(F)cc2)ccc1O ZINC001236252832 1099502417 /nfs/dbraw/zinc/50/24/17/1099502417.db2.gz QNVSWNOBBMXFFE-QGZVFWFLSA-N 2 2 300.377 3.121 20 10 DGCDLP [NH3+]C[C@H]1CCC[N@H+]1Cc1cc(-c2ccc(F)cc2)ccc1O ZINC001236252832 1099502425 /nfs/dbraw/zinc/50/24/25/1099502425.db2.gz QNVSWNOBBMXFFE-QGZVFWFLSA-N 2 2 300.377 3.121 20 10 DGCDLP CC(C)[N@H+](Cc1ccc2c(c1O)C=CC(C)(C)O2)[C@@H]1CC[NH2+]C1 ZINC001236527714 1099661881 /nfs/dbraw/zinc/66/18/81/1099661881.db2.gz AHTUSNDFVFQOJB-OAHLLOKOSA-N 2 2 316.445 3.149 20 10 DGCDLP CC(C)[N@@H+](Cc1ccc2c(c1O)C=CC(C)(C)O2)[C@@H]1CC[NH2+]C1 ZINC001236527714 1099661887 /nfs/dbraw/zinc/66/18/87/1099661887.db2.gz AHTUSNDFVFQOJB-OAHLLOKOSA-N 2 2 316.445 3.149 20 10 DGCDLP CC[C@H]([NH3+])C[N@H+](C)Cc1ccc(OCc2ccccc2)cc1O ZINC001236871001 1099842037 /nfs/dbraw/zinc/84/20/37/1099842037.db2.gz VRGPTYQNHFFLAB-KRWDZBQOSA-N 2 2 314.429 3.140 20 10 DGCDLP CC[C@H]([NH3+])C[N@@H+](C)Cc1ccc(OCc2ccccc2)cc1O ZINC001236871001 1099842050 /nfs/dbraw/zinc/84/20/50/1099842050.db2.gz VRGPTYQNHFFLAB-KRWDZBQOSA-N 2 2 314.429 3.140 20 10 DGCDLP CC(C)[NH2+]c1ccc(Nc2cc[nH+]c(N3CCOCC3)c2)cc1 ZINC001201489504 1102610470 /nfs/dbraw/zinc/61/04/70/1102610470.db2.gz QTDVYYMBCBDCAH-UHFFFAOYSA-N 2 2 312.417 3.482 20 10 DGCDLP C[N@@H+]1CCC[C@]2(CCC[NH+](Cc3c(O)cccc3Cl)C2)C1 ZINC001275217510 1104681085 /nfs/dbraw/zinc/68/10/85/1104681085.db2.gz RKYAVZNOBUILNL-KRWDZBQOSA-N 2 2 308.853 3.353 20 10 DGCDLP C[N@H+]1CCC[C@]2(CCC[NH+](Cc3c(O)cccc3Cl)C2)C1 ZINC001275217510 1104681088 /nfs/dbraw/zinc/68/10/88/1104681088.db2.gz RKYAVZNOBUILNL-KRWDZBQOSA-N 2 2 308.853 3.353 20 10 DGCDLP C[NH+]1CCC[C@]2(CCC[N@H+](Cc3c(O)cccc3Cl)C2)C1 ZINC001275217510 1104681091 /nfs/dbraw/zinc/68/10/91/1104681091.db2.gz RKYAVZNOBUILNL-KRWDZBQOSA-N 2 2 308.853 3.353 20 10 DGCDLP C[NH+]1CCC[C@]2(CCC[N@@H+](Cc3c(O)cccc3Cl)C2)C1 ZINC001275217510 1104681096 /nfs/dbraw/zinc/68/10/96/1104681096.db2.gz RKYAVZNOBUILNL-KRWDZBQOSA-N 2 2 308.853 3.353 20 10 DGCDLP [NH3+][C@H](c1ccccc1O)[C@H]([NH2+]C1CCCC1)c1ccccc1O ZINC001257346225 1106571875 /nfs/dbraw/zinc/57/18/75/1106571875.db2.gz RKUGZDCWVFRBMO-RTBURBONSA-N 2 2 312.413 3.371 20 10 DGCDLP Cc1cccc(NC[C@@H]2CCC[N@@H+]2Cc2cc(F)ccc2O)[nH+]1 ZINC001320161982 1106909962 /nfs/dbraw/zinc/90/99/62/1106909962.db2.gz UVJUBZZVALQOAB-INIZCTEOSA-N 2 2 315.392 3.311 20 10 DGCDLP Cc1cccc(NC[C@@H]2CCC[N@H+]2Cc2cc(F)ccc2O)[nH+]1 ZINC001320161982 1106909969 /nfs/dbraw/zinc/90/99/69/1106909969.db2.gz UVJUBZZVALQOAB-INIZCTEOSA-N 2 2 315.392 3.311 20 10 DGCDLP CCC[N@@H+]1CCC[C@H]1C[NH2+]C/C=C/c1ccc(N(C)C)cc1 ZINC001308399940 1111425039 /nfs/dbraw/zinc/42/50/39/1111425039.db2.gz SGGRQACXFONBSI-XZXOBPBMSA-N 2 2 301.478 3.230 20 10 DGCDLP CCC[N@H+]1CCC[C@H]1C[NH2+]C/C=C/c1ccc(N(C)C)cc1 ZINC001308399940 1111425040 /nfs/dbraw/zinc/42/50/40/1111425040.db2.gz SGGRQACXFONBSI-XZXOBPBMSA-N 2 2 301.478 3.230 20 10 DGCDLP CC[C@H]([NH2+]C[C@@H]1CCc2[nH+]ccn2C1)c1ccc(F)cc1O ZINC000287675888 131294795 /nfs/dbraw/zinc/29/47/95/131294795.db2.gz VZPUOQPYEZOQOV-WFASDCNBSA-N 2 2 303.381 3.031 20 10 DGCDLP CCCOc1ccc(C[N@@H+]2CCC[C@@H](c3[nH]cc[nH+]3)C2)c(O)c1 ZINC000092073229 400153909 /nfs/dbraw/zinc/15/39/09/400153909.db2.gz RTRUQOYYWKWMAO-OAHLLOKOSA-N 2 2 315.417 3.284 20 10 DGCDLP CCCOc1ccc(C[N@H+]2CCC[C@@H](c3[nH]cc[nH+]3)C2)c(O)c1 ZINC000092073229 400153912 /nfs/dbraw/zinc/15/39/12/400153912.db2.gz RTRUQOYYWKWMAO-OAHLLOKOSA-N 2 2 315.417 3.284 20 10 DGCDLP Cn1cc[nH+]c1C[C@H]1CCC[N@H+](Cc2cc(Cl)ccc2O)C1 ZINC000182090181 228366682 /nfs/dbraw/zinc/36/66/82/228366682.db2.gz KRFNRGDKDVQHRG-CYBMUJFWSA-N 2 2 319.836 3.234 20 10 DGCDLP Cn1cc[nH+]c1C[C@H]1CCC[N@@H+](Cc2cc(Cl)ccc2O)C1 ZINC000182090181 228366687 /nfs/dbraw/zinc/36/66/87/228366687.db2.gz KRFNRGDKDVQHRG-CYBMUJFWSA-N 2 2 319.836 3.234 20 10 DGCDLP Oc1c(Cl)cc(Cl)cc1C[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000037649129 431849936 /nfs/dbraw/zinc/84/99/36/431849936.db2.gz CHCWYTLDXHTHGT-JTQLQIEISA-N 2 2 315.244 3.273 20 10 DGCDLP Oc1c(Cl)cc(Cl)cc1C[NH2+]C[C@@H]1CC[N@H+](C2CC2)C1 ZINC000037649129 431849939 /nfs/dbraw/zinc/84/99/39/431849939.db2.gz CHCWYTLDXHTHGT-JTQLQIEISA-N 2 2 315.244 3.273 20 10 DGCDLP C[C@@H]([NH2+]C1CC[NH+](Cc2ccccn2)CC1)c1ccccc1O ZINC000183427887 432293654 /nfs/dbraw/zinc/29/36/54/432293654.db2.gz FGGOPNFHKAEDTG-OAHLLOKOSA-N 2 2 311.429 3.102 20 10 DGCDLP C[C@H]([NH2+]CCc1cn2c([nH+]1)CCCC2)c1ccc(N(C)C)cc1 ZINC000152756633 432352800 /nfs/dbraw/zinc/35/28/00/432352800.db2.gz DIGVFHRHOHOXMK-HNNXBMFYSA-N 2 2 312.461 3.179 20 10 DGCDLP CC(=O)c1cc(Cl)cc(C[N@H+]2CCC[C@@H]([NH+](C)C)CC2)c1O ZINC000277315842 432837544 /nfs/dbraw/zinc/83/75/44/432837544.db2.gz UWOHZAQQGNGKRN-OAHLLOKOSA-N 2 2 324.852 3.164 20 10 DGCDLP CC(=O)c1cc(Cl)cc(C[N@@H+]2CCC[C@@H]([NH+](C)C)CC2)c1O ZINC000277315842 432837547 /nfs/dbraw/zinc/83/75/47/432837547.db2.gz UWOHZAQQGNGKRN-OAHLLOKOSA-N 2 2 324.852 3.164 20 10 DGCDLP CCCN(c1ccc(C[NH3+])cc1)C1CCN(c2cccc[nH+]2)CC1 ZINC000278130949 432886331 /nfs/dbraw/zinc/88/63/31/432886331.db2.gz CCRCSYUATDSIIV-UHFFFAOYSA-N 2 2 324.472 3.426 20 10 DGCDLP Oc1cc(F)c(Cl)cc1C[N@@H+]1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000295374508 434333714 /nfs/dbraw/zinc/33/37/14/434333714.db2.gz OPOCFXSGHRVVQA-JTQLQIEISA-N 2 2 309.772 3.287 20 10 DGCDLP Oc1cc(F)c(Cl)cc1C[N@H+]1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000295374508 434333719 /nfs/dbraw/zinc/33/37/19/434333719.db2.gz OPOCFXSGHRVVQA-JTQLQIEISA-N 2 2 309.772 3.287 20 10 DGCDLP Oc1cccc2c1[C@H]([NH2+]Cc1ccccc1Cn1cc[nH+]c1)CC2 ZINC000296138202 434521146 /nfs/dbraw/zinc/52/11/46/434521146.db2.gz WBJDCJHPYUPIAV-GOSISDBHSA-N 2 2 319.408 3.414 20 10 DGCDLP C[C@H]([NH2+]CCc1cn2ccccc2[nH+]1)c1ccc(N(C)C)cc1 ZINC000130585055 525372806 /nfs/dbraw/zinc/37/28/06/525372806.db2.gz IFHHUCQXOUAPJL-HNNXBMFYSA-N 2 2 308.429 3.294 20 10 DGCDLP C[C@H]([NH2+][C@@H]1C[NH2+]CC[C@@H]1c1ccccc1)c1cc(F)ccc1O ZINC000854221899 620785052 /nfs/dbraw/zinc/78/50/52/620785052.db2.gz BPUNCWHWGXFHRG-FDQGKXFDSA-N 2 2 314.404 3.328 20 10 DGCDLP C[C@@H]([NH2+][C@@H]1C[NH2+]CC[C@@H]1c1ccccc1)c1cc(F)ccc1O ZINC000854221901 620785158 /nfs/dbraw/zinc/78/51/58/620785158.db2.gz BPUNCWHWGXFHRG-MZMPZRCHSA-N 2 2 314.404 3.328 20 10 DGCDLP Cc1ccc(O)c([C@H](C)[NH2+][C@@H]2C[NH2+]CC[C@@H]2c2ccccc2)c1 ZINC000854223751 620785705 /nfs/dbraw/zinc/78/57/05/620785705.db2.gz VMWWGEYSUCXEEK-KVSKMBFKSA-N 2 2 310.441 3.497 20 10 DGCDLP C[C@H]1C[C@H]([NH2+][C@@H]2Cc3ccccc3[C@H]2[NH3+])c2c1c(F)ccc2O ZINC000902437014 619635662 /nfs/dbraw/zinc/63/56/62/619635662.db2.gz GHLKTPQPWANSFV-VGQSVSGKSA-N 2 2 312.388 3.294 20 10 DGCDLP Cc1ccc(O)c([C@@H](C)[NH2+][C@H](CC[NH+](C)C)c2cccnc2)c1 ZINC000903378467 619768417 /nfs/dbraw/zinc/76/84/17/619768417.db2.gz CJPAQOLGAMFNJI-CRAIPNDOSA-N 2 2 313.445 3.439 20 10 DGCDLP CCCN(CCC)c1ccc(C[NH2+]CC[NH+]2CCCC2)cc1 ZINC000920957147 620829367 /nfs/dbraw/zinc/82/93/67/620829367.db2.gz KTQBKXPRHIOVOJ-UHFFFAOYSA-N 2 2 303.494 3.498 20 10 DGCDLP C[C@H]([NH2+]C[C@H]1CC[N@@H+]1C1CCCC1)c1ccc(N(C)C)cc1 ZINC000858532283 621202457 /nfs/dbraw/zinc/20/24/57/621202457.db2.gz IMPHVWVDEOOLFM-HNAYVOBHSA-N 2 2 301.478 3.420 20 10 DGCDLP C[C@H]([NH2+]C[C@H]1CC[N@H+]1C1CCCC1)c1ccc(N(C)C)cc1 ZINC000858532283 621202458 /nfs/dbraw/zinc/20/24/58/621202458.db2.gz IMPHVWVDEOOLFM-HNAYVOBHSA-N 2 2 301.478 3.420 20 10 DGCDLP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[N@@H+]3CCCC[C@@H]23)c2c1c(F)ccc2O ZINC000756431624 621638099 /nfs/dbraw/zinc/63/80/99/621638099.db2.gz OHSBVKYHPKXZSW-RZFFKMDDSA-N 2 2 304.409 3.296 20 10 DGCDLP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[N@H+]3CCCC[C@@H]23)c2c1c(F)ccc2O ZINC000756431624 621638101 /nfs/dbraw/zinc/63/81/01/621638101.db2.gz OHSBVKYHPKXZSW-RZFFKMDDSA-N 2 2 304.409 3.296 20 10 DGCDLP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[N@@H+]3CCCC[C@H]23)c2c1c(F)ccc2O ZINC000756431620 621638308 /nfs/dbraw/zinc/63/83/08/621638308.db2.gz OHSBVKYHPKXZSW-REBRKWNGSA-N 2 2 304.409 3.296 20 10 DGCDLP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[N@H+]3CCCC[C@H]23)c2c1c(F)ccc2O ZINC000756431620 621638309 /nfs/dbraw/zinc/63/83/09/621638309.db2.gz OHSBVKYHPKXZSW-REBRKWNGSA-N 2 2 304.409 3.296 20 10 DGCDLP CC(C)(C[NH2+]Cc1cc(Cl)c(F)cc1O)C[NH+]1CCCC1 ZINC000816591605 627812409 /nfs/dbraw/zinc/81/24/09/627812409.db2.gz IZBRDCWSFUNPAK-UHFFFAOYSA-N 2 2 314.832 3.396 20 10 DGCDLP CC(=O)c1cc(Cl)cc(C[N@@H+]2C[C@H](C[NH3+])[C@H](C)C[C@@H]2C)c1O ZINC000817880393 627952434 /nfs/dbraw/zinc/95/24/34/627952434.db2.gz RNAHNRIXWXZKJN-SUNKGSAMSA-N 2 2 324.852 3.053 20 10 DGCDLP CC(=O)c1cc(Cl)cc(C[N@H+]2C[C@H](C[NH3+])[C@H](C)C[C@@H]2C)c1O ZINC000817880393 627952436 /nfs/dbraw/zinc/95/24/36/627952436.db2.gz RNAHNRIXWXZKJN-SUNKGSAMSA-N 2 2 324.852 3.053 20 10 DGCDLP Cc1ccsc1[C@H](C)[NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000817938955 627967364 /nfs/dbraw/zinc/96/73/64/627967364.db2.gz WFFPNQSMCIZVLV-XJKSGUPXSA-N 2 2 303.475 3.473 20 10 DGCDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+][C@@H]2CCc3ccc(F)cc32)cc1 ZINC000817938855 627967879 /nfs/dbraw/zinc/96/78/79/627967879.db2.gz UOKSLRNVTCGJMM-RBUKOAKNSA-N 2 2 313.420 3.169 20 10 DGCDLP Oc1ccccc1[C@@H](CCc1ccccc1)[NH2+][C@H]1CCC[NH2+]C1 ZINC000817942111 627968604 /nfs/dbraw/zinc/96/86/04/627968604.db2.gz WTVRFSKNTMIUPH-PKOBYXMFSA-N 2 2 310.441 3.408 20 10 DGCDLP CSCC1CCC([NH2+]C[C@@H]([NH3+])c2ccc(N(C)C)cc2)CC1 ZINC000817942345 627969688 /nfs/dbraw/zinc/96/96/88/627969688.db2.gz OISOFGHHVJPDFM-JFUPDXTOSA-N 2 2 321.534 3.264 20 10 DGCDLP CC(C)[C@H]([NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1)c1cccnc1 ZINC000817944141 627969838 /nfs/dbraw/zinc/96/98/38/627969838.db2.gz XOZWQGRAHZERDQ-MOPGFXCFSA-N 2 2 312.461 3.134 20 10 DGCDLP C[C@@H]([NH2+]CC[NH2+]C1CC1)c1ccc(N2CCCCCC2)cc1 ZINC000817953583 627973672 /nfs/dbraw/zinc/97/36/72/627973672.db2.gz OPTZAKZKTDMQBR-MRXNPFEDSA-N 2 2 301.478 3.470 20 10 DGCDLP C[C@H]([NH2+][C@@H]1C[NH2+]CC[C@@H]1C)c1ccc(N2CCCCC2)cc1 ZINC000817968063 627978805 /nfs/dbraw/zinc/97/88/05/627978805.db2.gz NXOALRWHXLIBRV-TXPKVOOTSA-N 2 2 301.478 3.326 20 10 DGCDLP CC[NH2+][C@H](C)C[NH2+][C@@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000817972071 627980125 /nfs/dbraw/zinc/98/01/25/627980125.db2.gz JOAFMCDLEPTMFD-CABCVRRESA-N 2 2 307.457 3.465 20 10 DGCDLP COc1cc(C[NH+]2CCC([NH+](C)C)CC2)c(O)c(C(C)(C)C)c1 ZINC000824575424 628672609 /nfs/dbraw/zinc/67/26/09/628672609.db2.gz DWTTVKOLUYYZQN-UHFFFAOYSA-N 2 2 320.477 3.224 20 10 DGCDLP Cc1cc(O)c(C[N@@H+]2CCC[C@H](c3[nH]cc[nH+]3)C2)cc1Cl ZINC000824596179 628675067 /nfs/dbraw/zinc/67/50/67/628675067.db2.gz CDOPXJUNSOYEHH-LBPRGKRZSA-N 2 2 305.809 3.457 20 10 DGCDLP Cc1cc(O)c(C[N@H+]2CCC[C@H](c3[nH]cc[nH+]3)C2)cc1Cl ZINC000824596179 628675070 /nfs/dbraw/zinc/67/50/70/628675070.db2.gz CDOPXJUNSOYEHH-LBPRGKRZSA-N 2 2 305.809 3.457 20 10 DGCDLP Cc1cc(O)c(C[NH2+]C2CC[NH+](C3CCC3)CC2)cc1Cl ZINC000825143201 628731635 /nfs/dbraw/zinc/73/16/35/628731635.db2.gz FIECIXOYNHEVFJ-UHFFFAOYSA-N 2 2 308.853 3.461 20 10 DGCDLP CN(C)c1ccc(/C=C\C[N@@H+]2CCC[C@H](c3[nH]cc[nH+]3)C2)cc1 ZINC000835025803 629827536 /nfs/dbraw/zinc/82/75/36/629827536.db2.gz NPLVQYMPIUPLEF-IVZVJUQRSA-N 2 2 310.445 3.369 20 10 DGCDLP CN(C)c1ccc(/C=C\C[N@H+]2CCC[C@H](c3[nH]cc[nH+]3)C2)cc1 ZINC000835025803 629827542 /nfs/dbraw/zinc/82/75/42/629827542.db2.gz NPLVQYMPIUPLEF-IVZVJUQRSA-N 2 2 310.445 3.369 20 10 DGCDLP Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@H]1C[C@H](C)[N@@H+](C2CC2)C1 ZINC000840893388 630373978 /nfs/dbraw/zinc/37/39/78/630373978.db2.gz IYDKLYWBNNTDJG-BQFCYCMXSA-N 2 2 315.505 3.207 20 10 DGCDLP Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@H]1C[C@H](C)[N@H+](C2CC2)C1 ZINC000840893388 630373980 /nfs/dbraw/zinc/37/39/80/630373980.db2.gz IYDKLYWBNNTDJG-BQFCYCMXSA-N 2 2 315.505 3.207 20 10 DGCDLP Cc1cc(O)c(C[N@@H+]2CCC[C@@H](c3[nH]cc[nH+]3)C2)c(Cl)c1 ZINC000840911136 630376326 /nfs/dbraw/zinc/37/63/26/630376326.db2.gz QQTLBSURCCPKNF-GFCCVEGCSA-N 2 2 305.809 3.457 20 10 DGCDLP Cc1cc(O)c(C[N@H+]2CCC[C@@H](c3[nH]cc[nH+]3)C2)c(Cl)c1 ZINC000840911136 630376329 /nfs/dbraw/zinc/37/63/29/630376329.db2.gz QQTLBSURCCPKNF-GFCCVEGCSA-N 2 2 305.809 3.457 20 10 DGCDLP CC[N@@H+]1CC[C@H]2CC[C@@H](C1)[NH+]2Cc1ccc(N(C)C)cc1C ZINC000840920133 630378735 /nfs/dbraw/zinc/37/87/35/630378735.db2.gz CHNIYGSNYQGMDN-MJGOQNOKSA-N 2 2 301.478 3.120 20 10 DGCDLP CC[N@H+]1CC[C@H]2CC[C@@H](C1)[NH+]2Cc1ccc(N(C)C)cc1C ZINC000840920133 630378740 /nfs/dbraw/zinc/37/87/40/630378740.db2.gz CHNIYGSNYQGMDN-MJGOQNOKSA-N 2 2 301.478 3.120 20 10 DGCDLP CC[NH+]1CC[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccc(N(C)C)cc1C ZINC000840920133 630378741 /nfs/dbraw/zinc/37/87/41/630378741.db2.gz CHNIYGSNYQGMDN-MJGOQNOKSA-N 2 2 301.478 3.120 20 10 DGCDLP CC[NH+]1CC[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccc(N(C)C)cc1C ZINC000840920133 630378745 /nfs/dbraw/zinc/37/87/45/630378745.db2.gz CHNIYGSNYQGMDN-MJGOQNOKSA-N 2 2 301.478 3.120 20 10 DGCDLP CCc1ccc(C[NH2+]C[C@@H]([NH3+])c2ccc(N(C)C)cc2)s1 ZINC000841042384 630401331 /nfs/dbraw/zinc/40/13/31/630401331.db2.gz JBCHRBZQMKLENE-QGZVFWFLSA-N 2 2 303.475 3.166 20 10 DGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+][C@H]2CCC[C@H](C3CC3)C2)cc1 ZINC000841045807 630402059 /nfs/dbraw/zinc/40/20/59/630402059.db2.gz QOHAQUJQWVHQDV-JENIJYKNSA-N 2 2 301.478 3.311 20 10 DGCDLP CN(C)c1ccc(C[NH2+][C@H]2CC[NH2+]C2(C)C)c(C(F)(F)F)c1 ZINC000841085423 630406226 /nfs/dbraw/zinc/40/62/26/630406226.db2.gz BXKDKZNWXLVABX-AWEZNQCLSA-N 2 2 315.383 3.002 20 10 DGCDLP CCc1ccccc1[C@@H]([NH3+])C[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC000841086841 630406250 /nfs/dbraw/zinc/40/62/50/630406250.db2.gz NGLZAARRNNBYHI-SFHVURJKSA-N 2 2 315.436 3.244 20 10 DGCDLP Oc1c(F)cc(Cl)cc1C[NH+]1CCC([C@H]2CC[NH2+]C2)CC1 ZINC000843125881 630616644 /nfs/dbraw/zinc/61/66/44/630616644.db2.gz BLHOIQUPNAPKOO-LBPRGKRZSA-N 2 2 312.816 3.006 20 10 DGCDLP CC(=O)c1cc(Cl)cc(C[N@H+]2CCC[C@H](C)[C@@H]2CC[NH3+])c1O ZINC000846226379 631215810 /nfs/dbraw/zinc/21/58/10/631215810.db2.gz LSUNYZQWXQGEQJ-ZBEGNZNMSA-N 2 2 324.852 3.198 20 10 DGCDLP CC(=O)c1cc(Cl)cc(C[N@@H+]2CCC[C@H](C)[C@@H]2CC[NH3+])c1O ZINC000846226379 631215811 /nfs/dbraw/zinc/21/58/11/631215811.db2.gz LSUNYZQWXQGEQJ-ZBEGNZNMSA-N 2 2 324.852 3.198 20 10 DGCDLP CC(=O)c1cc(Cl)cc(C[N@H+]2CCC[C@H](C)[C@H]2CC[NH3+])c1O ZINC000846226378 631215880 /nfs/dbraw/zinc/21/58/80/631215880.db2.gz LSUNYZQWXQGEQJ-MEDUHNTESA-N 2 2 324.852 3.198 20 10 DGCDLP CC(=O)c1cc(Cl)cc(C[N@@H+]2CCC[C@H](C)[C@H]2CC[NH3+])c1O ZINC000846226378 631215882 /nfs/dbraw/zinc/21/58/82/631215882.db2.gz LSUNYZQWXQGEQJ-MEDUHNTESA-N 2 2 324.852 3.198 20 10 DGCDLP COc1ccc(O)c([C@H](C)[NH2+][C@H]2CCC[N@@H+]3CCCC[C@@H]23)c1 ZINC000848568356 631696410 /nfs/dbraw/zinc/69/64/10/631696410.db2.gz GORKFSLGNMHBTB-JQFCIGGWSA-N 2 2 304.434 3.068 20 10 DGCDLP COc1ccc(O)c([C@H](C)[NH2+][C@H]2CCC[N@H+]3CCCC[C@@H]23)c1 ZINC000848568356 631696414 /nfs/dbraw/zinc/69/64/14/631696414.db2.gz GORKFSLGNMHBTB-JQFCIGGWSA-N 2 2 304.434 3.068 20 10 DGCDLP COc1cccc([C@H](C)[NH2+][C@H]2CCC[N@@H+]3CCCC[C@H]23)c1O ZINC000848568259 631697225 /nfs/dbraw/zinc/69/72/25/631697225.db2.gz CFTVSVIUGPYGNU-CWRNSKLLSA-N 2 2 304.434 3.068 20 10 DGCDLP COc1cccc([C@H](C)[NH2+][C@H]2CCC[N@H+]3CCCC[C@H]23)c1O ZINC000848568259 631697228 /nfs/dbraw/zinc/69/72/28/631697228.db2.gz CFTVSVIUGPYGNU-CWRNSKLLSA-N 2 2 304.434 3.068 20 10 DGCDLP CC(C)(C)[C@H](Cn1cc[nH+]c1)[NH2+]Cc1cc(Cl)ccc1O ZINC000037156668 661217056 /nfs/dbraw/zinc/21/70/56/661217056.db2.gz GSRWROZQRDOIEC-HNNXBMFYSA-N 2 2 307.825 3.447 20 10 DGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+]Cc2ccc3[nH]ccc3c2)cc1 ZINC001578424775 1191942835 /nfs/dbraw/zinc/94/28/35/1191942835.db2.gz VGNTZLWHAZDCJK-GOSISDBHSA-N 2 2 308.429 3.024 20 10 DGCDLP Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+][C@@H]1Cc2ccccc2[C@H]1[NH3+] ZINC001336077232 1178990147 /nfs/dbraw/zinc/99/01/47/1178990147.db2.gz HZMQZVOXDMFSHC-VXHCAWKWSA-N 2 2 308.425 3.463 20 10 DGCDLP C[C@H](C[NH+](C)C)[C@H]1CCCC[N@@H+]1Cc1cc(F)cc(F)c1O ZINC001462463395 1182956891 /nfs/dbraw/zinc/95/68/91/1182956891.db2.gz VBQKJLZCGOHQJM-MLGOLLRUSA-N 2 2 312.404 3.223 20 10 DGCDLP C[C@H](C[NH+](C)C)[C@H]1CCCC[N@H+]1Cc1cc(F)cc(F)c1O ZINC001462463395 1182956892 /nfs/dbraw/zinc/95/68/92/1182956892.db2.gz VBQKJLZCGOHQJM-MLGOLLRUSA-N 2 2 312.404 3.223 20 10 DGCDLP Oc1c(F)cc(Cl)cc1C[NH2+]CCC[NH+]1CCCCC1 ZINC001560251894 1189298913 /nfs/dbraw/zinc/29/89/13/1189298913.db2.gz FWEQUEDCLRFOIO-UHFFFAOYSA-N 2 2 300.805 3.150 20 10 DGCDLP Oc1ccccc1C[NH+]1CCC([N@@H+]2CCc3ccccc3C2)CC1 ZINC001203558677 1090616613 /nfs/dbraw/zinc/61/66/13/1090616613.db2.gz UTUGMNIVXKOCCC-UHFFFAOYSA-N 2 2 322.452 3.415 20 10 DGCDLP Oc1ccccc1C[NH+]1CCC([N@H+]2CCc3ccccc3C2)CC1 ZINC001203558677 1090616614 /nfs/dbraw/zinc/61/66/14/1090616614.db2.gz UTUGMNIVXKOCCC-UHFFFAOYSA-N 2 2 322.452 3.415 20 10 DGCDLP CC[N@H+](Cc1ccc(N2CCCC2)cc1)C1CC[NH+](C)CC1 ZINC001204327518 1090950854 /nfs/dbraw/zinc/95/08/54/1090950854.db2.gz WWBNGEOMHHRPGA-UHFFFAOYSA-N 2 2 301.478 3.203 20 10 DGCDLP CC[N@@H+](Cc1ccc(N2CCCC2)cc1)C1CC[NH+](C)CC1 ZINC001204327518 1090950857 /nfs/dbraw/zinc/95/08/57/1090950857.db2.gz WWBNGEOMHHRPGA-UHFFFAOYSA-N 2 2 301.478 3.203 20 10 DGCDLP Cc1cc(O)c(C[N@@H+]2CCCC[C@](F)(C[NH3+])C2)cc1Cl ZINC001206363660 1091599834 /nfs/dbraw/zinc/59/98/34/1091599834.db2.gz ZLEKFTLPFUAQSV-HNNXBMFYSA-N 2 2 300.805 3.007 20 10 DGCDLP Cc1cc(O)c(C[N@H+]2CCCC[C@](F)(C[NH3+])C2)cc1Cl ZINC001206363660 1091599841 /nfs/dbraw/zinc/59/98/41/1091599841.db2.gz ZLEKFTLPFUAQSV-HNNXBMFYSA-N 2 2 300.805 3.007 20 10 DGCDLP Cc1[nH+]ccn1-c1ccccc1C[N@H+]1CCc2cccc(O)c2C1 ZINC001140027100 1091743351 /nfs/dbraw/zinc/74/33/51/1091743351.db2.gz YIHKMFSBWZNDTC-UHFFFAOYSA-N 2 2 319.408 3.445 20 10 DGCDLP CN(C)c1ccc(C[N@@H+]2CCC[C@@]3(CC[NH2+]3)C2)c2ccccc21 ZINC001222282921 1095529649 /nfs/dbraw/zinc/52/96/49/1095529649.db2.gz QVBBWLVPBGCDKV-HXUWFJFHSA-N 2 2 309.457 3.234 20 10 DGCDLP CN(C)c1ccc(C[N@H+]2CCC[C@@]3(CC[NH2+]3)C2)c2ccccc21 ZINC001222282921 1095529662 /nfs/dbraw/zinc/52/96/62/1095529662.db2.gz QVBBWLVPBGCDKV-HXUWFJFHSA-N 2 2 309.457 3.234 20 10 DGCDLP CCN(CC)c1ccc(C[N@@H+]2CCC[C@]3(CCC[NH2+]3)C2)cc1 ZINC001222345067 1095564932 /nfs/dbraw/zinc/56/49/32/1095564932.db2.gz HUSHRUXGBJLJNK-LJQANCHMSA-N 2 2 301.478 3.251 20 10 DGCDLP CCN(CC)c1ccc(C[N@H+]2CCC[C@]3(CCC[NH2+]3)C2)cc1 ZINC001222345067 1095564946 /nfs/dbraw/zinc/56/49/46/1095564946.db2.gz HUSHRUXGBJLJNK-LJQANCHMSA-N 2 2 301.478 3.251 20 10 DGCDLP c1cc(N2CCCC2)ccc1C[N@@H+]1CCC[C@]2(CCCC[NH2+]2)C1 ZINC001222385874 1095584564 /nfs/dbraw/zinc/58/45/64/1095584564.db2.gz YWSCJUQXVNWIQV-HXUWFJFHSA-N 2 2 313.489 3.395 20 10 DGCDLP c1cc(N2CCCC2)ccc1C[N@H+]1CCC[C@]2(CCCC[NH2+]2)C1 ZINC001222385874 1095584574 /nfs/dbraw/zinc/58/45/74/1095584574.db2.gz YWSCJUQXVNWIQV-HXUWFJFHSA-N 2 2 313.489 3.395 20 10 DGCDLP CCN(CC)c1ccc(C[N@@H+]2CC[C@]3(C2)CCCC[NH2+]3)cc1 ZINC001222420524 1095605660 /nfs/dbraw/zinc/60/56/60/1095605660.db2.gz DRGBIZKKKRZSNJ-IBGZPJMESA-N 2 2 301.478 3.251 20 10 DGCDLP CCN(CC)c1ccc(C[N@H+]2CC[C@]3(C2)CCCC[NH2+]3)cc1 ZINC001222420524 1095605668 /nfs/dbraw/zinc/60/56/68/1095605668.db2.gz DRGBIZKKKRZSNJ-IBGZPJMESA-N 2 2 301.478 3.251 20 10 DGCDLP Oc1c(C[NH+]2CC3(C2)CC[N@H+](CC2CC2)C3)ccc2ccccc21 ZINC001231879045 1097876966 /nfs/dbraw/zinc/87/69/66/1097876966.db2.gz TWODSFSJPODUMC-UHFFFAOYSA-N 2 2 322.452 3.463 20 10 DGCDLP Oc1c(C[NH+]2CC3(C2)CC[N@@H+](CC2CC2)C3)ccc2ccccc21 ZINC001231879045 1097876971 /nfs/dbraw/zinc/87/69/71/1097876971.db2.gz TWODSFSJPODUMC-UHFFFAOYSA-N 2 2 322.452 3.463 20 10 DGCDLP C[N@H+](Cc1cc(-c2ccc(F)cc2)ccc1O)[C@@H]1CCC[NH2+]C1 ZINC001235347168 1098971226 /nfs/dbraw/zinc/97/12/26/1098971226.db2.gz NICRMKKZCOWSPK-GOSISDBHSA-N 2 2 314.404 3.382 20 10 DGCDLP C[N@@H+](Cc1cc(-c2ccc(F)cc2)ccc1O)[C@@H]1CCC[NH2+]C1 ZINC001235347168 1098971236 /nfs/dbraw/zinc/97/12/36/1098971236.db2.gz NICRMKKZCOWSPK-GOSISDBHSA-N 2 2 314.404 3.382 20 10 DGCDLP C[N@H+](CCC1CC[NH2+]CC1)Cc1cccc(C(F)(F)F)c1O ZINC001235717070 1099144526 /nfs/dbraw/zinc/14/45/26/1099144526.db2.gz CIHPIWBUVWIZOV-UHFFFAOYSA-N 2 2 316.367 3.233 20 10 DGCDLP C[N@@H+](CCC1CC[NH2+]CC1)Cc1cccc(C(F)(F)F)c1O ZINC001235717070 1099144533 /nfs/dbraw/zinc/14/45/33/1099144533.db2.gz CIHPIWBUVWIZOV-UHFFFAOYSA-N 2 2 316.367 3.233 20 10 DGCDLP CC[N@H+](Cc1ccc2c(c1O)C=CC(C)(C)O2)[C@H]1CCC[NH2+]C1 ZINC001236007434 1099328391 /nfs/dbraw/zinc/32/83/91/1099328391.db2.gz BWYDUPCIWDHSIS-HNNXBMFYSA-N 2 2 316.445 3.150 20 10 DGCDLP CC[N@@H+](Cc1ccc2c(c1O)C=CC(C)(C)O2)[C@H]1CCC[NH2+]C1 ZINC001236007434 1099328400 /nfs/dbraw/zinc/32/84/00/1099328400.db2.gz BWYDUPCIWDHSIS-HNNXBMFYSA-N 2 2 316.445 3.150 20 10 DGCDLP C[N@H+](Cc1cccc(C(F)(F)F)c1O)[C@@H]1CCCC[C@@H]1[NH3+] ZINC001236214082 1099470273 /nfs/dbraw/zinc/47/02/73/1099470273.db2.gz DXIFZAYVWGMKOW-QWHCGFSZSA-N 2 2 302.340 3.113 20 10 DGCDLP C[N@@H+](Cc1cccc(C(F)(F)F)c1O)[C@@H]1CCCC[C@@H]1[NH3+] ZINC001236214082 1099470278 /nfs/dbraw/zinc/47/02/78/1099470278.db2.gz DXIFZAYVWGMKOW-QWHCGFSZSA-N 2 2 302.340 3.113 20 10 DGCDLP Oc1cc(C(F)(F)F)ccc1C[N@H+](C1CC1)[C@H]1CCC[NH2+]C1 ZINC001236238948 1099491791 /nfs/dbraw/zinc/49/17/91/1099491791.db2.gz FLFKSCWSLCJZCN-AWEZNQCLSA-N 2 2 314.351 3.127 20 10 DGCDLP Oc1cc(C(F)(F)F)ccc1C[N@@H+](C1CC1)[C@H]1CCC[NH2+]C1 ZINC001236238948 1099491793 /nfs/dbraw/zinc/49/17/93/1099491793.db2.gz FLFKSCWSLCJZCN-AWEZNQCLSA-N 2 2 314.351 3.127 20 10 DGCDLP Oc1c(F)cccc1C[N@H+](C[C@H]1CCC[NH2+]C1)C1CCCC1 ZINC001236372735 1099557523 /nfs/dbraw/zinc/55/75/23/1099557523.db2.gz DGOLJMRYLVFNHN-AWEZNQCLSA-N 2 2 306.425 3.276 20 10 DGCDLP Oc1c(F)cccc1C[N@@H+](C[C@H]1CCC[NH2+]C1)C1CCCC1 ZINC001236372735 1099557533 /nfs/dbraw/zinc/55/75/33/1099557533.db2.gz DGOLJMRYLVFNHN-AWEZNQCLSA-N 2 2 306.425 3.276 20 10 DGCDLP CC(C)C[N@H+](Cc1cc(F)c(Cl)cc1O)[C@@H]1CCC[NH2+]C1 ZINC001236478406 1099636638 /nfs/dbraw/zinc/63/66/38/1099636638.db2.gz HOFHZGQQRRDWER-CYBMUJFWSA-N 2 2 314.832 3.395 20 10 DGCDLP CC(C)C[N@@H+](Cc1cc(F)c(Cl)cc1O)[C@@H]1CCC[NH2+]C1 ZINC001236478406 1099636643 /nfs/dbraw/zinc/63/66/43/1099636643.db2.gz HOFHZGQQRRDWER-CYBMUJFWSA-N 2 2 314.832 3.395 20 10 DGCDLP COc1cc(O)c(C[N@H+](C[C@H]2CCC[NH2+]C2)C2CC2)c(Cl)c1 ZINC001236602691 1099696860 /nfs/dbraw/zinc/69/68/60/1099696860.db2.gz ZWIYZLFNXAAZMO-LBPRGKRZSA-N 2 2 324.852 3.018 20 10 DGCDLP COc1cc(O)c(C[N@@H+](C[C@H]2CCC[NH2+]C2)C2CC2)c(Cl)c1 ZINC001236602691 1099696870 /nfs/dbraw/zinc/69/68/70/1099696870.db2.gz ZWIYZLFNXAAZMO-LBPRGKRZSA-N 2 2 324.852 3.018 20 10 DGCDLP [NH3+]C[C@@H]1Cc2ccccc2C[N@@H+]1Cc1cc2ccccc2cc1O ZINC001237028716 1099933697 /nfs/dbraw/zinc/93/36/97/1099933697.db2.gz SPQSFWDIHATXOZ-FQEVSTJZSA-N 2 2 318.420 3.431 20 10 DGCDLP [NH3+]C[C@@H]1Cc2ccccc2C[N@H+]1Cc1cc2ccccc2cc1O ZINC001237028716 1099933704 /nfs/dbraw/zinc/93/37/04/1099933704.db2.gz SPQSFWDIHATXOZ-FQEVSTJZSA-N 2 2 318.420 3.431 20 10 DGCDLP C[C@]1(C[NH3+])CCC[N@H+](Cc2c(O)ccc(Cl)c2Cl)C1 ZINC001237082553 1099961731 /nfs/dbraw/zinc/96/17/31/1099961731.db2.gz RDXPPARZVWTLCU-CQSZACIVSA-N 2 2 303.233 3.260 20 10 DGCDLP C[C@]1(C[NH3+])CCC[N@@H+](Cc2c(O)ccc(Cl)c2Cl)C1 ZINC001237082553 1099961740 /nfs/dbraw/zinc/96/17/40/1099961740.db2.gz RDXPPARZVWTLCU-CQSZACIVSA-N 2 2 303.233 3.260 20 10 DGCDLP COc1cc(O)c(C[N@H+](C2CCC2)[C@H]2CCC[NH2+]C2)cc1Cl ZINC001237155678 1100005383 /nfs/dbraw/zinc/00/53/83/1100005383.db2.gz KIYMXHCOUZTZMX-AWEZNQCLSA-N 2 2 324.852 3.161 20 10 DGCDLP COc1cc(O)c(C[N@@H+](C2CCC2)[C@H]2CCC[NH2+]C2)cc1Cl ZINC001237155678 1100005391 /nfs/dbraw/zinc/00/53/91/1100005391.db2.gz KIYMXHCOUZTZMX-AWEZNQCLSA-N 2 2 324.852 3.161 20 10 DGCDLP C[N@@H+]1CCC[C@@]2(CCC[NH+](Cc3c(O)cccc3Cl)C2)C1 ZINC001275217511 1104680846 /nfs/dbraw/zinc/68/08/46/1104680846.db2.gz RKYAVZNOBUILNL-QGZVFWFLSA-N 2 2 308.853 3.353 20 10 DGCDLP C[N@H+]1CCC[C@@]2(CCC[NH+](Cc3c(O)cccc3Cl)C2)C1 ZINC001275217511 1104680850 /nfs/dbraw/zinc/68/08/50/1104680850.db2.gz RKYAVZNOBUILNL-QGZVFWFLSA-N 2 2 308.853 3.353 20 10 DGCDLP C[NH+]1CCC[C@@]2(CCC[N@H+](Cc3c(O)cccc3Cl)C2)C1 ZINC001275217511 1104680852 /nfs/dbraw/zinc/68/08/52/1104680852.db2.gz RKYAVZNOBUILNL-QGZVFWFLSA-N 2 2 308.853 3.353 20 10 DGCDLP C[NH+]1CCC[C@@]2(CCC[N@@H+](Cc3c(O)cccc3Cl)C2)C1 ZINC001275217511 1104680856 /nfs/dbraw/zinc/68/08/56/1104680856.db2.gz RKYAVZNOBUILNL-QGZVFWFLSA-N 2 2 308.853 3.353 20 10 DGCDLP C[N@@H+]1CCC[C@]2(CCC[NH+](Cc3ccc(Cl)cc3O)C2)C1 ZINC001275267827 1104698579 /nfs/dbraw/zinc/69/85/79/1104698579.db2.gz YFLJOHPIRDTVLY-KRWDZBQOSA-N 2 2 308.853 3.353 20 10 DGCDLP C[N@H+]1CCC[C@]2(CCC[NH+](Cc3ccc(Cl)cc3O)C2)C1 ZINC001275267827 1104698582 /nfs/dbraw/zinc/69/85/82/1104698582.db2.gz YFLJOHPIRDTVLY-KRWDZBQOSA-N 2 2 308.853 3.353 20 10 DGCDLP C[NH+]1CCC[C@]2(CCC[N@H+](Cc3ccc(Cl)cc3O)C2)C1 ZINC001275267827 1104698585 /nfs/dbraw/zinc/69/85/85/1104698585.db2.gz YFLJOHPIRDTVLY-KRWDZBQOSA-N 2 2 308.853 3.353 20 10 DGCDLP C[NH+]1CCC[C@]2(CCC[N@@H+](Cc3ccc(Cl)cc3O)C2)C1 ZINC001275267827 1104698587 /nfs/dbraw/zinc/69/85/87/1104698587.db2.gz YFLJOHPIRDTVLY-KRWDZBQOSA-N 2 2 308.853 3.353 20 10 DGCDLP CN(C)c1ccc(C[N@@H+]2C[C@@H]3C[C@H]2C[NH+](C)C3)c2ccccc21 ZINC001275937649 1104962800 /nfs/dbraw/zinc/96/28/00/1104962800.db2.gz IYTKFTCIBYQJHQ-WBVHZDCISA-N 2 2 309.457 3.042 20 10 DGCDLP CN(C)c1ccc(C[N@H+]2C[C@@H]3C[C@H]2C[NH+](C)C3)c2ccccc21 ZINC001275937649 1104962805 /nfs/dbraw/zinc/96/28/05/1104962805.db2.gz IYTKFTCIBYQJHQ-WBVHZDCISA-N 2 2 309.457 3.042 20 10 DGCDLP CN(C)c1ccc(C[NH+]2C[C@@H]3C[C@H]2C[N@H+](C)C3)c2ccccc21 ZINC001275937649 1104962809 /nfs/dbraw/zinc/96/28/09/1104962809.db2.gz IYTKFTCIBYQJHQ-WBVHZDCISA-N 2 2 309.457 3.042 20 10 DGCDLP CN(C)c1ccc(C[NH+]2C[C@@H]3C[C@H]2C[N@@H+](C)C3)c2ccccc21 ZINC001275937649 1104962812 /nfs/dbraw/zinc/96/28/12/1104962812.db2.gz IYTKFTCIBYQJHQ-WBVHZDCISA-N 2 2 309.457 3.042 20 10 DGCDLP C[C@H]([NH2+]C1CC[NH+](CC2CC2)CC1)c1ccc(F)c(F)c1O ZINC000191210252 299272796 /nfs/dbraw/zinc/27/27/96/299272796.db2.gz FPTDZOINWKXLDO-NSHDSACASA-N 2 2 310.388 3.195 20 10 DGCDLP C[C@H](Cn1cc[nH+]c1)[NH2+][C@@H](C)c1cc(Br)ccc1O ZINC000273372591 130113161 /nfs/dbraw/zinc/11/31/61/130113161.db2.gz GKCZNCZUYVNANL-MNOVXSKESA-N 2 2 324.222 3.091 20 10 DGCDLP CC(=O)c1cc(F)cc(C[N@@H+](C)C2CC[NH+](C(C)C)CC2)c1O ZINC000079407027 400863856 /nfs/dbraw/zinc/86/38/56/400863856.db2.gz SAKKQXDBRCNOQM-UHFFFAOYSA-N 2 2 322.424 3.039 20 10 DGCDLP CC(=O)c1cc(F)cc(C[N@H+](C)C2CC[NH+](C(C)C)CC2)c1O ZINC000079407027 400863862 /nfs/dbraw/zinc/86/38/62/400863862.db2.gz SAKKQXDBRCNOQM-UHFFFAOYSA-N 2 2 322.424 3.039 20 10 DGCDLP CCCOc1ccc(C[N@H+](C)[C@@H]2CC[NH+](C)[C@H](C)C2)c(O)c1 ZINC000093644671 431915461 /nfs/dbraw/zinc/91/54/61/431915461.db2.gz MBCAUUZWXDFRJQ-GDBMZVCRSA-N 2 2 306.450 3.096 20 10 DGCDLP CCCOc1ccc(C[N@@H+](C)[C@@H]2CC[NH+](C)[C@H](C)C2)c(O)c1 ZINC000093644671 431915463 /nfs/dbraw/zinc/91/54/63/431915463.db2.gz MBCAUUZWXDFRJQ-GDBMZVCRSA-N 2 2 306.450 3.096 20 10 DGCDLP CCCOc1ccc(C[NH+](C)[C@@H]2CC[N@H+](C)[C@H](C)C2)c(O)c1 ZINC000093644671 431915466 /nfs/dbraw/zinc/91/54/66/431915466.db2.gz MBCAUUZWXDFRJQ-GDBMZVCRSA-N 2 2 306.450 3.096 20 10 DGCDLP CCCOc1ccc(C[NH+](C)[C@@H]2CC[N@@H+](C)[C@H](C)C2)c(O)c1 ZINC000093644671 431915469 /nfs/dbraw/zinc/91/54/69/431915469.db2.gz MBCAUUZWXDFRJQ-GDBMZVCRSA-N 2 2 306.450 3.096 20 10 DGCDLP C[C@H]1CC[N@H+](Cc2c(O)cccc2Cl)C[C@H]1n1cc[nH+]c1 ZINC000271228100 432358491 /nfs/dbraw/zinc/35/84/91/432358491.db2.gz BFMFKLMMCFFXLN-SWLSCSKDSA-N 2 2 305.809 3.325 20 10 DGCDLP C[C@H]1CC[N@@H+](Cc2c(O)cccc2Cl)C[C@H]1n1cc[nH+]c1 ZINC000271228100 432358497 /nfs/dbraw/zinc/35/84/97/432358497.db2.gz BFMFKLMMCFFXLN-SWLSCSKDSA-N 2 2 305.809 3.325 20 10 DGCDLP CCCn1cc[nH+]c1CCC[N@H+](C)Cc1cc(F)ccc1O ZINC000290328798 433031925 /nfs/dbraw/zinc/03/19/25/433031925.db2.gz DNWDSHQYTLRBDL-UHFFFAOYSA-N 2 2 305.397 3.202 20 10 DGCDLP CCCn1cc[nH+]c1CCC[N@@H+](C)Cc1cc(F)ccc1O ZINC000290328798 433031927 /nfs/dbraw/zinc/03/19/27/433031927.db2.gz DNWDSHQYTLRBDL-UHFFFAOYSA-N 2 2 305.397 3.202 20 10 DGCDLP CC[C@@H]([NH2+]Cc1ccc(-n2cc[nH+]c2)nc1)c1ccccc1O ZINC000373212837 433128392 /nfs/dbraw/zinc/12/83/92/433128392.db2.gz VHUSGOPJWGSXIW-MRXNPFEDSA-N 2 2 308.385 3.214 20 10 DGCDLP Cn1cc[nH+]c1[C@@H]1CCC[N@H+](Cc2c(O)ccc(Cl)c2F)C1 ZINC000373228797 433137373 /nfs/dbraw/zinc/13/73/73/433137373.db2.gz NDMJGQZWMGCKMN-LLVKDONJSA-N 2 2 323.799 3.298 20 10 DGCDLP Cn1cc[nH+]c1[C@@H]1CCC[N@@H+](Cc2c(O)ccc(Cl)c2F)C1 ZINC000373228797 433137377 /nfs/dbraw/zinc/13/73/77/433137377.db2.gz NDMJGQZWMGCKMN-LLVKDONJSA-N 2 2 323.799 3.298 20 10 DGCDLP C[N@H+](Cc1cc(Cl)c(F)cc1O)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000294797319 434145838 /nfs/dbraw/zinc/14/58/38/434145838.db2.gz VSNTWGUQRRGNBP-FUNVUKJBSA-N 2 2 312.816 3.242 20 10 DGCDLP C[N@@H+](Cc1cc(Cl)c(F)cc1O)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000294797319 434145849 /nfs/dbraw/zinc/14/58/49/434145849.db2.gz VSNTWGUQRRGNBP-FUNVUKJBSA-N 2 2 312.816 3.242 20 10 DGCDLP C[NH+](Cc1cc(Cl)c(F)cc1O)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000294797319 434145857 /nfs/dbraw/zinc/14/58/57/434145857.db2.gz VSNTWGUQRRGNBP-FUNVUKJBSA-N 2 2 312.816 3.242 20 10 DGCDLP C[NH+](Cc1cc(Cl)c(F)cc1O)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000294797319 434145863 /nfs/dbraw/zinc/14/58/63/434145863.db2.gz VSNTWGUQRRGNBP-FUNVUKJBSA-N 2 2 312.816 3.242 20 10 DGCDLP Oc1cc(F)c(Cl)cc1C[NH+]1CCC(c2[nH]cc[nH+]2)CC1 ZINC000295484378 434381110 /nfs/dbraw/zinc/38/11/10/434381110.db2.gz XHNYDJFLRFPGRV-UHFFFAOYSA-N 2 2 309.772 3.287 20 10 DGCDLP COc1ccc(O)c([C@H](C)[NH2+]Cc2ccccc2-n2cc[nH+]c2)c1 ZINC000185125311 534205311 /nfs/dbraw/zinc/20/53/11/534205311.db2.gz JRDDYCQNEJDRQG-AWEZNQCLSA-N 2 2 323.396 3.437 20 10 DGCDLP C[C@H]1CC[N@H+](CC[NH2+]Cc2ccc(N3CCCCC3)cc2)C1 ZINC000744450028 575343926 /nfs/dbraw/zinc/34/39/26/575343926.db2.gz JJYSAMVIESMYDF-KRWDZBQOSA-N 2 2 301.478 3.108 20 10 DGCDLP C[C@H]1CC[N@@H+](CC[NH2+]Cc2ccc(N3CCCCC3)cc2)C1 ZINC000744450028 575343927 /nfs/dbraw/zinc/34/39/27/575343927.db2.gz JJYSAMVIESMYDF-KRWDZBQOSA-N 2 2 301.478 3.108 20 10 DGCDLP C[N@@H+](Cc1ccc(N2CCCCC2)cc1)C[C@@H]([NH3+])CC(F)F ZINC000903874007 619827495 /nfs/dbraw/zinc/82/74/95/619827495.db2.gz QKLCRAQNYQUVKV-HNNXBMFYSA-N 2 2 311.420 3.091 20 10 DGCDLP C[N@H+](Cc1ccc(N2CCCCC2)cc1)C[C@@H]([NH3+])CC(F)F ZINC000903874007 619827498 /nfs/dbraw/zinc/82/74/98/619827498.db2.gz QKLCRAQNYQUVKV-HNNXBMFYSA-N 2 2 311.420 3.091 20 10 DGCDLP C[NH+](C)CC[C@@H]([NH2+]Cc1cc(Cl)ccc1O)c1cccnc1 ZINC000922629864 621070128 /nfs/dbraw/zinc/07/01/28/621070128.db2.gz AEGZPQGIJBNKKZ-MRXNPFEDSA-N 2 2 319.836 3.223 20 10 DGCDLP C[C@@H]([NH2+]C[C@@H]1CC[N@@H+]1C1CCCC1)c1ccc(N(C)C)cc1 ZINC000858532280 621202274 /nfs/dbraw/zinc/20/22/74/621202274.db2.gz IMPHVWVDEOOLFM-BEFAXECRSA-N 2 2 301.478 3.420 20 10 DGCDLP C[C@@H]([NH2+]C[C@@H]1CC[N@H+]1C1CCCC1)c1ccc(N(C)C)cc1 ZINC000858532280 621202277 /nfs/dbraw/zinc/20/22/77/621202277.db2.gz IMPHVWVDEOOLFM-BEFAXECRSA-N 2 2 301.478 3.420 20 10 DGCDLP [NH3+]C[C@@H]1C[N@H+](Cc2cccc(Cl)c2O)CC[C@H]1C(F)(F)F ZINC000863645973 621693390 /nfs/dbraw/zinc/69/33/90/621693390.db2.gz OZHJDYCLPVBECJ-GHMZBOCLSA-N 2 2 322.758 3.005 20 10 DGCDLP [NH3+]C[C@@H]1C[N@@H+](Cc2cccc(Cl)c2O)CC[C@H]1C(F)(F)F ZINC000863645973 621693393 /nfs/dbraw/zinc/69/33/93/621693393.db2.gz OZHJDYCLPVBECJ-GHMZBOCLSA-N 2 2 322.758 3.005 20 10 DGCDLP C[C@H]([NH2+][C@@H]1CCn2cc[nH+]c2C1)c1ccc2ccccc2c1O ZINC000779061701 623725814 /nfs/dbraw/zinc/72/58/14/623725814.db2.gz MKQKFBRFEWURGK-DZGCQCFKSA-N 2 2 307.397 3.408 20 10 DGCDLP CC[C@H]([NH2+][C@@H]1CCn2cc[nH+]c2C1)c1cc(Cl)ccc1O ZINC000779067357 623726763 /nfs/dbraw/zinc/72/67/63/623726763.db2.gz VZBNVDPYQWIEHB-OCCSQVGLSA-N 2 2 305.809 3.298 20 10 DGCDLP C[NH+]1CCC(C)(C[NH2+]Cc2cc(Cl)cc(F)c2O)CC1 ZINC000780780792 623983055 /nfs/dbraw/zinc/98/30/55/623983055.db2.gz AHANTWVGMVMEHM-UHFFFAOYSA-N 2 2 300.805 3.006 20 10 DGCDLP CCC1([NH+]2CCCC2)CC[NH+](Cc2cc(F)ccc2O)CC1 ZINC000877674191 623987367 /nfs/dbraw/zinc/98/73/67/623987367.db2.gz NVEPEMMUXAJWIC-UHFFFAOYSA-N 2 2 306.425 3.372 20 10 DGCDLP CN(C)c1ccc(C[NH+]2CCC(Nc3cccc[nH+]3)CC2)cc1 ZINC000785764754 624729212 /nfs/dbraw/zinc/72/92/12/624729212.db2.gz GJGNRYRBZVRVFA-UHFFFAOYSA-N 2 2 310.445 3.224 20 10 DGCDLP C[N@@H+]1CCC[C@H]1CC[NH+](Cc1ccco1)Cc1ccccc1O ZINC000128379510 624939115 /nfs/dbraw/zinc/93/91/15/624939115.db2.gz IYRJCENYOGDHKR-KRWDZBQOSA-N 2 2 314.429 3.472 20 10 DGCDLP C[N@H+]1CCC[C@H]1CC[NH+](Cc1ccco1)Cc1ccccc1O ZINC000128379510 624939116 /nfs/dbraw/zinc/93/91/16/624939116.db2.gz IYRJCENYOGDHKR-KRWDZBQOSA-N 2 2 314.429 3.472 20 10 DGCDLP C[NH+]1CCC[C@H]1CC[N@H+](Cc1ccco1)Cc1ccccc1O ZINC000128379510 624939118 /nfs/dbraw/zinc/93/91/18/624939118.db2.gz IYRJCENYOGDHKR-KRWDZBQOSA-N 2 2 314.429 3.472 20 10 DGCDLP C[NH+]1CCC[C@H]1CC[N@@H+](Cc1ccco1)Cc1ccccc1O ZINC000128379510 624939120 /nfs/dbraw/zinc/93/91/20/624939120.db2.gz IYRJCENYOGDHKR-KRWDZBQOSA-N 2 2 314.429 3.472 20 10 DGCDLP C[NH+]1CC[C@H]2[C@@H](CCC[N@@H+]2Cc2c(O)ccc(Cl)c2F)C1 ZINC000809767490 626949546 /nfs/dbraw/zinc/94/95/46/626949546.db2.gz MTDJHSJZKAGEMF-FZMZJTMJSA-N 2 2 312.816 3.101 20 10 DGCDLP C[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2Cc2c(O)ccc(Cl)c2F)C1 ZINC000809767490 626949538 /nfs/dbraw/zinc/94/95/38/626949538.db2.gz MTDJHSJZKAGEMF-FZMZJTMJSA-N 2 2 312.816 3.101 20 10 DGCDLP C[N@H+]1CC[C@H]2[C@@H](CCC[NH+]2Cc2c(O)ccc(Cl)c2F)C1 ZINC000809767490 626949543 /nfs/dbraw/zinc/94/95/43/626949543.db2.gz MTDJHSJZKAGEMF-FZMZJTMJSA-N 2 2 312.816 3.101 20 10 DGCDLP C[NH+]1CC[C@H]2[C@@H](CCC[N@H+]2Cc2c(O)ccc(Cl)c2F)C1 ZINC000809767490 626949549 /nfs/dbraw/zinc/94/95/49/626949549.db2.gz MTDJHSJZKAGEMF-FZMZJTMJSA-N 2 2 312.816 3.101 20 10 DGCDLP C[C@H](CC[NH+](C)C)[NH2+][C@H](C)c1cccc(C(F)(F)F)c1O ZINC000815570989 627685392 /nfs/dbraw/zinc/68/53/92/627685392.db2.gz QSBNUAPMOIPHDY-GHMZBOCLSA-N 2 2 304.356 3.402 20 10 DGCDLP Cc1cc(C)c([C@@H](C)[N@H+]2CCc3sc(C[NH3+])nc3C2)c(O)c1 ZINC000925751779 627787649 /nfs/dbraw/zinc/78/76/49/627787649.db2.gz PSSWPURZMKHWKR-GFCCVEGCSA-N 2 2 317.458 3.044 20 10 DGCDLP Cc1cc(C)c([C@H](C)[N@H+]2CCc3sc(C[NH3+])nc3C2)c(O)c1 ZINC000925751782 627787829 /nfs/dbraw/zinc/78/78/29/627787829.db2.gz PSSWPURZMKHWKR-LBPRGKRZSA-N 2 2 317.458 3.044 20 10 DGCDLP CCC[N@H+](CCC[NH+](C)C)Cc1cc(Cl)c(F)cc1O ZINC000816610833 627814633 /nfs/dbraw/zinc/81/46/33/627814633.db2.gz ANQJRHGSWUUXHS-UHFFFAOYSA-N 2 2 302.821 3.348 20 10 DGCDLP CCC[N@@H+](CCC[NH+](C)C)Cc1cc(Cl)c(F)cc1O ZINC000816610833 627814638 /nfs/dbraw/zinc/81/46/38/627814638.db2.gz ANQJRHGSWUUXHS-UHFFFAOYSA-N 2 2 302.821 3.348 20 10 DGCDLP CC1CCN(c2ccc(C[NH2+][C@@H]3C[NH2+]CC[C@@H]3C)cc2)CC1 ZINC000817902782 627957253 /nfs/dbraw/zinc/95/72/53/627957253.db2.gz YEEROIXBQJRKQY-QFBILLFUSA-N 2 2 301.478 3.011 20 10 DGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+][C@H]2CCc3c2cccc3F)cc1 ZINC000817938972 627967767 /nfs/dbraw/zinc/96/77/67/627967767.db2.gz WQVJFQPUHLHANZ-MOPGFXCFSA-N 2 2 313.420 3.169 20 10 DGCDLP CCC[C@H]([NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1)c1cccnc1 ZINC000817942910 627969737 /nfs/dbraw/zinc/96/97/37/627969737.db2.gz RMZKZJRKYOUDFF-OALUTQOASA-N 2 2 312.461 3.278 20 10 DGCDLP CCC[C@H]([NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1)c1ccccn1 ZINC000817944099 627969956 /nfs/dbraw/zinc/96/99/56/627969956.db2.gz XHEUYSWYRCETRA-ROUUACIJSA-N 2 2 312.461 3.278 20 10 DGCDLP C[C@H]([NH2+][C@@H]1C[NH2+]CC[C@@H]1C)c1ccc(N2CCCCC2)c(F)c1 ZINC000817967208 627977983 /nfs/dbraw/zinc/97/79/83/627977983.db2.gz FOCKMFTUGGSIET-RLFYNMQTSA-N 2 2 319.468 3.465 20 10 DGCDLP C[C@H](CCC[NH3+])[NH2+][C@@H](C)c1cc(Br)c(F)cc1O ZINC000817977930 627981634 /nfs/dbraw/zinc/98/16/34/627981634.db2.gz RSJUTCAHTCRBAE-BDAKNGLRSA-N 2 2 319.218 3.072 20 10 DGCDLP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@@H]2CCc3cccc(O)c32)cn1 ZINC000834523464 629720561 /nfs/dbraw/zinc/72/05/61/629720561.db2.gz UQKCVOUYCXXSTE-MRXNPFEDSA-N 2 2 320.396 3.058 20 10 DGCDLP C[C@H](CCCC(F)(F)F)[NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000841045532 630402069 /nfs/dbraw/zinc/40/20/69/630402069.db2.gz MKZQKWLUGHQZAA-IUODEOHRSA-N 2 2 317.399 3.463 20 10 DGCDLP CCc1ccccc1[C@H]([NH3+])C[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC000841086840 630406236 /nfs/dbraw/zinc/40/62/36/630406236.db2.gz NGLZAARRNNBYHI-GOSISDBHSA-N 2 2 315.436 3.244 20 10 DGCDLP Cc1cc(O)c(C[N@H+]2C[C@@H](c3cccc(F)c3)[C@H]([NH3+])C2)cc1C ZINC000841103007 630408525 /nfs/dbraw/zinc/40/85/25/630408525.db2.gz COUYZCUDLSEQAF-ZWKOTPCHSA-N 2 2 314.404 3.075 20 10 DGCDLP Cc1cc(O)c(C[N@@H+]2C[C@@H](c3cccc(F)c3)[C@H]([NH3+])C2)cc1C ZINC000841103007 630408527 /nfs/dbraw/zinc/40/85/27/630408527.db2.gz COUYZCUDLSEQAF-ZWKOTPCHSA-N 2 2 314.404 3.075 20 10 DGCDLP CCN(Cc1ccccc1)c1ccc(C[N@@H+]2CC[C@H]([NH3+])C2)cc1 ZINC000843046823 630608338 /nfs/dbraw/zinc/60/83/38/630608338.db2.gz DQIFJWXOEHPRFB-IBGZPJMESA-N 2 2 309.457 3.246 20 10 DGCDLP CCN(Cc1ccccc1)c1ccc(C[N@H+]2CC[C@H]([NH3+])C2)cc1 ZINC000843046823 630608340 /nfs/dbraw/zinc/60/83/40/630608340.db2.gz DQIFJWXOEHPRFB-IBGZPJMESA-N 2 2 309.457 3.246 20 10 DGCDLP CN(C)c1ccc(/C=C/C[NH+]2CCC([NH2+]CC3CC3)CC2)cc1 ZINC000843054101 630609099 /nfs/dbraw/zinc/60/90/99/630609099.db2.gz CYWITHVKMXZXMG-ONEGZZNKSA-N 2 2 313.489 3.230 20 10 DGCDLP COc1cc(C[NH2+][C@@H](C)Cn2cc[nH+]c2)c(O)c(C(C)(C)C)c1 ZINC000850029948 632033191 /nfs/dbraw/zinc/03/31/91/632033191.db2.gz FRVSCMLEFWNLRE-ZDUSSCGKSA-N 2 2 317.433 3.073 20 10 DGCDLP COc1ccc(O)c([C@@H](C)[NH2+][C@@H](Cn2cc[nH+]c2)C(C)(C)C)c1 ZINC000319981728 657304086 /nfs/dbraw/zinc/30/40/86/657304086.db2.gz JRGMCEMQTDUTHG-DYVFJYSZSA-N 2 2 317.433 3.363 20 10 DGCDLP Oc1ccc(Cl)cc1C[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000092066533 662327484 /nfs/dbraw/zinc/32/74/84/662327484.db2.gz SOPIYSCLJJLXOC-DYVFJYSZSA-N 2 2 320.864 3.494 20 10 DGCDLP Oc1ccc(Cl)cc1C[N@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000092066533 662327487 /nfs/dbraw/zinc/32/74/87/662327487.db2.gz SOPIYSCLJJLXOC-DYVFJYSZSA-N 2 2 320.864 3.494 20 10 DGCDLP Oc1ccc(Cl)cc1C[NH+]1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000092066533 662327489 /nfs/dbraw/zinc/32/74/89/662327489.db2.gz SOPIYSCLJJLXOC-DYVFJYSZSA-N 2 2 320.864 3.494 20 10 DGCDLP Oc1ccc(Cl)cc1C[NH+]1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000092066533 662327491 /nfs/dbraw/zinc/32/74/91/662327491.db2.gz SOPIYSCLJJLXOC-DYVFJYSZSA-N 2 2 320.864 3.494 20 10 DGCDLP CCC[N@@H+]1CC[C@@H]([NH2+]Cc2ccc(N3CCCCC3)cc2)C1 ZINC000389218092 685192554 /nfs/dbraw/zinc/19/25/54/685192554.db2.gz DNYQMKBKBDAUEE-GOSISDBHSA-N 2 2 301.478 3.251 20 10 DGCDLP CCC[N@H+]1CC[C@@H]([NH2+]Cc2ccc(N3CCCCC3)cc2)C1 ZINC000389218092 685192563 /nfs/dbraw/zinc/19/25/63/685192563.db2.gz DNYQMKBKBDAUEE-GOSISDBHSA-N 2 2 301.478 3.251 20 10 DGCDLP CC1(C)C[NH2+]CC[C@@H]([NH2+]Cc2cc(Cl)c(F)cc2O)C1 ZINC001576480750 1191829066 /nfs/dbraw/zinc/82/90/66/1191829066.db2.gz NZXSTEONNHEHST-LLVKDONJSA-N 2 2 300.805 3.053 20 10 DGCDLP CC1=CCC[C@H](C)[C@H]1C[NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1 ZINC001576556144 1191843561 /nfs/dbraw/zinc/84/35/61/1191843561.db2.gz NZHUESLFRHZUJD-SNRMKQJTSA-N 2 2 301.478 3.334 20 10 DGCDLP CC(C)C[NH+]1CCC([NH2+]Cc2cc(Cl)cc(F)c2O)CC1 ZINC001461033515 1182759823 /nfs/dbraw/zinc/75/98/23/1182759823.db2.gz ZLFOBKNMQWLBHZ-UHFFFAOYSA-N 2 2 314.832 3.395 20 10 DGCDLP CC(C)(C)[C@@H](Cn1cc[nH+]c1)[NH2+]Cc1ccc2c(c1)CCCO2 ZINC001461087243 1182766432 /nfs/dbraw/zinc/76/64/32/1182766432.db2.gz QIUJWMSFCTWUOF-GOSISDBHSA-N 2 2 313.445 3.413 20 10 DGCDLP CC[N@@H+]1CCC[C@H]([NH2+][C@@H](C)Cc2ccc(N(C)C)cc2C)C1 ZINC001621396668 1193837386 /nfs/dbraw/zinc/83/73/86/1193837386.db2.gz PNAVXYNQUDEUSE-WMZOPIPTSA-N 2 2 303.494 3.066 20 10 DGCDLP CC[N@H+]1CCC[C@H]([NH2+][C@@H](C)Cc2ccc(N(C)C)cc2C)C1 ZINC001621396668 1193837389 /nfs/dbraw/zinc/83/73/89/1193837389.db2.gz PNAVXYNQUDEUSE-WMZOPIPTSA-N 2 2 303.494 3.066 20 10 DGCDLP Cc1c[nH+]ccc1O[C@@H]1CC[N@@H+](Cc2ccc(N(C)C)cc2)C1 ZINC001203936804 1090844708 /nfs/dbraw/zinc/84/47/08/1090844708.db2.gz NUVMQOHTJRSMPI-GOSISDBHSA-N 2 2 311.429 3.109 20 10 DGCDLP Cc1c[nH+]ccc1O[C@@H]1CC[N@H+](Cc2ccc(N(C)C)cc2)C1 ZINC001203936804 1090844714 /nfs/dbraw/zinc/84/47/14/1090844714.db2.gz NUVMQOHTJRSMPI-GOSISDBHSA-N 2 2 311.429 3.109 20 10 DGCDLP CCN(CC)c1ccc(C[N@@H+]2C[C@H]3CCC[NH+](C)[C@@H]3C2)cc1 ZINC001203946852 1090848602 /nfs/dbraw/zinc/84/86/02/1090848602.db2.gz YHACHVVVABBPJI-IEBWSBKVSA-N 2 2 301.478 3.059 20 10 DGCDLP CCN(CC)c1ccc(C[N@H+]2C[C@H]3CCC[NH+](C)[C@@H]3C2)cc1 ZINC001203946852 1090848604 /nfs/dbraw/zinc/84/86/04/1090848604.db2.gz YHACHVVVABBPJI-IEBWSBKVSA-N 2 2 301.478 3.059 20 10 DGCDLP CCN(CC)c1ccc(C[NH+]2C[C@H]3CCC[N@H+](C)[C@@H]3C2)cc1 ZINC001203946852 1090848608 /nfs/dbraw/zinc/84/86/08/1090848608.db2.gz YHACHVVVABBPJI-IEBWSBKVSA-N 2 2 301.478 3.059 20 10 DGCDLP CCN(CC)c1ccc(C[NH+]2C[C@H]3CCC[N@@H+](C)[C@@H]3C2)cc1 ZINC001203946852 1090848612 /nfs/dbraw/zinc/84/86/12/1090848612.db2.gz YHACHVVVABBPJI-IEBWSBKVSA-N 2 2 301.478 3.059 20 10 DGCDLP C[C@@H]1CC[C@@H](C[NH3+])C[N@@H+]1Cc1cc(Cl)c(Cl)cc1O ZINC001206811506 1091751266 /nfs/dbraw/zinc/75/12/66/1091751266.db2.gz VQZOMMZBCGPADD-ZJUUUORDSA-N 2 2 303.233 3.258 20 10 DGCDLP C[C@@H]1CC[C@@H](C[NH3+])C[N@H+]1Cc1cc(Cl)c(Cl)cc1O ZINC001206811506 1091751273 /nfs/dbraw/zinc/75/12/73/1091751273.db2.gz VQZOMMZBCGPADD-ZJUUUORDSA-N 2 2 303.233 3.258 20 10 DGCDLP CC[N@H+](CCn1cc[nH+]c1)Cc1ccc(N(C)C)cc1Cl ZINC001140926220 1092066446 /nfs/dbraw/zinc/06/64/46/1092066446.db2.gz ILRHSIXFNQXMBA-UHFFFAOYSA-N 2 2 306.841 3.125 20 10 DGCDLP CC[N@@H+](CCn1cc[nH+]c1)Cc1ccc(N(C)C)cc1Cl ZINC001140926220 1092066457 /nfs/dbraw/zinc/06/64/57/1092066457.db2.gz ILRHSIXFNQXMBA-UHFFFAOYSA-N 2 2 306.841 3.125 20 10 DGCDLP CCCC[NH+]1CCC([N@H+](C)Cc2cc(F)c(F)cc2O)CC1 ZINC001142531307 1092498052 /nfs/dbraw/zinc/49/80/52/1092498052.db2.gz SUQPUVRMRPKUOD-UHFFFAOYSA-N 2 2 312.404 3.367 20 10 DGCDLP CCCC[NH+]1CCC([N@@H+](C)Cc2cc(F)c(F)cc2O)CC1 ZINC001142531307 1092498059 /nfs/dbraw/zinc/49/80/59/1092498059.db2.gz SUQPUVRMRPKUOD-UHFFFAOYSA-N 2 2 312.404 3.367 20 10 DGCDLP [NH3+]C[C@H]1CCCC[N@H+](Cc2c(O)ccc(Cl)c2Cl)C1 ZINC001206639006 1092868284 /nfs/dbraw/zinc/86/82/84/1092868284.db2.gz AJMYIKDGMBUKSV-SNVBAGLBSA-N 2 2 303.233 3.260 20 10 DGCDLP [NH3+]C[C@H]1CCCC[N@@H+](Cc2c(O)ccc(Cl)c2Cl)C1 ZINC001206639006 1092868297 /nfs/dbraw/zinc/86/82/97/1092868297.db2.gz AJMYIKDGMBUKSV-SNVBAGLBSA-N 2 2 303.233 3.260 20 10 DGCDLP C[NH+](C)[C@@H]1CC[C@H]2C[N@H+](Cc3cccc(Cl)c3O)C[C@@H]2C1 ZINC001336889366 1094774933 /nfs/dbraw/zinc/77/49/33/1094774933.db2.gz SQBDVQVXOBIRCF-AEGPPILISA-N 2 2 308.853 3.208 20 10 DGCDLP C[NH+](C)[C@@H]1CC[C@H]2C[N@@H+](Cc3cccc(Cl)c3O)C[C@@H]2C1 ZINC001336889366 1094774946 /nfs/dbraw/zinc/77/49/46/1094774946.db2.gz SQBDVQVXOBIRCF-AEGPPILISA-N 2 2 308.853 3.208 20 10 DGCDLP CCC[N@H+](Cc1cc(Cl)cc(C(C)=O)c1O)C1CC[NH2+]CC1 ZINC000315286163 1095098025 /nfs/dbraw/zinc/09/80/25/1095098025.db2.gz VEXMNAANEOWDIP-UHFFFAOYSA-N 2 2 324.852 3.212 20 10 DGCDLP CCC[N@@H+](Cc1cc(Cl)cc(C(C)=O)c1O)C1CC[NH2+]CC1 ZINC000315286163 1095098039 /nfs/dbraw/zinc/09/80/39/1095098039.db2.gz VEXMNAANEOWDIP-UHFFFAOYSA-N 2 2 324.852 3.212 20 10 DGCDLP Oc1ccc(F)c(Cl)c1C[N@@H+]1CCC[C@@]12CCC[NH2+]CC2 ZINC001222320494 1095549320 /nfs/dbraw/zinc/54/93/20/1095549320.db2.gz IKADMKXEGMGFEC-MRXNPFEDSA-N 2 2 312.816 3.293 20 10 DGCDLP Oc1ccc(F)c(Cl)c1C[N@H+]1CCC[C@@]12CCC[NH2+]CC2 ZINC001222320494 1095549322 /nfs/dbraw/zinc/54/93/22/1095549322.db2.gz IKADMKXEGMGFEC-MRXNPFEDSA-N 2 2 312.816 3.293 20 10 DGCDLP C[N@@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1Cc1cccc(F)c1O ZINC001138128358 1095898847 /nfs/dbraw/zinc/89/88/47/1095898847.db2.gz FLIANHQVQQHFHI-JKSUJKDBSA-N 2 2 306.425 3.370 20 10 DGCDLP C[N@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1Cc1cccc(F)c1O ZINC001138128358 1095898868 /nfs/dbraw/zinc/89/88/68/1095898868.db2.gz FLIANHQVQQHFHI-JKSUJKDBSA-N 2 2 306.425 3.370 20 10 DGCDLP C[NH+]1CCC[C@H]1C[C@H]1CCCC[N@@H+]1Cc1cccc(F)c1O ZINC001138128358 1095898892 /nfs/dbraw/zinc/89/88/92/1095898892.db2.gz FLIANHQVQQHFHI-JKSUJKDBSA-N 2 2 306.425 3.370 20 10 DGCDLP CC[N@H+](CCC[NH+](C)C)Cc1cccc(OC(F)(F)F)c1O ZINC001233768742 1098427526 /nfs/dbraw/zinc/42/75/26/1098427526.db2.gz YFIFAJUTVWFZCO-UHFFFAOYSA-N 2 2 320.355 3.064 20 10 DGCDLP CC[N@@H+](CCC[NH+](C)C)Cc1cccc(OC(F)(F)F)c1O ZINC001233768742 1098427527 /nfs/dbraw/zinc/42/75/27/1098427527.db2.gz YFIFAJUTVWFZCO-UHFFFAOYSA-N 2 2 320.355 3.064 20 10 DGCDLP Oc1ccc(F)c(Cl)c1C[N@@H+]1CCC[C@@]2(CCC[NH2+]2)CC1 ZINC001235036793 1098767108 /nfs/dbraw/zinc/76/71/08/1098767108.db2.gz BQVGUBZVEXUJOU-INIZCTEOSA-N 2 2 312.816 3.293 20 10 DGCDLP Oc1ccc(F)c(Cl)c1C[N@H+]1CCC[C@@]2(CCC[NH2+]2)CC1 ZINC001235036793 1098767114 /nfs/dbraw/zinc/76/71/14/1098767114.db2.gz BQVGUBZVEXUJOU-INIZCTEOSA-N 2 2 312.816 3.293 20 10 DGCDLP C[C@@]1(C[NH3+])CCC[N@H+](Cc2cc(Cl)cc(F)c2O)CC1 ZINC001206324335 1098783800 /nfs/dbraw/zinc/78/38/00/1098783800.db2.gz ABKKENQOOZZOQZ-OAHLLOKOSA-N 2 2 300.805 3.136 20 10 DGCDLP C[C@@]1(C[NH3+])CCC[N@@H+](Cc2cc(Cl)cc(F)c2O)CC1 ZINC001206324335 1098783811 /nfs/dbraw/zinc/78/38/11/1098783811.db2.gz ABKKENQOOZZOQZ-OAHLLOKOSA-N 2 2 300.805 3.136 20 10 DGCDLP CN(C)c1ccc(C[N@@H+]2C[C@H]3CCC[NH2+][C@H]3C2)c2ccccc21 ZINC001235210301 1098881184 /nfs/dbraw/zinc/88/11/84/1098881184.db2.gz WUNZHLUZXVNFGJ-APWZRJJASA-N 2 2 309.457 3.090 20 10 DGCDLP CN(C)c1ccc(C[N@H+]2C[C@H]3CCC[NH2+][C@H]3C2)c2ccccc21 ZINC001235210301 1098881197 /nfs/dbraw/zinc/88/11/97/1098881197.db2.gz WUNZHLUZXVNFGJ-APWZRJJASA-N 2 2 309.457 3.090 20 10 DGCDLP C[N@H+](Cc1cccc(C(F)(F)F)c1O)[C@H]1CCCC[C@H]1[NH3+] ZINC001236214081 1099470171 /nfs/dbraw/zinc/47/01/71/1099470171.db2.gz DXIFZAYVWGMKOW-OLZOCXBDSA-N 2 2 302.340 3.113 20 10 DGCDLP C[N@@H+](Cc1cccc(C(F)(F)F)c1O)[C@H]1CCCC[C@H]1[NH3+] ZINC001236214081 1099470177 /nfs/dbraw/zinc/47/01/77/1099470177.db2.gz DXIFZAYVWGMKOW-OLZOCXBDSA-N 2 2 302.340 3.113 20 10 DGCDLP Oc1cc(Cl)c(F)cc1C[N@H+](C[C@@H]1CCC[NH2+]C1)C1CC1 ZINC001236600760 1099697497 /nfs/dbraw/zinc/69/74/97/1099697497.db2.gz JBHMHZDZNAHLED-LLVKDONJSA-N 2 2 312.816 3.149 20 10 DGCDLP Oc1cc(Cl)c(F)cc1C[N@@H+](C[C@@H]1CCC[NH2+]C1)C1CC1 ZINC001236600760 1099697498 /nfs/dbraw/zinc/69/74/98/1099697498.db2.gz JBHMHZDZNAHLED-LLVKDONJSA-N 2 2 312.816 3.149 20 10 DGCDLP CCC[N@@H+](Cc1c(O)ccc(F)c1Cl)C[C@@H]1CC[NH2+]C1 ZINC001236843844 1099828904 /nfs/dbraw/zinc/82/89/04/1099828904.db2.gz RNOMBZBXLQAQIS-LLVKDONJSA-N 2 2 300.805 3.006 20 10 DGCDLP CCC[N@H+](Cc1c(O)ccc(F)c1Cl)C[C@@H]1CC[NH2+]C1 ZINC001236843844 1099828913 /nfs/dbraw/zinc/82/89/13/1099828913.db2.gz RNOMBZBXLQAQIS-LLVKDONJSA-N 2 2 300.805 3.006 20 10 DGCDLP CCC[N@@H+](Cc1c(O)ccc(F)c1Cl)C[C@H]1CC[NH2+]C1 ZINC001236843845 1099830082 /nfs/dbraw/zinc/83/00/82/1099830082.db2.gz RNOMBZBXLQAQIS-NSHDSACASA-N 2 2 300.805 3.006 20 10 DGCDLP CCC[N@H+](Cc1c(O)ccc(F)c1Cl)C[C@H]1CC[NH2+]C1 ZINC001236843845 1099830093 /nfs/dbraw/zinc/83/00/93/1099830093.db2.gz RNOMBZBXLQAQIS-NSHDSACASA-N 2 2 300.805 3.006 20 10 DGCDLP [NH3+]C[C@@H]1Cc2ccccc2C[N@@H+]1Cc1ccc2ccccc2c1O ZINC001237026861 1099932995 /nfs/dbraw/zinc/93/29/95/1099932995.db2.gz ALRDBBVUEPQJDO-IBGZPJMESA-N 2 2 318.420 3.431 20 10 DGCDLP [NH3+]C[C@@H]1Cc2ccccc2C[N@H+]1Cc1ccc2ccccc2c1O ZINC001237026861 1099933008 /nfs/dbraw/zinc/93/30/08/1099933008.db2.gz ALRDBBVUEPQJDO-IBGZPJMESA-N 2 2 318.420 3.431 20 10 DGCDLP Cc1cc(Cl)cc(C[NH+]2CCC([N@H+](C)C3CC3)CC2)c1O ZINC001237689963 1100214137 /nfs/dbraw/zinc/21/41/37/1100214137.db2.gz SQUNVSXEHKFSBE-UHFFFAOYSA-N 2 2 308.853 3.413 20 10 DGCDLP Cc1cc(Cl)cc(C[NH+]2CCC([N@@H+](C)C3CC3)CC2)c1O ZINC001237689963 1100214142 /nfs/dbraw/zinc/21/41/42/1100214142.db2.gz SQUNVSXEHKFSBE-UHFFFAOYSA-N 2 2 308.853 3.413 20 10 DGCDLP Cc1cc(F)cc(C[NH+]2CCC([NH+]3CCCCC3)CC2)c1O ZINC001238058333 1100345748 /nfs/dbraw/zinc/34/57/48/1100345748.db2.gz QNYMJNOQBYWXNQ-UHFFFAOYSA-N 2 2 306.425 3.290 20 10 DGCDLP Cc1cc(F)cc(C[NH+]2CCC(C)([NH+]3CCCC3)CC2)c1O ZINC001238068984 1100347897 /nfs/dbraw/zinc/34/78/97/1100347897.db2.gz XCRHVRWZUNNYIA-UHFFFAOYSA-N 2 2 306.425 3.290 20 10 DGCDLP c1c[nH+]c(C2CC[NH+](Cc3ccc(N4CCCC4)cc3)CC2)[nH]1 ZINC001320494771 1107024835 /nfs/dbraw/zinc/02/48/35/1107024835.db2.gz YUXDGVGVJCCKQY-UHFFFAOYSA-N 2 2 310.445 3.390 20 10 DGCDLP C[C@H](Cn1cc[nH+]c1)[NH2+][C@H](C)c1cc(Br)ccc1O ZINC000273372589 130112475 /nfs/dbraw/zinc/11/24/75/130112475.db2.gz GKCZNCZUYVNANL-GHMZBOCLSA-N 2 2 324.222 3.091 20 10 DGCDLP C[C@@H]1CC[N@H+](Cc2c(O)ccc(Cl)c2F)C[C@@H]1n1cc[nH+]c1 ZINC000191442906 432265666 /nfs/dbraw/zinc/26/56/66/432265666.db2.gz SJPKRNAHUGEQES-RISCZKNCSA-N 2 2 323.799 3.464 20 10 DGCDLP C[C@@H]1CC[N@@H+](Cc2c(O)ccc(Cl)c2F)C[C@@H]1n1cc[nH+]c1 ZINC000191442906 432265671 /nfs/dbraw/zinc/26/56/71/432265671.db2.gz SJPKRNAHUGEQES-RISCZKNCSA-N 2 2 323.799 3.464 20 10 DGCDLP CCN(CC)c1ccc(C[N@H+](C)CCCn2cc[nH+]c2)cc1 ZINC000271985513 432432791 /nfs/dbraw/zinc/43/27/91/432432791.db2.gz PDLZOBDAXJUTGW-UHFFFAOYSA-N 2 2 300.450 3.251 20 10 DGCDLP CCN(CC)c1ccc(C[N@@H+](C)CCCn2cc[nH+]c2)cc1 ZINC000271985513 432432796 /nfs/dbraw/zinc/43/27/96/432432796.db2.gz PDLZOBDAXJUTGW-UHFFFAOYSA-N 2 2 300.450 3.251 20 10 DGCDLP Oc1cc(F)c(Cl)cc1C[N@@H+]1CC[C@H](C[NH+]2CCCC2)C1 ZINC000295436023 434359130 /nfs/dbraw/zinc/35/91/30/434359130.db2.gz UDWAKAXUSWELQK-GFCCVEGCSA-N 2 2 312.816 3.102 20 10 DGCDLP Oc1cc(F)c(Cl)cc1C[N@H+]1CC[C@H](C[NH+]2CCCC2)C1 ZINC000295436023 434359141 /nfs/dbraw/zinc/35/91/41/434359141.db2.gz UDWAKAXUSWELQK-GFCCVEGCSA-N 2 2 312.816 3.102 20 10 DGCDLP COc1ccc(O)c([C@@H](C)[NH2+]Cc2ccccc2-n2cc[nH+]c2)c1 ZINC000185125326 534203821 /nfs/dbraw/zinc/20/38/21/534203821.db2.gz JRDDYCQNEJDRQG-CQSZACIVSA-N 2 2 323.396 3.437 20 10 DGCDLP C[C@@H]([NH2+]CCc1cn2ccccc2[nH+]1)c1ccc(N(C)C)cc1 ZINC000130585266 525467398 /nfs/dbraw/zinc/46/73/98/525467398.db2.gz IFHHUCQXOUAPJL-OAHLLOKOSA-N 2 2 308.429 3.294 20 10 DGCDLP Cc1ccc([C@H](C)[NH2+][C@@H]2C[NH2+]CC[C@@H]2c2ccccc2)c(O)c1 ZINC000854222965 620785589 /nfs/dbraw/zinc/78/55/89/620785589.db2.gz PQQNJNXDSQAFCT-KFKAGJAMSA-N 2 2 310.441 3.497 20 10 DGCDLP C[C@@H]1C[N@H+](Cc2cccc(Cl)c2O)CCN1c1cc[nH+]cc1 ZINC000895558287 618799120 /nfs/dbraw/zinc/79/91/20/618799120.db2.gz VDDJBKHPDIVMLA-CYBMUJFWSA-N 2 2 317.820 3.151 20 10 DGCDLP C[C@@H]1C[N@@H+](Cc2cccc(Cl)c2O)CCN1c1cc[nH+]cc1 ZINC000895558287 618799121 /nfs/dbraw/zinc/79/91/21/618799121.db2.gz VDDJBKHPDIVMLA-CYBMUJFWSA-N 2 2 317.820 3.151 20 10 DGCDLP C[C@@H]([NH2+][C@@H]1Cc2ccccc2[C@H]1[NH3+])c1cc(Cl)ccc1O ZINC000902435138 619635770 /nfs/dbraw/zinc/63/57/70/619635770.db2.gz AEGGTAZZGJDFKL-IGGJQXEISA-N 2 2 302.805 3.321 20 10 DGCDLP C[NH+](C)CC[C@H]([NH2+][C@@H]1CCc2cccc(O)c21)c1cccnc1 ZINC000903381371 619768759 /nfs/dbraw/zinc/76/87/59/619768759.db2.gz WBCQKNTVVGNJGZ-DLBZAZTESA-N 2 2 311.429 3.057 20 10 DGCDLP C[C@@H]([NH2+]C1CC[NH+](CC2CC2)CC1)c1cc(F)cc(F)c1O ZINC000756431623 621638203 /nfs/dbraw/zinc/63/82/03/621638203.db2.gz CQAWYVQPOOGYLZ-LLVKDONJSA-N 2 2 310.388 3.195 20 10 DGCDLP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2cc(F)cc(F)c2O)C1 ZINC000756546348 621646650 /nfs/dbraw/zinc/64/66/50/621646650.db2.gz OWFDCATVSIKMCA-STQMWFEESA-N 2 2 312.404 3.441 20 10 DGCDLP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2cc(F)cc(F)c2O)C1 ZINC000756546348 621646651 /nfs/dbraw/zinc/64/66/51/621646651.db2.gz OWFDCATVSIKMCA-STQMWFEESA-N 2 2 312.404 3.441 20 10 DGCDLP CC[C@@H]([NH2+]CCCCn1cc[nH+]c1)c1ccc(N(C)C)cc1 ZINC000765258382 622254925 /nfs/dbraw/zinc/25/49/25/622254925.db2.gz LAQUTEBGJCCTIF-GOSISDBHSA-N 2 2 300.450 3.470 20 10 DGCDLP CCN(C)c1ccc([C@H](C)[NH2+]C[C@]2([NH+](C)C)CCSC2)cc1 ZINC000766438406 622329565 /nfs/dbraw/zinc/32/95/65/622329565.db2.gz LEFNUDOJFFBEFW-MAUKXSAKSA-N 2 2 321.534 3.231 20 10 DGCDLP CC[C@H]([NH2+]C[C@@]1([NH+](C)C)CCSC1)c1ccc(N(C)C)cc1 ZINC000766440728 622330079 /nfs/dbraw/zinc/33/00/79/622330079.db2.gz YVBYIWHYBJKHKQ-ROUUACIJSA-N 2 2 321.534 3.231 20 10 DGCDLP CC1(C)C[NH2+]CC[C@H]([NH2+]Cc2c(O)ccc(Cl)c2F)C1 ZINC000872254330 622867811 /nfs/dbraw/zinc/86/78/11/622867811.db2.gz ZTANIPKQEHHHTN-JTQLQIEISA-N 2 2 300.805 3.053 20 10 DGCDLP C[N@H+](CCCCCC[NH3+])Cc1cccc(Br)c1O ZINC000873231508 623083639 /nfs/dbraw/zinc/08/36/39/623083639.db2.gz LSDUHYILYVPNMR-UHFFFAOYSA-N 2 2 315.255 3.106 20 10 DGCDLP C[N@@H+](CCCCCC[NH3+])Cc1cccc(Br)c1O ZINC000873231508 623083645 /nfs/dbraw/zinc/08/36/45/623083645.db2.gz LSDUHYILYVPNMR-UHFFFAOYSA-N 2 2 315.255 3.106 20 10 DGCDLP Cc1[nH+]ccn1C[C@@H](C)C[NH2+]Cc1cc(Cl)cc(F)c1O ZINC000775905161 623348368 /nfs/dbraw/zinc/34/83/68/623348368.db2.gz HXDZERJLUNULSZ-JTQLQIEISA-N 2 2 311.788 3.116 20 10 DGCDLP C[C@H]([NH2+]Cc1ccccc1Cn1cc[nH+]c1)c1ccccc1O ZINC000783498863 624359175 /nfs/dbraw/zinc/35/91/75/624359175.db2.gz JKZZBTYWEIWJLV-HNNXBMFYSA-N 2 2 307.397 3.488 20 10 DGCDLP Oc1ccc(Cl)cc1C[NH+]1CCC([NH+]2CCCCC2)CC1 ZINC000132475621 626720190 /nfs/dbraw/zinc/72/01/90/626720190.db2.gz PZUWVXLTKQJKOB-UHFFFAOYSA-N 2 2 308.853 3.496 20 10 DGCDLP Cc1cc(Cl)cc([C@H](C)[NH2+][C@H]2CCn3cc[nH+]c3C2)c1O ZINC000808715530 626853269 /nfs/dbraw/zinc/85/32/69/626853269.db2.gz VLILYIHOQWRABP-AAEUAGOBSA-N 2 2 305.809 3.216 20 10 DGCDLP Cc1cc(Cl)cc([C@@H](C)[NH2+][C@H]2CCc3[nH+]c[nH]c3C2)c1O ZINC000810252776 626992930 /nfs/dbraw/zinc/99/29/30/626992930.db2.gz JAGDGZACBXOBJP-PWSUYJOCSA-N 2 2 305.809 3.285 20 10 DGCDLP COc1cccc([C@H](C)[NH2+]C[C@H]([NH3+])c2ccc(N(C)C)cc2)c1 ZINC000817939035 627967298 /nfs/dbraw/zinc/96/72/98/627967298.db2.gz XZISWMMIWWMLIE-LIRRHRJNSA-N 2 2 313.445 3.112 20 10 DGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+][C@@H](c2ccccc2)C2CC2)cc1 ZINC000817942605 627969462 /nfs/dbraw/zinc/96/94/62/627969462.db2.gz PWBBQWVDUSEMOG-UXHICEINSA-N 2 2 309.457 3.493 20 10 DGCDLP CCC[C@@H]([NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1)c1ccccn1 ZINC000817944097 627969947 /nfs/dbraw/zinc/96/99/47/627969947.db2.gz XHEUYSWYRCETRA-QZTJIDSGSA-N 2 2 312.461 3.278 20 10 DGCDLP CC[C@@H]([NH2+][C@@H](C[NH3+])C1CC1)c1ccc(C(F)(F)F)cc1O ZINC000817959687 627974717 /nfs/dbraw/zinc/97/47/17/627974717.db2.gz GIJGAACJWZEXRK-OLZOCXBDSA-N 2 2 302.340 3.189 20 10 DGCDLP CCC[NH2+]CC[NH2+][C@H](C)c1cc(Br)cc(C)c1O ZINC000817962019 627976798 /nfs/dbraw/zinc/97/67/98/627976798.db2.gz GMVNETSROCEKOH-LLVKDONJSA-N 2 2 315.255 3.113 20 10 DGCDLP CCC[NH2+]CC[NH2+][C@H](CC)c1ccc(C(F)(F)F)cc1O ZINC000817963560 627977094 /nfs/dbraw/zinc/97/70/94/627977094.db2.gz UZSYFBVBBNENAM-CYBMUJFWSA-N 2 2 304.356 3.451 20 10 DGCDLP CC[NH2+][C@H](C)C[NH2+][C@H](CC)c1cc(Br)ccc1O ZINC000817972015 627979762 /nfs/dbraw/zinc/97/97/62/627979762.db2.gz JFTCEYRVLNORGP-ZWNOBZJWSA-N 2 2 315.255 3.193 20 10 DGCDLP Oc1c(Cl)cccc1C[NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1 ZINC000827951072 629007395 /nfs/dbraw/zinc/00/73/95/629007395.db2.gz VLJRXFPOQNLYHO-CQSZACIVSA-N 2 2 308.853 3.257 20 10 DGCDLP Oc1c(Cl)cccc1C[NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC000827951072 629007400 /nfs/dbraw/zinc/00/74/00/629007400.db2.gz VLJRXFPOQNLYHO-CQSZACIVSA-N 2 2 308.853 3.257 20 10 DGCDLP C[C@@H](CCc1ccccc1)[NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000841044573 630401469 /nfs/dbraw/zinc/40/14/69/630401469.db2.gz DIJWMNZSZNUVFA-OXJNMPFZSA-N 2 2 311.473 3.363 20 10 DGCDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+]Cc2cncc3ccccc32)cc1 ZINC000841045685 630401860 /nfs/dbraw/zinc/40/18/60/630401860.db2.gz OFXJBHXSPFSDDZ-FQEVSTJZSA-N 2 2 320.440 3.090 20 10 DGCDLP Cc1cccn2c(CN3CCCc4cc(C[NH3+])ccc43)c[nH+]c12 ZINC000843058381 630609771 /nfs/dbraw/zinc/60/97/71/630609771.db2.gz QISLMAWGXSUSNW-UHFFFAOYSA-N 2 2 306.413 3.054 20 10 DGCDLP C[C@@H]1CCC[N@H+](Cc2c(O)ccc(Cl)c2F)[C@H]1CC[NH3+] ZINC000844900686 630970314 /nfs/dbraw/zinc/97/03/14/630970314.db2.gz CQEYFWAGPMEDNQ-MFKMUULPSA-N 2 2 300.805 3.134 20 10 DGCDLP COc1cccc([C@@H](C)[NH2+]CCCCNc2cccc[nH+]2)c1O ZINC000846143764 631211876 /nfs/dbraw/zinc/21/18/76/631211876.db2.gz HHFTVXWREBXZBR-CQSZACIVSA-N 2 2 315.417 3.339 20 10 DGCDLP CC(=O)c1cc(Cl)cc(C[N@H+]2CCC[C@@H](C)[C@H]2CC[NH3+])c1O ZINC000846226376 631215578 /nfs/dbraw/zinc/21/55/78/631215578.db2.gz LSUNYZQWXQGEQJ-BDJLRTHQSA-N 2 2 324.852 3.198 20 10 DGCDLP CC(=O)c1cc(Cl)cc(C[N@@H+]2CCC[C@@H](C)[C@H]2CC[NH3+])c1O ZINC000846226376 631215579 /nfs/dbraw/zinc/21/55/79/631215579.db2.gz LSUNYZQWXQGEQJ-BDJLRTHQSA-N 2 2 324.852 3.198 20 10 DGCDLP C[C@H]([NH2+][C@@H]1CCC[N@@H+]2CCCC[C@@H]12)c1ccc(N(C)C)cc1 ZINC000848568695 631696678 /nfs/dbraw/zinc/69/66/78/631696678.db2.gz OQBMUPNFLMXWMB-IPELMVKDSA-N 2 2 301.478 3.420 20 10 DGCDLP C[C@H]([NH2+][C@@H]1CCC[N@H+]2CCCC[C@@H]12)c1ccc(N(C)C)cc1 ZINC000848568695 631696681 /nfs/dbraw/zinc/69/66/81/631696681.db2.gz OQBMUPNFLMXWMB-IPELMVKDSA-N 2 2 301.478 3.420 20 10 DGCDLP CCc1cccc(C[NH2+]Cc2ccc(-n3cc[nH+]c3C)nc2)c1O ZINC000848895151 631776394 /nfs/dbraw/zinc/77/63/94/631776394.db2.gz RFABLYUQFGXVEG-UHFFFAOYSA-N 2 2 322.412 3.134 20 10 DGCDLP Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1CCC[N@@H+]2CCCC[C@H]12 ZINC000848927647 631790927 /nfs/dbraw/zinc/79/09/27/631790927.db2.gz JOKFUSKURGAJAO-RTBURBONSA-N 2 2 301.478 3.168 20 10 DGCDLP Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1CCC[N@H+]2CCCC[C@H]12 ZINC000848927647 631790933 /nfs/dbraw/zinc/79/09/33/631790933.db2.gz JOKFUSKURGAJAO-RTBURBONSA-N 2 2 301.478 3.168 20 10 DGCDLP CCC[N@@H+]1CC[C@H]([NH2+]Cc2ccc(N3CCCCC3)cc2)C1 ZINC000389218093 685192884 /nfs/dbraw/zinc/19/28/84/685192884.db2.gz DNYQMKBKBDAUEE-SFHVURJKSA-N 2 2 301.478 3.251 20 10 DGCDLP CCC[N@H+]1CC[C@H]([NH2+]Cc2ccc(N3CCCCC3)cc2)C1 ZINC000389218093 685192887 /nfs/dbraw/zinc/19/28/87/685192887.db2.gz DNYQMKBKBDAUEE-SFHVURJKSA-N 2 2 301.478 3.251 20 10 DGCDLP Oc1cc(Cl)ccc1C[N@@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC001474313873 1183902495 /nfs/dbraw/zinc/90/24/95/1183902495.db2.gz GNSSRVJJPLZXSI-CQSZACIVSA-N 2 2 308.853 3.353 20 10 DGCDLP Oc1cc(Cl)ccc1C[N@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC001474313873 1183902497 /nfs/dbraw/zinc/90/24/97/1183902497.db2.gz GNSSRVJJPLZXSI-CQSZACIVSA-N 2 2 308.853 3.353 20 10 DGCDLP C[C@]1([NH3+])CCC[N@H+](Cc2c(O)ccc(Cl)c2Cl)CC1 ZINC001205288336 1084088936 /nfs/dbraw/zinc/08/89/36/1084088936.db2.gz IVQRLNLSUQENJE-AWEZNQCLSA-N 2 2 303.233 3.402 20 10 DGCDLP C[C@]1([NH3+])CCC[N@@H+](Cc2c(O)ccc(Cl)c2Cl)CC1 ZINC001205288336 1084088946 /nfs/dbraw/zinc/08/89/46/1084088946.db2.gz IVQRLNLSUQENJE-AWEZNQCLSA-N 2 2 303.233 3.402 20 10 DGCDLP Cc1cc(O)c(C[NH+]2CCC(c3c[nH+]cn3C)CC2)c(Cl)c1 ZINC001184364028 1084157203 /nfs/dbraw/zinc/15/72/03/1084157203.db2.gz KCCHDXFXIHLYAV-UHFFFAOYSA-N 2 2 319.836 3.467 20 10 DGCDLP CN(C)c1ccc(C[N@@H+]2C[C@@H]3CCC[NH+](C)[C@@H]3C2)c2ccccc21 ZINC001204240390 1090931102 /nfs/dbraw/zinc/93/11/02/1090931102.db2.gz QXKGVIARFUIZRR-LAUBAEHRSA-N 2 2 323.484 3.432 20 10 DGCDLP CN(C)c1ccc(C[N@H+]2C[C@@H]3CCC[NH+](C)[C@@H]3C2)c2ccccc21 ZINC001204240390 1090931106 /nfs/dbraw/zinc/93/11/06/1090931106.db2.gz QXKGVIARFUIZRR-LAUBAEHRSA-N 2 2 323.484 3.432 20 10 DGCDLP CN(C)c1ccc(C[NH+]2C[C@@H]3CCC[N@H+](C)[C@@H]3C2)c2ccccc21 ZINC001204240390 1090931109 /nfs/dbraw/zinc/93/11/09/1090931109.db2.gz QXKGVIARFUIZRR-LAUBAEHRSA-N 2 2 323.484 3.432 20 10 DGCDLP CN(C)c1ccc(C[NH+]2C[C@@H]3CCC[N@@H+](C)[C@@H]3C2)c2ccccc21 ZINC001204240390 1090931117 /nfs/dbraw/zinc/93/11/17/1090931117.db2.gz QXKGVIARFUIZRR-LAUBAEHRSA-N 2 2 323.484 3.432 20 10 DGCDLP [NH3+][C@@H]1C[N@H+](Cc2cc(-c3ccc(F)cc3)ccc2O)CC12CC2 ZINC001204911627 1091060697 /nfs/dbraw/zinc/06/06/97/1091060697.db2.gz KGVMOEFNMHFUGU-GOSISDBHSA-N 2 2 312.388 3.121 20 10 DGCDLP [NH3+][C@@H]1C[N@@H+](Cc2cc(-c3ccc(F)cc3)ccc2O)CC12CC2 ZINC001204911627 1091060702 /nfs/dbraw/zinc/06/07/02/1091060702.db2.gz KGVMOEFNMHFUGU-GOSISDBHSA-N 2 2 312.388 3.121 20 10 DGCDLP C[C@]1(C[NH3+])CCCC[N@H+](Cc2c(O)ccc(F)c2Cl)C1 ZINC001206575203 1091674885 /nfs/dbraw/zinc/67/48/85/1091674885.db2.gz UZVPXVBCFAYNJP-OAHLLOKOSA-N 2 2 300.805 3.136 20 10 DGCDLP C[C@]1(C[NH3+])CCCC[N@@H+](Cc2c(O)ccc(F)c2Cl)C1 ZINC001206575203 1091674887 /nfs/dbraw/zinc/67/48/87/1091674887.db2.gz UZVPXVBCFAYNJP-OAHLLOKOSA-N 2 2 300.805 3.136 20 10 DGCDLP Cc1c[nH+]ccc1O[C@H]1CC[N@H+](Cc2ccc(Cl)cc2O)C1 ZINC001140468336 1091878751 /nfs/dbraw/zinc/87/87/51/1091878751.db2.gz GOYYBTJGWFXHMN-HNNXBMFYSA-N 2 2 318.804 3.402 20 10 DGCDLP Cc1c[nH+]ccc1O[C@H]1CC[N@@H+](Cc2ccc(Cl)cc2O)C1 ZINC001140468336 1091878759 /nfs/dbraw/zinc/87/87/59/1091878759.db2.gz GOYYBTJGWFXHMN-HNNXBMFYSA-N 2 2 318.804 3.402 20 10 DGCDLP C[NH+](C)[C@@H]1CC[C@@H]2C[N@H+](Cc3cccc(Cl)c3O)C[C@H]2C1 ZINC001336889367 1094774414 /nfs/dbraw/zinc/77/44/14/1094774414.db2.gz SQBDVQVXOBIRCF-BPLDGKMQSA-N 2 2 308.853 3.208 20 10 DGCDLP C[NH+](C)[C@@H]1CC[C@@H]2C[N@@H+](Cc3cccc(Cl)c3O)C[C@H]2C1 ZINC001336889367 1094774426 /nfs/dbraw/zinc/77/44/26/1094774426.db2.gz SQBDVQVXOBIRCF-BPLDGKMQSA-N 2 2 308.853 3.208 20 10 DGCDLP Oc1cc(Cl)c(F)cc1C[N@@H+]1CCC[C@@]2(CCC[NH2+]C2)C1 ZINC001222277829 1095524673 /nfs/dbraw/zinc/52/46/73/1095524673.db2.gz SUVASBFVWSLESD-MRXNPFEDSA-N 2 2 312.816 3.150 20 10 DGCDLP Oc1cc(Cl)c(F)cc1C[N@H+]1CCC[C@@]2(CCC[NH2+]C2)C1 ZINC001222277829 1095524680 /nfs/dbraw/zinc/52/46/80/1095524680.db2.gz SUVASBFVWSLESD-MRXNPFEDSA-N 2 2 312.816 3.150 20 10 DGCDLP c1cc(N2CCCCC2)ccc1C[N@@H+]1CC[C@]2(C1)CCCC[NH2+]2 ZINC001222427262 1095609083 /nfs/dbraw/zinc/60/90/83/1095609083.db2.gz PKKZWMZMLFUZNC-FQEVSTJZSA-N 2 2 313.489 3.395 20 10 DGCDLP c1cc(N2CCCCC2)ccc1C[N@H+]1CC[C@]2(C1)CCCC[NH2+]2 ZINC001222427262 1095609085 /nfs/dbraw/zinc/60/90/85/1095609085.db2.gz PKKZWMZMLFUZNC-FQEVSTJZSA-N 2 2 313.489 3.395 20 10 DGCDLP c1cc(N2CCCC2)ccc1C[NH2+]C[C@@H]1CC[N@@H+]1C1CCCC1 ZINC001118805949 1096080880 /nfs/dbraw/zinc/08/08/80/1096080880.db2.gz MDVFDRMNHYTYRK-FQEVSTJZSA-N 2 2 313.489 3.393 20 10 DGCDLP c1cc(N2CCCC2)ccc1C[NH2+]C[C@@H]1CC[N@H+]1C1CCCC1 ZINC001118805949 1096080892 /nfs/dbraw/zinc/08/08/92/1096080892.db2.gz MDVFDRMNHYTYRK-FQEVSTJZSA-N 2 2 313.489 3.393 20 10 DGCDLP CC[N@H+](Cc1c(O)ccc(Cl)c1Cl)C1CC[NH2+]CC1 ZINC001235764517 1099170619 /nfs/dbraw/zinc/17/06/19/1099170619.db2.gz HYDMEXJMGKSTGJ-UHFFFAOYSA-N 2 2 303.233 3.273 20 10 DGCDLP CC[N@@H+](Cc1c(O)ccc(Cl)c1Cl)C1CC[NH2+]CC1 ZINC001235764517 1099170621 /nfs/dbraw/zinc/17/06/21/1099170621.db2.gz HYDMEXJMGKSTGJ-UHFFFAOYSA-N 2 2 303.233 3.273 20 10 DGCDLP CC(C)[N@H+](CC[NH3+])Cc1cc(OCc2ccccc2)ccc1O ZINC001235948472 1099281731 /nfs/dbraw/zinc/28/17/31/1099281731.db2.gz XVGAJTLKUSXNDP-UHFFFAOYSA-N 2 2 314.429 3.140 20 10 DGCDLP CC(C)[N@@H+](CC[NH3+])Cc1cc(OCc2ccccc2)ccc1O ZINC001235948472 1099281736 /nfs/dbraw/zinc/28/17/36/1099281736.db2.gz XVGAJTLKUSXNDP-UHFFFAOYSA-N 2 2 314.429 3.140 20 10 DGCDLP Cc1cc(C[N@H+]2C[C@H]3CC[C@@H](C2)[C@@H]3[NH3+])c(C)n1-c1ccccc1 ZINC001235959292 1099291167 /nfs/dbraw/zinc/29/11/67/1099291167.db2.gz MNSDREHKJKGSBC-XEMDLRDOSA-N 2 2 309.457 3.263 20 10 DGCDLP Cc1cc(C[N@@H+]2C[C@H]3CC[C@@H](C2)[C@@H]3[NH3+])c(C)n1-c1ccccc1 ZINC001235959292 1099291176 /nfs/dbraw/zinc/29/11/76/1099291176.db2.gz MNSDREHKJKGSBC-XEMDLRDOSA-N 2 2 309.457 3.263 20 10 DGCDLP CC[N@H+](Cc1ccc(N2CCCCC2)cc1)[C@H]1CCC[NH2+]C1 ZINC001236003950 1099325634 /nfs/dbraw/zinc/32/56/34/1099325634.db2.gz BXVSENIBZOUBSS-IBGZPJMESA-N 2 2 301.478 3.251 20 10 DGCDLP CC[N@@H+](Cc1ccc(N2CCCCC2)cc1)[C@H]1CCC[NH2+]C1 ZINC001236003950 1099325643 /nfs/dbraw/zinc/32/56/43/1099325643.db2.gz BXVSENIBZOUBSS-IBGZPJMESA-N 2 2 301.478 3.251 20 10 DGCDLP CC(C)(C)c1cccc(C[N@H+](C2CC2)[C@@H]2CCC[NH2+]C2)c1O ZINC001236239746 1099493531 /nfs/dbraw/zinc/49/35/31/1099493531.db2.gz LNMGTTYFOHVSDB-MRXNPFEDSA-N 2 2 302.462 3.406 20 10 DGCDLP CC(C)(C)c1cccc(C[N@@H+](C2CC2)[C@@H]2CCC[NH2+]C2)c1O ZINC001236239746 1099493538 /nfs/dbraw/zinc/49/35/38/1099493538.db2.gz LNMGTTYFOHVSDB-MRXNPFEDSA-N 2 2 302.462 3.406 20 10 DGCDLP CCC[N@H+](Cc1ccc2c(c1O)C=CC(C)(C)O2)[C@H]1CC[NH2+]C1 ZINC001236331081 1099542275 /nfs/dbraw/zinc/54/22/75/1099542275.db2.gz WHHMLAJMKBXKEE-HNNXBMFYSA-N 2 2 316.445 3.150 20 10 DGCDLP CCC[N@@H+](Cc1ccc2c(c1O)C=CC(C)(C)O2)[C@H]1CC[NH2+]C1 ZINC001236331081 1099542285 /nfs/dbraw/zinc/54/22/85/1099542285.db2.gz WHHMLAJMKBXKEE-HNNXBMFYSA-N 2 2 316.445 3.150 20 10 DGCDLP CC[N@@H+](Cc1cc(Cl)c(Cl)cc1O)C[C@H]1CC[NH2+]C1 ZINC001236410812 1099585303 /nfs/dbraw/zinc/58/53/03/1099585303.db2.gz KQXCVDILAKTPGK-JTQLQIEISA-N 2 2 303.233 3.130 20 10 DGCDLP CC[N@H+](Cc1cc(Cl)c(Cl)cc1O)C[C@H]1CC[NH2+]C1 ZINC001236410812 1099585309 /nfs/dbraw/zinc/58/53/09/1099585309.db2.gz KQXCVDILAKTPGK-JTQLQIEISA-N 2 2 303.233 3.130 20 10 DGCDLP CC(C)(C)C[N@H+](Cc1c(O)ccc(F)c1F)C1CC[NH2+]CC1 ZINC001236459448 1099622981 /nfs/dbraw/zinc/62/29/81/1099622981.db2.gz OVEOJDGGEGHRJY-UHFFFAOYSA-N 2 2 312.404 3.271 20 10 DGCDLP CC(C)(C)C[N@@H+](Cc1c(O)ccc(F)c1F)C1CC[NH2+]CC1 ZINC001236459448 1099622987 /nfs/dbraw/zinc/62/29/87/1099622987.db2.gz OVEOJDGGEGHRJY-UHFFFAOYSA-N 2 2 312.404 3.271 20 10 DGCDLP CC[N@H+](CCn1cc[nH+]c1)Cc1cc(C(F)(F)F)ccc1O ZINC001237142327 1099993461 /nfs/dbraw/zinc/99/34/61/1099993461.db2.gz HITSTUAEDKSQSV-UHFFFAOYSA-N 2 2 313.323 3.130 20 10 DGCDLP CC[N@@H+](CCn1cc[nH+]c1)Cc1cc(C(F)(F)F)ccc1O ZINC001237142327 1099993472 /nfs/dbraw/zinc/99/34/72/1099993472.db2.gz HITSTUAEDKSQSV-UHFFFAOYSA-N 2 2 313.323 3.130 20 10 DGCDLP Cc1cc(O)c(C[N@H+](C2CCC2)[C@@H]2CCC[NH2+]C2)cc1Cl ZINC001237157722 1100007615 /nfs/dbraw/zinc/00/76/15/1100007615.db2.gz VMUQVRDXXAMVBV-OAHLLOKOSA-N 2 2 308.853 3.461 20 10 DGCDLP Cc1cc(O)c(C[N@@H+](C2CCC2)[C@@H]2CCC[NH2+]C2)cc1Cl ZINC001237157722 1100007627 /nfs/dbraw/zinc/00/76/27/1100007627.db2.gz VMUQVRDXXAMVBV-OAHLLOKOSA-N 2 2 308.853 3.461 20 10 DGCDLP Oc1cc(Cl)c(F)cc1C[N@H+](C1CCC1)[C@H]1CCC[NH2+]C1 ZINC001237159286 1100007704 /nfs/dbraw/zinc/00/77/04/1100007704.db2.gz ABEYPOYPHWBHCN-ZDUSSCGKSA-N 2 2 312.816 3.291 20 10 DGCDLP Oc1cc(Cl)c(F)cc1C[N@@H+](C1CCC1)[C@H]1CCC[NH2+]C1 ZINC001237159286 1100007711 /nfs/dbraw/zinc/00/77/11/1100007711.db2.gz ABEYPOYPHWBHCN-ZDUSSCGKSA-N 2 2 312.816 3.291 20 10 DGCDLP Oc1c(F)cc(Cl)cc1C[NH2+]Cc1ccc2c[nH+]cn2c1 ZINC001202749007 1104204131 /nfs/dbraw/zinc/20/41/31/1104204131.db2.gz FXKXZRHTBHJVMR-UHFFFAOYSA-N 2 2 305.740 3.122 20 10 DGCDLP CC(C)C[N@H+](C)CCC[NH2+]Cc1cc(F)c(N(C)C)cc1F ZINC001308456728 1111430955 /nfs/dbraw/zinc/43/09/55/1111430955.db2.gz HUZIODHNMQOLGW-UHFFFAOYSA-N 2 2 313.436 3.098 20 10 DGCDLP CC(C)C[N@@H+](C)CCC[NH2+]Cc1cc(F)c(N(C)C)cc1F ZINC001308456728 1111430957 /nfs/dbraw/zinc/43/09/57/1111430957.db2.gz HUZIODHNMQOLGW-UHFFFAOYSA-N 2 2 313.436 3.098 20 10 DGCDLP Oc1cc(F)c(Cl)cc1C[NH2+]Cc1ccc2c[nH+]cn2c1 ZINC001308811089 1111478610 /nfs/dbraw/zinc/47/86/10/1111478610.db2.gz UMLJFVYUYUKTKO-UHFFFAOYSA-N 2 2 305.740 3.122 20 10 DGCDLP C[C@H]([NH2+]C1CC[NH+](C)CC1)c1cc(Cl)c(Cl)cc1O ZINC000192617626 299272312 /nfs/dbraw/zinc/27/23/12/299272312.db2.gz VMNIVDUKJBYNEO-VIFPVBQESA-N 2 2 303.233 3.444 20 10 DGCDLP C[C@@H]([NH2+][C@@H](C)CC[NH+](C)C)c1ccc(Br)cc1O ZINC000273560503 130136807 /nfs/dbraw/zinc/13/68/07/130136807.db2.gz IARBIMPISYMTLC-WDEREUQCSA-N 2 2 315.255 3.146 20 10 DGCDLP CC[NH+]1CCC([NH2+]Cc2cc(Cl)cc(Cl)c2O)CC1 ZINC000038097943 431855241 /nfs/dbraw/zinc/85/52/41/431855241.db2.gz WMIPSQCEOSGTLO-UHFFFAOYSA-N 2 2 303.233 3.273 20 10 DGCDLP CC(=O)c1cc(Cl)cc(C[N@H+]2CCC[C@H]([NH+](C)C)CC2)c1O ZINC000277315836 432837692 /nfs/dbraw/zinc/83/76/92/432837692.db2.gz UWOHZAQQGNGKRN-HNNXBMFYSA-N 2 2 324.852 3.164 20 10 DGCDLP CC(=O)c1cc(Cl)cc(C[N@@H+]2CCC[C@H]([NH+](C)C)CC2)c1O ZINC000277315836 432837694 /nfs/dbraw/zinc/83/76/94/432837694.db2.gz UWOHZAQQGNGKRN-HNNXBMFYSA-N 2 2 324.852 3.164 20 10 DGCDLP C[NH+]1CCC([N@H+](Cc2ccco2)Cc2ccccc2O)CC1 ZINC000290454609 433056685 /nfs/dbraw/zinc/05/66/85/433056685.db2.gz MPCLDDPMESXZDD-UHFFFAOYSA-N 2 2 300.402 3.082 20 10 DGCDLP C[NH+]1CCC([N@@H+](Cc2ccco2)Cc2ccccc2O)CC1 ZINC000290454609 433056694 /nfs/dbraw/zinc/05/66/94/433056694.db2.gz MPCLDDPMESXZDD-UHFFFAOYSA-N 2 2 300.402 3.082 20 10 DGCDLP CN(C)c1ccc(C[N@@H+]2CCC[C@H](c3[nH+]ccn3C)C2)cc1F ZINC000373227182 433133306 /nfs/dbraw/zinc/13/33/06/433133306.db2.gz JHVMTPZSOZXKED-HNNXBMFYSA-N 2 2 316.424 3.005 20 10 DGCDLP CN(C)c1ccc(C[N@H+]2CCC[C@H](c3[nH+]ccn3C)C2)cc1F ZINC000373227182 433133318 /nfs/dbraw/zinc/13/33/18/433133318.db2.gz JHVMTPZSOZXKED-HNNXBMFYSA-N 2 2 316.424 3.005 20 10 DGCDLP CC[C@@H]([NH2+]CCc1cn2c([nH+]1)CCCC2)c1ccc(F)cc1O ZINC000367613966 522843074 /nfs/dbraw/zinc/84/30/74/522843074.db2.gz GPNVTJOQPBAHPT-MRXNPFEDSA-N 2 2 317.408 3.348 20 10 DGCDLP Cn1c2ccccc2[nH+]c1CCC[NH2+]Cc1cc(F)ccc1O ZINC000180924046 527114021 /nfs/dbraw/zinc/11/40/21/527114021.db2.gz VPHDDHOQVPVRLN-UHFFFAOYSA-N 2 2 313.376 3.140 20 10 DGCDLP Oc1cccc2c1[C@H]([NH2+][C@@H]1C[NH2+]CC[C@@H]1c1ccccc1)CC2 ZINC000854221942 620785791 /nfs/dbraw/zinc/78/57/91/620785791.db2.gz CCWNHRSHSBVMRG-KZNAEPCWSA-N 2 2 308.425 3.115 20 10 DGCDLP COc1cccc(O)c1C[NH2+]C[C@H]([NH3+])c1ccc(C(C)C)cc1 ZINC000841037439 619207149 /nfs/dbraw/zinc/20/71/49/619207149.db2.gz QHMAFEVHMBVEES-KRWDZBQOSA-N 2 2 314.429 3.314 20 10 DGCDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+]Cc2ccc(C(F)F)cc2)cc1 ZINC000841040921 619242099 /nfs/dbraw/zinc/24/20/99/619242099.db2.gz CQBRJWMFUJOVFT-KRWDZBQOSA-N 2 2 319.399 3.480 20 10 DGCDLP Cc1ccccc1C[C@@H](C)[NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000841041752 619243032 /nfs/dbraw/zinc/24/30/32/619243032.db2.gz BHCCLTBHSFSHTQ-OXQOHEQNSA-N 2 2 311.473 3.282 20 10 DGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+]Cc2cc(F)cc(Cl)c2)cc1 ZINC000841045509 619247275 /nfs/dbraw/zinc/24/72/75/619247275.db2.gz LYWYLCMGYNMIPY-QGZVFWFLSA-N 2 2 321.827 3.335 20 10 DGCDLP C[C@@H]1C[C@@H]([NH2+][C@@H]2Cc3ccccc3[C@H]2[NH3+])c2c1c(F)ccc2O ZINC000902437011 619635855 /nfs/dbraw/zinc/63/58/55/619635855.db2.gz GHLKTPQPWANSFV-FFONGLNXSA-N 2 2 312.388 3.294 20 10 DGCDLP CCN(CC)c1ccc(C[NH2+]C[C@@H](C)Cn2cc[nH+]c2)cc1F ZINC000152116939 620492803 /nfs/dbraw/zinc/49/28/03/620492803.db2.gz HKBHINADQORKID-OAHLLOKOSA-N 2 2 318.440 3.294 20 10 DGCDLP COc1cccc([C@H](C)[NH2+]C[C@@H]2CC[N@@H+]2C2CCCC2)c1O ZINC000858531727 621202287 /nfs/dbraw/zinc/20/22/87/621202287.db2.gz JLUUDQDWUBRQFY-ZFWWWQNUSA-N 2 2 304.434 3.068 20 10 DGCDLP COc1cccc([C@H](C)[NH2+]C[C@@H]2CC[N@H+]2C2CCCC2)c1O ZINC000858531727 621202289 /nfs/dbraw/zinc/20/22/89/621202289.db2.gz JLUUDQDWUBRQFY-ZFWWWQNUSA-N 2 2 304.434 3.068 20 10 DGCDLP COc1cccc([C@@H](C)[NH2+]C[C@H]2CC[N@@H+]2C2CCCC2)c1O ZINC000858531724 621202383 /nfs/dbraw/zinc/20/23/83/621202383.db2.gz JLUUDQDWUBRQFY-UKRRQHHQSA-N 2 2 304.434 3.068 20 10 DGCDLP COc1cccc([C@@H](C)[NH2+]C[C@H]2CC[N@H+]2C2CCCC2)c1O ZINC000858531724 621202385 /nfs/dbraw/zinc/20/23/85/621202385.db2.gz JLUUDQDWUBRQFY-UKRRQHHQSA-N 2 2 304.434 3.068 20 10 DGCDLP C[C@H]1C[C@@H]([NH2+]CCCCn2cc[nH+]c2)c2c1c(F)ccc2O ZINC000756458238 621639541 /nfs/dbraw/zinc/63/95/41/621639541.db2.gz KQTADRPKFDZNAU-GXTWGEPZSA-N 2 2 303.381 3.346 20 10 DGCDLP CC[C@H]([NH2+]C[C@]1([NH+](C)C)CCSC1)c1ccc(N(C)C)cc1 ZINC000766440729 622330195 /nfs/dbraw/zinc/33/01/95/622330195.db2.gz YVBYIWHYBJKHKQ-ZWKOTPCHSA-N 2 2 321.534 3.231 20 10 DGCDLP C[C@@H]([NH2+]Cc1cccc2c1CC[NH2+]C2)c1cc(F)cc(F)c1O ZINC000873235886 623087017 /nfs/dbraw/zinc/08/70/17/623087017.db2.gz RVOABFKLECNQSU-LLVKDONJSA-N 2 2 318.367 3.167 20 10 DGCDLP CC[C@@H]([NH2+][C@H]1CCn2cc[nH+]c2C1)c1cc(Cl)ccc1O ZINC000779067354 623726357 /nfs/dbraw/zinc/72/63/57/623726357.db2.gz VZBNVDPYQWIEHB-GXTWGEPZSA-N 2 2 305.809 3.298 20 10 DGCDLP CC1CC[NH+](CCC[NH2+]Cc2c(O)ccc(Cl)c2F)CC1 ZINC000790946664 625720342 /nfs/dbraw/zinc/72/03/42/625720342.db2.gz FVFBOYRHTJPLCF-UHFFFAOYSA-N 2 2 314.832 3.396 20 10 DGCDLP CC[C@@H]([NH2+]C[C@H]1C[NH2+]CCC1(F)F)c1cccc(Cl)c1O ZINC000925779625 627793652 /nfs/dbraw/zinc/79/36/52/627793652.db2.gz YPOKQIRQSBSAOZ-ZWNOBZJWSA-N 2 2 318.795 3.331 20 10 DGCDLP CC1CCN(c2ccc(C[NH2+][C@H]3C[NH2+]CC[C@H]3C)cc2)CC1 ZINC000817902780 627956906 /nfs/dbraw/zinc/95/69/06/627956906.db2.gz YEEROIXBQJRKQY-APWZRJJASA-N 2 2 301.478 3.011 20 10 DGCDLP C[C@H]([NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1)c1ccc(F)c(F)c1 ZINC000817938167 627966790 /nfs/dbraw/zinc/96/67/90/627966790.db2.gz GABVGLMDLRQUFL-KPZWWZAWSA-N 2 2 319.399 3.381 20 10 DGCDLP CC[C@@H]([NH2+][C@H]1CCC[NH2+]C1)c1ccc(C(F)(F)F)cc1O ZINC000817941894 627968486 /nfs/dbraw/zinc/96/84/86/627968486.db2.gz SVYIAVYWXXFMHL-WCQYABFASA-N 2 2 302.340 3.204 20 10 DGCDLP C[C@@H]([NH2+]C[C@H]1CCC[NH2+]1)c1ccc(N2CCCCCC2)cc1 ZINC000817951230 627972150 /nfs/dbraw/zinc/97/21/50/627972150.db2.gz CBMNVYOILCSFQR-SJLPKXTDSA-N 2 2 301.478 3.470 20 10 DGCDLP C[C@@H]1C[C@@H]([NH2+]C[C@@H]([NH3+])c2ccccc2)c2c1c(F)ccc2O ZINC000817954047 627973144 /nfs/dbraw/zinc/97/31/44/627973144.db2.gz AQXNPEUONVZDKW-KCPJHIHWSA-N 2 2 300.377 3.369 20 10 DGCDLP CCC[NH2+]CC[NH2+][C@H](CC)c1cc(Br)ccc1O ZINC000817961883 627976832 /nfs/dbraw/zinc/97/68/32/627976832.db2.gz FTJDKOIXXBDMOJ-CYBMUJFWSA-N 2 2 315.255 3.195 20 10 DGCDLP C[C@@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)c1cc(F)cc(F)c1O ZINC000817967667 627977624 /nfs/dbraw/zinc/97/76/24/627977624.db2.gz AGXAPKNRHYPUNV-SNVBAGLBSA-N 2 2 304.340 3.124 20 10 DGCDLP C[C@@H]([NH2+][C@@H]1CC[NH2+][C@H](C)C1)c1cc(Cl)c(Cl)cc1O ZINC000817971805 627979647 /nfs/dbraw/zinc/97/96/47/627979647.db2.gz QDQJFYTXGFMRHY-OPRDCNLKSA-N 2 2 303.233 3.490 20 10 DGCDLP CC[NH2+][C@H](C)C[NH2+][C@H](C)c1cc(Br)cc(C)c1O ZINC000817973493 627979985 /nfs/dbraw/zinc/97/99/85/627979985.db2.gz UNXRLWGOTUYSHZ-GHMZBOCLSA-N 2 2 315.255 3.112 20 10 DGCDLP C[C@@H]([NH2+][C@@H]1CCCC[NH2+]C1)c1ccc(N2CCCCC2)cc1 ZINC000817983511 627983250 /nfs/dbraw/zinc/98/32/50/627983250.db2.gz FPJVKDWWVBFBLY-SJLPKXTDSA-N 2 2 301.478 3.470 20 10 DGCDLP CC[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1)c1cccc(Cl)c1O ZINC000817987345 627984381 /nfs/dbraw/zinc/98/43/81/627984381.db2.gz SUUWCANCBHPJEL-VLXAULBPSA-N 2 2 308.853 3.474 20 10 DGCDLP CCO[C@@H](C[NH2+][C@H](C)c1ccc2ccccc2c1O)C[NH+](C)C ZINC000926965055 627991009 /nfs/dbraw/zinc/99/10/09/627991009.db2.gz ZWEGWFBGTHJFBH-ZBFHGGJFSA-N 2 2 316.445 3.163 20 10 DGCDLP CC[C@@H](C[NH2+]C/C=C\c1ccc(N(C)C)cc1)[NH+]1CCCC1 ZINC000835035934 629830381 /nfs/dbraw/zinc/83/03/81/629830381.db2.gz LQGOQYRKMCJNLK-ZEVQVBBLSA-N 2 2 301.478 3.230 20 10 DGCDLP Cc1cc(O)c(C[NH2+]CCCNc2cccc[nH+]2)c(Cl)c1 ZINC000840904266 630375130 /nfs/dbraw/zinc/37/51/30/630375130.db2.gz ICMUJMZXHQFZLL-UHFFFAOYSA-N 2 2 305.809 3.341 20 10 DGCDLP Cc1cc(O)c(C[NH2+]C2CC([NH+]3CCCCC3)C2)c(Cl)c1 ZINC000840941528 630382043 /nfs/dbraw/zinc/38/20/43/630382043.db2.gz YUQPZUMWBHXSLM-UHFFFAOYSA-N 2 2 308.853 3.461 20 10 DGCDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+]Cc2ccc3ncccc3c2)cc1 ZINC000841040100 630400414 /nfs/dbraw/zinc/40/04/14/630400414.db2.gz IKKCVFXCIRDMSA-IBGZPJMESA-N 2 2 320.440 3.090 20 10 DGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+]Cc2cccc3cccnc32)cc1 ZINC000841041538 630400734 /nfs/dbraw/zinc/40/07/34/630400734.db2.gz DAMDGMGRGGMZCX-LJQANCHMSA-N 2 2 320.440 3.090 20 10 DGCDLP C[C@H](CCc1ccsc1)[NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000841046137 630401897 /nfs/dbraw/zinc/40/18/97/630401897.db2.gz WWMNZHAFQCMIFE-KDOFPFPSSA-N 2 2 317.502 3.425 20 10 DGCDLP Oc1ccc(Cl)c(F)c1C[N@@H+]1CCC[C@@H]([C@@H]2CCC[NH2+]2)C1 ZINC000843045346 630607659 /nfs/dbraw/zinc/60/76/59/630607659.db2.gz NUUXCWMCAZCCRE-RISCZKNCSA-N 2 2 312.816 3.149 20 10 DGCDLP Oc1ccc(Cl)c(F)c1C[N@H+]1CCC[C@@H]([C@@H]2CCC[NH2+]2)C1 ZINC000843045346 630607661 /nfs/dbraw/zinc/60/76/61/630607661.db2.gz NUUXCWMCAZCCRE-RISCZKNCSA-N 2 2 312.816 3.149 20 10 DGCDLP Cc1cc(Cl)cc(C[NH+]2CCC([NH2+]CC3CC3)CC2)c1O ZINC000843054286 630608959 /nfs/dbraw/zinc/60/89/59/630608959.db2.gz JBPHDGARTAZOBC-UHFFFAOYSA-N 2 2 308.853 3.318 20 10 DGCDLP Oc1c(Cl)cccc1C[N@@H+]1CCC[C@@H]([C@H]2CCC[NH2+]C2)C1 ZINC000843126299 630616700 /nfs/dbraw/zinc/61/67/00/630616700.db2.gz ICKNULNJBMIEQK-UONOGXRCSA-N 2 2 308.853 3.257 20 10 DGCDLP Oc1c(Cl)cccc1C[N@H+]1CCC[C@@H]([C@H]2CCC[NH2+]C2)C1 ZINC000843126299 630616703 /nfs/dbraw/zinc/61/67/03/630616703.db2.gz ICKNULNJBMIEQK-UONOGXRCSA-N 2 2 308.853 3.257 20 10 DGCDLP COc1cccc([C@@H](C)[NH2+][C@@H](Cn2cc[nH+]c2)C(C)(C)C)c1O ZINC000846144937 631211825 /nfs/dbraw/zinc/21/18/25/631211825.db2.gz ODWLNABXYFYLIZ-CJNGLKHVSA-N 2 2 317.433 3.363 20 10 DGCDLP Oc1c(Cl)cccc1C[N@@H+]1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000849350533 631900356 /nfs/dbraw/zinc/90/03/56/631900356.db2.gz PHSNEZKGBNDTSC-CQSZACIVSA-N 2 2 308.853 3.257 20 10 DGCDLP Oc1c(Cl)cccc1C[N@H+]1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000849350533 631900358 /nfs/dbraw/zinc/90/03/58/631900358.db2.gz PHSNEZKGBNDTSC-CQSZACIVSA-N 2 2 308.853 3.257 20 10 DGCDLP CCC[N@H+](CCC[NH+](C)C)Cc1cc(F)c(N(C)C)cc1F ZINC001474503345 1183931977 /nfs/dbraw/zinc/93/19/77/1183931977.db2.gz KJDNTDPSUJFEJX-UHFFFAOYSA-N 2 2 313.436 3.195 20 10 DGCDLP CCC[N@@H+](CCC[NH+](C)C)Cc1cc(F)c(N(C)C)cc1F ZINC001474503345 1183931981 /nfs/dbraw/zinc/93/19/81/1183931981.db2.gz KJDNTDPSUJFEJX-UHFFFAOYSA-N 2 2 313.436 3.195 20 10 DGCDLP C[C@@H]1C[C@H](C)C[N@@H+](CCC[NH2+]Cc2cc(F)cc(F)c2O)C1 ZINC001660944789 1196544418 /nfs/dbraw/zinc/54/44/18/1196544418.db2.gz JDSQYVLLPBTTIV-BETUJISGSA-N 2 2 312.404 3.128 20 10 DGCDLP C[C@@H]1C[C@H](C)C[N@H+](CCC[NH2+]Cc2cc(F)cc(F)c2O)C1 ZINC001660944789 1196544419 /nfs/dbraw/zinc/54/44/19/1196544419.db2.gz JDSQYVLLPBTTIV-BETUJISGSA-N 2 2 312.404 3.128 20 10 DGCDLP CCOc1cccc(C[NH+]2CCC([NH+](CC)CC)CC2)c1O ZINC000121687332 1200226082 /nfs/dbraw/zinc/22/60/82/1200226082.db2.gz IEMCBBGWQVEWKG-UHFFFAOYSA-N 2 2 306.450 3.097 20 10 DGCDLP COc1ccc(C[N@H+](C2CCCC2)C2CC[NH+](C)CC2)c(O)c1 ZINC001203635025 1090770315 /nfs/dbraw/zinc/77/03/15/1090770315.db2.gz GOUGLVZPZZBNPM-UHFFFAOYSA-N 2 2 318.461 3.240 20 10 DGCDLP COc1ccc(C[N@@H+](C2CCCC2)C2CC[NH+](C)CC2)c(O)c1 ZINC001203635025 1090770318 /nfs/dbraw/zinc/77/03/18/1090770318.db2.gz GOUGLVZPZZBNPM-UHFFFAOYSA-N 2 2 318.461 3.240 20 10 DGCDLP C[N@@H+]1CCC[C@@H]2C[NH+](Cc3ccc(N4CCCCC4)cc3)C[C@@H]21 ZINC001138220675 1091119985 /nfs/dbraw/zinc/11/99/85/1091119985.db2.gz MAMSWYIXGVPVLI-QUCCMNQESA-N 2 2 313.489 3.203 20 10 DGCDLP C[N@H+]1CCC[C@@H]2C[NH+](Cc3ccc(N4CCCCC4)cc3)C[C@@H]21 ZINC001138220675 1091119988 /nfs/dbraw/zinc/11/99/88/1091119988.db2.gz MAMSWYIXGVPVLI-QUCCMNQESA-N 2 2 313.489 3.203 20 10 DGCDLP C[NH+]1CCC[C@@H]2C[N@H+](Cc3ccc(N4CCCCC4)cc3)C[C@@H]21 ZINC001138220675 1091119994 /nfs/dbraw/zinc/11/99/94/1091119994.db2.gz MAMSWYIXGVPVLI-QUCCMNQESA-N 2 2 313.489 3.203 20 10 DGCDLP C[NH+]1CCC[C@@H]2C[N@@H+](Cc3ccc(N4CCCCC4)cc3)C[C@@H]21 ZINC001138220675 1091119999 /nfs/dbraw/zinc/11/99/99/1091119999.db2.gz MAMSWYIXGVPVLI-QUCCMNQESA-N 2 2 313.489 3.203 20 10 DGCDLP C[C@@]1([NH3+])CCC[N@H+](Cc2cc(Cl)c(Cl)cc2O)CC1 ZINC001205287913 1091165436 /nfs/dbraw/zinc/16/54/36/1091165436.db2.gz DAEMFOWVXDYGLY-CQSZACIVSA-N 2 2 303.233 3.402 20 10 DGCDLP C[C@@]1([NH3+])CCC[N@@H+](Cc2cc(Cl)c(Cl)cc2O)CC1 ZINC001205287913 1091165446 /nfs/dbraw/zinc/16/54/46/1091165446.db2.gz DAEMFOWVXDYGLY-CQSZACIVSA-N 2 2 303.233 3.402 20 10 DGCDLP CCC[NH+]1C[C@H]2C[NH+](Cc3ccc(N(C)C)cc3Cl)C[C@@H]2C1 ZINC001140926542 1092066960 /nfs/dbraw/zinc/06/69/60/1092066960.db2.gz NHKQKNODJCUIKB-HOTGVXAUSA-N 2 2 321.896 3.180 20 10 DGCDLP CCC[NH+]1C[C@@H]2C[NH+](Cc3ccc(N(C)C)cc3Cl)C[C@H]2C1 ZINC001140926543 1092067068 /nfs/dbraw/zinc/06/70/68/1092067068.db2.gz NHKQKNODJCUIKB-HZPDHXFCSA-N 2 2 321.896 3.180 20 10 DGCDLP Cc1ccc(C)n1-c1ccc(C[N@@H+]2CCC[C@@]3(CC[NH2+]3)C2)cc1 ZINC001222282299 1095528605 /nfs/dbraw/zinc/52/86/05/1095528605.db2.gz ILXOTERHUJYJTJ-HXUWFJFHSA-N 2 2 309.457 3.422 20 10 DGCDLP Cc1ccc(C)n1-c1ccc(C[N@H+]2CCC[C@@]3(CC[NH2+]3)C2)cc1 ZINC001222282299 1095528618 /nfs/dbraw/zinc/52/86/18/1095528618.db2.gz ILXOTERHUJYJTJ-HXUWFJFHSA-N 2 2 309.457 3.422 20 10 DGCDLP CN(C)c1ccc(C[N@@H+]2CCC[C@]3(CC[NH2+]3)C2)c2ccccc21 ZINC001222282920 1095529248 /nfs/dbraw/zinc/52/92/48/1095529248.db2.gz QVBBWLVPBGCDKV-FQEVSTJZSA-N 2 2 309.457 3.234 20 10 DGCDLP CN(C)c1ccc(C[N@H+]2CCC[C@]3(CC[NH2+]3)C2)c2ccccc21 ZINC001222282920 1095529259 /nfs/dbraw/zinc/52/92/59/1095529259.db2.gz QVBBWLVPBGCDKV-FQEVSTJZSA-N 2 2 309.457 3.234 20 10 DGCDLP Oc1cc(C(F)(F)F)ccc1C[N@H+]1CCC[C@]2(CCC[NH2+]2)C1 ZINC001222355714 1095569900 /nfs/dbraw/zinc/56/99/00/1095569900.db2.gz UDLVMWFWAVQZBO-OAHLLOKOSA-N 2 2 314.351 3.129 20 10 DGCDLP CC(C)(C)c1ccc(C[N@@H+]2CCC[C@]3(CCC[NH2+]3)C2)c(O)c1 ZINC001222354821 1095570184 /nfs/dbraw/zinc/57/01/84/1095570184.db2.gz NWQITNUCCAJOHT-LJQANCHMSA-N 2 2 302.462 3.408 20 10 DGCDLP CC(C)(C)c1ccc(C[N@H+]2CCC[C@]3(CCC[NH2+]3)C2)c(O)c1 ZINC001222354821 1095570191 /nfs/dbraw/zinc/57/01/91/1095570191.db2.gz NWQITNUCCAJOHT-LJQANCHMSA-N 2 2 302.462 3.408 20 10 DGCDLP C[N@@H+]1CCC[C@@H]2C[NH+](Cc3cc(C(C)(C)C)ccc3O)C[C@@H]21 ZINC001233286814 1098276737 /nfs/dbraw/zinc/27/67/37/1098276737.db2.gz JQNRKSVYDMCPAE-PBHICJAKSA-N 2 2 302.462 3.216 20 10 DGCDLP C[N@H+]1CCC[C@@H]2C[NH+](Cc3cc(C(C)(C)C)ccc3O)C[C@@H]21 ZINC001233286814 1098276743 /nfs/dbraw/zinc/27/67/43/1098276743.db2.gz JQNRKSVYDMCPAE-PBHICJAKSA-N 2 2 302.462 3.216 20 10 DGCDLP C[NH+]1CCC[C@@H]2C[N@H+](Cc3cc(C(C)(C)C)ccc3O)C[C@@H]21 ZINC001233286814 1098276750 /nfs/dbraw/zinc/27/67/50/1098276750.db2.gz JQNRKSVYDMCPAE-PBHICJAKSA-N 2 2 302.462 3.216 20 10 DGCDLP C[NH+]1CCC[C@@H]2C[N@@H+](Cc3cc(C(C)(C)C)ccc3O)C[C@@H]21 ZINC001233286814 1098276758 /nfs/dbraw/zinc/27/67/58/1098276758.db2.gz JQNRKSVYDMCPAE-PBHICJAKSA-N 2 2 302.462 3.216 20 10 DGCDLP Oc1cc(C(F)(F)F)ccc1C[N@@H+]1CCCC[C@@]12CC[NH2+]C2 ZINC001235116239 1098815611 /nfs/dbraw/zinc/81/56/11/1098815611.db2.gz FJMGFBIHYHYSAV-HNNXBMFYSA-N 2 2 314.351 3.129 20 10 DGCDLP Oc1cc(C(F)(F)F)ccc1C[N@H+]1CCCC[C@@]12CC[NH2+]C2 ZINC001235116239 1098815627 /nfs/dbraw/zinc/81/56/27/1098815627.db2.gz FJMGFBIHYHYSAV-HNNXBMFYSA-N 2 2 314.351 3.129 20 10 DGCDLP Oc1c(Cl)cccc1C[NH+]1CCC([C@H]2CCCC[NH2+]2)CC1 ZINC001235243725 1098916854 /nfs/dbraw/zinc/91/68/54/1098916854.db2.gz XSPOMJSXUWUEGU-MRXNPFEDSA-N 2 2 308.853 3.400 20 10 DGCDLP Cc1cc(C[N@@H+]2CC[C@@H]3[NH2+]CC[C@@H]3C2)c(C)n1-c1ccccc1 ZINC001235265266 1098937051 /nfs/dbraw/zinc/93/70/51/1098937051.db2.gz CMCGAWOVMSRYKG-XLIONFOSSA-N 2 2 309.457 3.278 20 10 DGCDLP Cc1cc(C[N@H+]2CC[C@@H]3[NH2+]CC[C@@H]3C2)c(C)n1-c1ccccc1 ZINC001235265266 1098937057 /nfs/dbraw/zinc/93/70/57/1098937057.db2.gz CMCGAWOVMSRYKG-XLIONFOSSA-N 2 2 309.457 3.278 20 10 DGCDLP CC[NH+](CC)CC[C@H](C)[NH2+]Cc1cc(F)c(N(C)C)cc1F ZINC001179829189 1099224328 /nfs/dbraw/zinc/22/43/28/1099224328.db2.gz AFUQKHSMZVRSNT-ZDUSSCGKSA-N 2 2 313.436 3.241 20 10 DGCDLP CC[N@H+](Cc1ccc2c(c1O)C=CC(C)(C)O2)[C@@H]1CCC[NH2+]C1 ZINC001236007436 1099328727 /nfs/dbraw/zinc/32/87/27/1099328727.db2.gz BWYDUPCIWDHSIS-OAHLLOKOSA-N 2 2 316.445 3.150 20 10 DGCDLP CC[N@@H+](Cc1ccc2c(c1O)C=CC(C)(C)O2)[C@@H]1CCC[NH2+]C1 ZINC001236007436 1099328737 /nfs/dbraw/zinc/32/87/37/1099328737.db2.gz BWYDUPCIWDHSIS-OAHLLOKOSA-N 2 2 316.445 3.150 20 10 DGCDLP C[N@H+](Cc1ccc2c(c1O)C=CC(C)(C)O2)[C@]1(C)CCC[NH2+]C1 ZINC001236207621 1099464612 /nfs/dbraw/zinc/46/46/12/1099464612.db2.gz BZETXAIFHQNAFX-LJQANCHMSA-N 2 2 316.445 3.150 20 10 DGCDLP C[N@@H+](Cc1ccc2c(c1O)C=CC(C)(C)O2)[C@]1(C)CCC[NH2+]C1 ZINC001236207621 1099464624 /nfs/dbraw/zinc/46/46/24/1099464624.db2.gz BZETXAIFHQNAFX-LJQANCHMSA-N 2 2 316.445 3.150 20 10 DGCDLP Nc1ccc(C[N@H+](Cc2ccccc2F)C2CC[NH2+]CC2)cc1 ZINC001236368376 1099554986 /nfs/dbraw/zinc/55/49/86/1099554986.db2.gz BUIQPBWMZSJZNN-UHFFFAOYSA-N 2 2 313.420 3.162 20 10 DGCDLP Nc1ccc(C[N@@H+](Cc2ccccc2F)C2CC[NH2+]CC2)cc1 ZINC001236368376 1099554998 /nfs/dbraw/zinc/55/49/98/1099554998.db2.gz BUIQPBWMZSJZNN-UHFFFAOYSA-N 2 2 313.420 3.162 20 10 DGCDLP CCC[N@H+](CCC[NH+](C)C)Cc1cc(F)c(Cl)cc1O ZINC001237939380 1100299451 /nfs/dbraw/zinc/29/94/51/1100299451.db2.gz BNWITUCKVKBVCH-UHFFFAOYSA-N 2 2 302.821 3.348 20 10 DGCDLP CCC[N@@H+](CCC[NH+](C)C)Cc1cc(F)c(Cl)cc1O ZINC001237939380 1100299457 /nfs/dbraw/zinc/29/94/57/1100299457.db2.gz BNWITUCKVKBVCH-UHFFFAOYSA-N 2 2 302.821 3.348 20 10 DGCDLP Cc1cc(O)c(C[NH+]2CCC[C@@]3(CC[N@@H+](C)C3)C2)cc1Cl ZINC001276372209 1103689621 /nfs/dbraw/zinc/68/96/21/1103689621.db2.gz JOQUUYDTIPHBTD-KRWDZBQOSA-N 2 2 308.853 3.272 20 10 DGCDLP Cc1cc(O)c(C[NH+]2CCC[C@@]3(CC[N@H+](C)C3)C2)cc1Cl ZINC001276372209 1103689628 /nfs/dbraw/zinc/68/96/28/1103689628.db2.gz JOQUUYDTIPHBTD-KRWDZBQOSA-N 2 2 308.853 3.272 20 10 DGCDLP Cc1cc(O)c(C[N@H+]2CCC[C@@]3(CC[NH+](C)C3)C2)cc1Cl ZINC001276372209 1103689632 /nfs/dbraw/zinc/68/96/32/1103689632.db2.gz JOQUUYDTIPHBTD-KRWDZBQOSA-N 2 2 308.853 3.272 20 10 DGCDLP Cc1cc(O)c(C[N@@H+]2CCC[C@@]3(CC[NH+](C)C3)C2)cc1Cl ZINC001276372209 1103689640 /nfs/dbraw/zinc/68/96/40/1103689640.db2.gz JOQUUYDTIPHBTD-KRWDZBQOSA-N 2 2 308.853 3.272 20 10 DGCDLP CCc1cccc(C[N@@H+]2CCC[C@@H](Cc3[nH+]ccn3C)C2)c1O ZINC001261559658 1107465715 /nfs/dbraw/zinc/46/57/15/1107465715.db2.gz VFPFZZRWSXDZHQ-HNNXBMFYSA-N 2 2 313.445 3.143 20 10 DGCDLP CCc1cccc(C[N@H+]2CCC[C@@H](Cc3[nH+]ccn3C)C2)c1O ZINC001261559658 1107465719 /nfs/dbraw/zinc/46/57/19/1107465719.db2.gz VFPFZZRWSXDZHQ-HNNXBMFYSA-N 2 2 313.445 3.143 20 10 DGCDLP Oc1cc(F)c(F)cc1C[N@@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC001308609574 1111451329 /nfs/dbraw/zinc/45/13/29/1111451329.db2.gz CHPXNTRCGJFCGY-AWEZNQCLSA-N 2 2 310.388 3.121 20 10 DGCDLP Oc1cc(F)c(F)cc1C[N@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC001308609574 1111451330 /nfs/dbraw/zinc/45/13/30/1111451330.db2.gz CHPXNTRCGJFCGY-AWEZNQCLSA-N 2 2 310.388 3.121 20 10 DGCDLP Oc1c(Cl)cc(Cl)cc1C[NH2+]CCCn1cc[nH+]c1 ZINC000020506193 182226078 /nfs/dbraw/zinc/22/60/78/182226078.db2.gz DNZCAFXKCVGIMK-UHFFFAOYSA-N 2 2 300.189 3.075 20 10 DGCDLP CCN(CC)c1ccc(C[N@@H+]2CC[C@@H](C[NH+](C)C)C2)cc1F ZINC000125491039 431927596 /nfs/dbraw/zinc/92/75/96/431927596.db2.gz GSXKVPHYJCZQMM-INIZCTEOSA-N 2 2 307.457 3.055 20 10 DGCDLP CCN(CC)c1ccc(C[N@H+]2CC[C@@H](C[NH+](C)C)C2)cc1F ZINC000125491039 431927599 /nfs/dbraw/zinc/92/75/99/431927599.db2.gz GSXKVPHYJCZQMM-INIZCTEOSA-N 2 2 307.457 3.055 20 10 DGCDLP COc1cc(Cl)cc(C[NH+]2CCC([NH2+]C(C)C)CC2)c1O ZINC000184686494 432421147 /nfs/dbraw/zinc/42/11/47/432421147.db2.gz MQQCMJMMPGQBGL-UHFFFAOYSA-N 2 2 312.841 3.017 20 10 DGCDLP C[C@H](Cn1cc[nH+]c1)[NH2+][C@H](C)c1ccc(Br)cc1O ZINC000273301161 432580533 /nfs/dbraw/zinc/58/05/33/432580533.db2.gz BNHIOTSIZWRLKU-GHMZBOCLSA-N 2 2 324.222 3.091 20 10 DGCDLP Cc1[nH+]ccn1CCCC[NH2+][C@@H](C)c1ccc(F)c(F)c1O ZINC000187734340 333236958 /nfs/dbraw/zinc/23/69/58/333236958.db2.gz PLATVAWEZARABZ-NSHDSACASA-N 2 2 309.360 3.306 20 10 DGCDLP CC[N@@H+]1CC[C@H]([NH+](C)Cc2cc(F)cc(C(C)=O)c2O)C[C@H]1C ZINC000750827078 575754227 /nfs/dbraw/zinc/75/42/27/575754227.db2.gz VJTVNYCWBRCLNJ-WBMJQRKESA-N 2 2 322.424 3.039 20 10 DGCDLP CC[NH+]1CC[C@H]([N@@H+](C)Cc2cc(F)cc(C(C)=O)c2O)C[C@H]1C ZINC000750827078 575754232 /nfs/dbraw/zinc/75/42/32/575754232.db2.gz VJTVNYCWBRCLNJ-WBMJQRKESA-N 2 2 322.424 3.039 20 10 DGCDLP C[C@@H]([NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1)c1cc(F)cc(F)c1O ZINC000853242056 620681397 /nfs/dbraw/zinc/68/13/97/620681397.db2.gz ZUPRWVGLYZETHW-OCCSQVGLSA-N 2 2 324.415 3.443 20 10 DGCDLP C[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1)c1cc(F)cc(F)c1O ZINC000853242056 620681399 /nfs/dbraw/zinc/68/13/99/620681399.db2.gz ZUPRWVGLYZETHW-OCCSQVGLSA-N 2 2 324.415 3.443 20 10 DGCDLP C[C@H]([NH2+][C@@H]1C[NH2+]CC[C@@H]1c1cccc(F)c1)c1ccccc1O ZINC000854222312 620785513 /nfs/dbraw/zinc/78/55/13/620785513.db2.gz FBYSKQVRFVXICI-MORSLUCNSA-N 2 2 314.404 3.328 20 10 DGCDLP C[C@@H]([NH2+][C@@H]1C[NH2+]CC[C@@H]1c1cccc(F)c1)c1ccccc1O ZINC000854222310 620785527 /nfs/dbraw/zinc/78/55/27/620785527.db2.gz FBYSKQVRFVXICI-FSPWUOQZSA-N 2 2 314.404 3.328 20 10 DGCDLP C[C@H]([NH2+]CC1([NH3+])CCCC1)c1cccc(C(F)(F)F)c1O ZINC000854222664 620785830 /nfs/dbraw/zinc/78/58/30/620785830.db2.gz JRMGZJQRBDPZRN-JTQLQIEISA-N 2 2 302.340 3.333 20 10 DGCDLP C[C@@H]([NH2+]CC12CC(C1)C[NH2+]2)c1ccc(N2CCCCC2)c(F)c1 ZINC000854228495 620786709 /nfs/dbraw/zinc/78/67/09/620786709.db2.gz XIBQRINYXTYEBN-TZGCNFNXSA-N 2 2 317.452 3.219 20 10 DGCDLP C[C@H]([NH2+]CCC(C)(C)[NH3+])c1cc(Br)cc(F)c1O ZINC000925736774 618589920 /nfs/dbraw/zinc/58/99/20/618589920.db2.gz BZOUPTDBTDPWSF-QMMMGPOBSA-N 2 2 319.218 3.072 20 10 DGCDLP Cc1cc(O)c(C[N@@H+]2CC[C@@H](Oc3cc[nH+]cc3)C2)c(Cl)c1 ZINC000840940593 618613673 /nfs/dbraw/zinc/61/36/73/618613673.db2.gz HNXJQVJDRYXMLF-CQSZACIVSA-N 2 2 318.804 3.402 20 10 DGCDLP Cc1cc(O)c(C[N@H+]2CC[C@@H](Oc3cc[nH+]cc3)C2)c(Cl)c1 ZINC000840940593 618613675 /nfs/dbraw/zinc/61/36/75/618613675.db2.gz HNXJQVJDRYXMLF-CQSZACIVSA-N 2 2 318.804 3.402 20 10 DGCDLP CCOCc1cc(C[NH2+]C[C@H]([NH3+])c2ccccc2)ccc1OC ZINC000841035571 619173046 /nfs/dbraw/zinc/17/30/46/619173046.db2.gz IFRNCYPVVSBNGM-SFHVURJKSA-N 2 2 314.429 3.021 20 10 DGCDLP CCCC[C@@H](C[NH3+])[NH2+][C@H](C)c1ccc(Br)cc1O ZINC000817963203 620894747 /nfs/dbraw/zinc/89/47/47/620894747.db2.gz SFQIRPQCWJIUTB-PWSUYJOCSA-N 2 2 315.255 3.323 20 10 DGCDLP CN(C)c1cc(F)c(C[NH2+]C2CC[NH+](C3CCC3)CC2)cc1F ZINC000858118020 621154778 /nfs/dbraw/zinc/15/47/78/621154778.db2.gz KMNPWFJLIZIKRO-UHFFFAOYSA-N 2 2 323.431 3.137 20 10 DGCDLP C[C@@H]([NH2+]CCC[NH+]1CCC(C)CC1)c1cc(F)cc(F)c1O ZINC000756361243 621630923 /nfs/dbraw/zinc/63/09/23/621630923.db2.gz JQKHYCNQKJPNKE-CYBMUJFWSA-N 2 2 312.404 3.443 20 10 DGCDLP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@@H](C)c1cc(F)cc(F)c1O ZINC000756534209 621646109 /nfs/dbraw/zinc/64/61/09/621646109.db2.gz LFNQTEYWQHQTOV-MNOVXSKESA-N 2 2 309.360 3.162 20 10 DGCDLP C[C@@H]([NH2+][C@@H]1CC[NH2+][C@H]1C)c1ccc(N2CCCCCC2)cc1 ZINC000863547262 621682812 /nfs/dbraw/zinc/68/28/12/621682812.db2.gz RBEAXJRGHPDLOS-JTDSTZFVSA-N 2 2 301.478 3.468 20 10 DGCDLP [NH3+]C[C@@H]1C[N@H+](Cc2c(O)cccc2Cl)CC[C@@H]1C(F)(F)F ZINC000863646292 621693253 /nfs/dbraw/zinc/69/32/53/621693253.db2.gz ISGYFGSFMYOJON-KOLCDFICSA-N 2 2 322.758 3.005 20 10 DGCDLP [NH3+]C[C@@H]1C[N@@H+](Cc2c(O)cccc2Cl)CC[C@@H]1C(F)(F)F ZINC000863646292 621693255 /nfs/dbraw/zinc/69/32/55/621693255.db2.gz ISGYFGSFMYOJON-KOLCDFICSA-N 2 2 322.758 3.005 20 10 DGCDLP C[C@H]([NH2+]C[C@H]1CCCC[N@@H+]1C1CC1)c1ccc(N(C)C)cc1 ZINC000774378366 623138326 /nfs/dbraw/zinc/13/83/26/623138326.db2.gz LINGGLIVGLNXNT-HNAYVOBHSA-N 2 2 301.478 3.420 20 10 DGCDLP C[C@H]([NH2+]C[C@H]1CCCC[N@H+]1C1CC1)c1ccc(N(C)C)cc1 ZINC000774378366 623138329 /nfs/dbraw/zinc/13/83/29/623138329.db2.gz LINGGLIVGLNXNT-HNAYVOBHSA-N 2 2 301.478 3.420 20 10 DGCDLP Cc1cccc(O)c1C[NH+](C)CCC[N@@H+](C)Cc1ccco1 ZINC000877524073 623923124 /nfs/dbraw/zinc/92/31/24/623923124.db2.gz QHLZJMGJFUYYQV-UHFFFAOYSA-N 2 2 302.418 3.248 20 10 DGCDLP Cc1cccc(O)c1C[NH+](C)CCC[N@H+](C)Cc1ccco1 ZINC000877524073 623923128 /nfs/dbraw/zinc/92/31/28/623923128.db2.gz QHLZJMGJFUYYQV-UHFFFAOYSA-N 2 2 302.418 3.248 20 10 DGCDLP Cc1cccc(O)c1C[N@@H+](C)CCC[NH+](C)Cc1ccco1 ZINC000877524073 623923132 /nfs/dbraw/zinc/92/31/32/623923132.db2.gz QHLZJMGJFUYYQV-UHFFFAOYSA-N 2 2 302.418 3.248 20 10 DGCDLP Cc1cccc(O)c1C[N@H+](C)CCC[NH+](C)Cc1ccco1 ZINC000877524073 623923136 /nfs/dbraw/zinc/92/31/36/623923136.db2.gz QHLZJMGJFUYYQV-UHFFFAOYSA-N 2 2 302.418 3.248 20 10 DGCDLP C[C@@H](C[NH2+]Cc1c(O)ccc(Cl)c1F)C[NH+]1CCCCC1 ZINC000790947912 625721221 /nfs/dbraw/zinc/72/12/21/625721221.db2.gz CQIDJRUTHBELAK-LBPRGKRZSA-N 2 2 314.832 3.396 20 10 DGCDLP Oc1cccc(Cl)c1C[N@@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000131165724 625958605 /nfs/dbraw/zinc/95/86/05/625958605.db2.gz OCLUALDBOSNEFW-AWEZNQCLSA-N 2 2 308.853 3.353 20 10 DGCDLP Oc1cccc(Cl)c1C[N@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000131165724 625958607 /nfs/dbraw/zinc/95/86/07/625958607.db2.gz OCLUALDBOSNEFW-AWEZNQCLSA-N 2 2 308.853 3.353 20 10 DGCDLP CC[C@H]([NH2+]CCn1cc[nH+]c1)c1ccc(C(F)(F)F)cc1O ZINC000810207397 626988232 /nfs/dbraw/zinc/98/82/32/626988232.db2.gz HSTOAVSLWYBBMZ-ZDUSSCGKSA-N 2 2 313.323 3.348 20 10 DGCDLP CCN(CC)c1ccc(C[N@@H+]2CC[C@]3(CC[NH+](C)C3)C2)cc1F ZINC000814178139 627547394 /nfs/dbraw/zinc/54/73/94/627547394.db2.gz DFXSKQGDHWEHEQ-IBGZPJMESA-N 2 2 319.468 3.200 20 10 DGCDLP CCN(CC)c1ccc(C[N@H+]2CC[C@]3(CC[NH+](C)C3)C2)cc1F ZINC000814178139 627547395 /nfs/dbraw/zinc/54/73/95/627547395.db2.gz DFXSKQGDHWEHEQ-IBGZPJMESA-N 2 2 319.468 3.200 20 10 DGCDLP CCN(CC)c1ccc(C[NH+]2CC[C@]3(CC[N@H+](C)C3)C2)cc1F ZINC000814178139 627547396 /nfs/dbraw/zinc/54/73/96/627547396.db2.gz DFXSKQGDHWEHEQ-IBGZPJMESA-N 2 2 319.468 3.200 20 10 DGCDLP CCN(CC)c1ccc(C[NH+]2CC[C@]3(CC[N@@H+](C)C3)C2)cc1F ZINC000814178139 627547398 /nfs/dbraw/zinc/54/73/98/627547398.db2.gz DFXSKQGDHWEHEQ-IBGZPJMESA-N 2 2 319.468 3.200 20 10 DGCDLP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2cc(Cl)c(F)cc2O)C[C@@H]1C ZINC000816515146 627800300 /nfs/dbraw/zinc/80/03/00/627800300.db2.gz QTDQMNAASIYZEI-WCQYABFASA-N 2 2 314.832 3.489 20 10 DGCDLP CC[N@H+]1CC[C@@H]([NH+](C)Cc2cc(Cl)c(F)cc2O)C[C@@H]1C ZINC000816515146 627800301 /nfs/dbraw/zinc/80/03/01/627800301.db2.gz QTDQMNAASIYZEI-WCQYABFASA-N 2 2 314.832 3.489 20 10 DGCDLP CC[NH+]1CC[C@@H]([N@H+](C)Cc2cc(Cl)c(F)cc2O)C[C@@H]1C ZINC000816515146 627800302 /nfs/dbraw/zinc/80/03/02/627800302.db2.gz QTDQMNAASIYZEI-WCQYABFASA-N 2 2 314.832 3.489 20 10 DGCDLP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2cc(Cl)c(F)cc2O)C[C@@H]1C ZINC000816515146 627800303 /nfs/dbraw/zinc/80/03/03/627800303.db2.gz QTDQMNAASIYZEI-WCQYABFASA-N 2 2 314.832 3.489 20 10 DGCDLP CC[N@@H+]1CC[C@H]([NH+](C)Cc2cc(Cl)c(F)cc2O)[C@H](C)C1 ZINC000816514723 627800367 /nfs/dbraw/zinc/80/03/67/627800367.db2.gz FXVVOTZUBYVTHP-ABAIWWIYSA-N 2 2 314.832 3.347 20 10 DGCDLP CC[N@H+]1CC[C@H]([NH+](C)Cc2cc(Cl)c(F)cc2O)[C@H](C)C1 ZINC000816514723 627800370 /nfs/dbraw/zinc/80/03/70/627800370.db2.gz FXVVOTZUBYVTHP-ABAIWWIYSA-N 2 2 314.832 3.347 20 10 DGCDLP CC[NH+]1CC[C@H]([N@H+](C)Cc2cc(Cl)c(F)cc2O)[C@H](C)C1 ZINC000816514723 627800373 /nfs/dbraw/zinc/80/03/73/627800373.db2.gz FXVVOTZUBYVTHP-ABAIWWIYSA-N 2 2 314.832 3.347 20 10 DGCDLP CC[NH+]1CC[C@H]([N@@H+](C)Cc2cc(Cl)c(F)cc2O)[C@H](C)C1 ZINC000816514723 627800374 /nfs/dbraw/zinc/80/03/74/627800374.db2.gz FXVVOTZUBYVTHP-ABAIWWIYSA-N 2 2 314.832 3.347 20 10 DGCDLP C[C@@H]([NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1)c1cc(F)cc(F)c1 ZINC000817938565 627966891 /nfs/dbraw/zinc/96/68/91/627966891.db2.gz NGKWQHKPIXQQLN-KZULUSFZSA-N 2 2 319.399 3.381 20 10 DGCDLP Cc1ccc([C@@H](C)[NH2+]C[C@H]([NH3+])c2ccc(N(C)C)cc2)s1 ZINC000817939117 627967239 /nfs/dbraw/zinc/96/72/39/627967239.db2.gz ZEZGXRIWUUKZNH-CJNGLKHVSA-N 2 2 303.475 3.473 20 10 DGCDLP C[C@H]([NH2+][C@H]1CCC[NH2+]C1)c1ccc(N2CCCCCC2)cc1 ZINC000817940076 627967735 /nfs/dbraw/zinc/96/77/35/627967735.db2.gz DDSGCTXGUGVHHZ-WMZOPIPTSA-N 2 2 301.478 3.470 20 10 DGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+][C@@H]2CCCC23CCCC3)cc1 ZINC000817943310 627969411 /nfs/dbraw/zinc/96/94/11/627969411.db2.gz UGXQBZACARFFNA-QZTJIDSGSA-N 2 2 301.478 3.455 20 10 DGCDLP C[C@@H]1C[C@@H]([NH2+]C[C@H]([NH3+])c2ccccc2)c2c1c(F)ccc2O ZINC000817954045 627973073 /nfs/dbraw/zinc/97/30/73/627973073.db2.gz AQXNPEUONVZDKW-BYCMXARLSA-N 2 2 300.377 3.369 20 10 DGCDLP CC(C)C[C@H](C[NH3+])[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O ZINC000817959891 627975453 /nfs/dbraw/zinc/97/54/53/627975453.db2.gz WHVKONDROZCXQH-WDEREUQCSA-N 2 2 304.356 3.435 20 10 DGCDLP CCCC[C@@H](C[NH3+])[NH2+][C@@H](C)c1cc(Br)ccc1O ZINC000817961680 627975791 /nfs/dbraw/zinc/97/57/91/627975791.db2.gz CGVNXSPYRLWYEF-JQWIXIFHSA-N 2 2 315.255 3.323 20 10 DGCDLP COc1ccc(O)c([C@H](C)[NH2+]CC[NH2+]C2CCCCCC2)c1 ZINC000817961271 627975889 /nfs/dbraw/zinc/97/58/89/627975889.db2.gz ZWCQQYSAGRBVJM-AWEZNQCLSA-N 2 2 306.450 3.364 20 10 DGCDLP C[C@H]([NH2+][C@@H]1CCCC[C@H]1[NH3+])c1ccc(Br)cc1O ZINC000818616374 628043554 /nfs/dbraw/zinc/04/35/54/628043554.db2.gz VOMAPTCWEKMQDU-ZWKOPEQDSA-N 2 2 313.239 3.075 20 10 DGCDLP Cc1cc(O)c(C[N@@H+]2CCC[C@H](c3[nH]cc[nH+]3)C2)c(Cl)c1 ZINC000840911137 630376778 /nfs/dbraw/zinc/37/67/78/630376778.db2.gz QQTLBSURCCPKNF-LBPRGKRZSA-N 2 2 305.809 3.457 20 10 DGCDLP Cc1cc(O)c(C[N@H+]2CCC[C@H](c3[nH]cc[nH+]3)C2)c(Cl)c1 ZINC000840911137 630376780 /nfs/dbraw/zinc/37/67/80/630376780.db2.gz QQTLBSURCCPKNF-LBPRGKRZSA-N 2 2 305.809 3.457 20 10 DGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+]Cc2ccc(Cl)cc2)cc1 ZINC000841041443 630400774 /nfs/dbraw/zinc/40/07/74/630400774.db2.gz CGDVKHRNEWEMKN-QGZVFWFLSA-N 2 2 303.837 3.196 20 10 DGCDLP C[C@@H](CCC(F)(F)F)[NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000841044981 630401134 /nfs/dbraw/zinc/40/11/34/630401134.db2.gz HEKMDTAZKHJNJD-FZMZJTMJSA-N 2 2 303.372 3.073 20 10 DGCDLP Oc1c(F)cc(Cl)cc1C[N@@H+]1CCCC[C@H]1[C@H]1CC[NH2+]C1 ZINC000841087480 630406121 /nfs/dbraw/zinc/40/61/21/630406121.db2.gz OGGTZBSZPCRDKU-NHYWBVRUSA-N 2 2 312.816 3.149 20 10 DGCDLP Oc1c(F)cc(Cl)cc1C[N@H+]1CCCC[C@H]1[C@H]1CC[NH2+]C1 ZINC000841087480 630406122 /nfs/dbraw/zinc/40/61/22/630406122.db2.gz OGGTZBSZPCRDKU-NHYWBVRUSA-N 2 2 312.816 3.149 20 10 DGCDLP [NH3+]C[C@H]1CC[C@H](C[NH2+]Cc2cc(Cl)cc(F)c2O)CC1 ZINC000841084203 630406129 /nfs/dbraw/zinc/40/61/29/630406129.db2.gz XMQNOCRFRPJGTQ-XYPYZODXSA-N 2 2 300.805 3.039 20 10 DGCDLP Oc1c(F)cc(Cl)cc1C[NH+]1CCC([C@@H]2CC[NH2+]C2)CC1 ZINC000843125880 630616629 /nfs/dbraw/zinc/61/66/29/630616629.db2.gz BLHOIQUPNAPKOO-GFCCVEGCSA-N 2 2 312.816 3.006 20 10 DGCDLP C[C@H]1CCC[N@H+](Cc2c(O)ccc(Cl)c2F)[C@H]1CC[NH3+] ZINC000844900684 630970284 /nfs/dbraw/zinc/97/02/84/630970284.db2.gz CQEYFWAGPMEDNQ-GWCFXTLKSA-N 2 2 300.805 3.134 20 10 DGCDLP CCc1cccc(C[NH2+][C@H](Cn2cc[nH+]c2)C(C)(C)C)c1O ZINC000848895101 631776731 /nfs/dbraw/zinc/77/67/31/631776731.db2.gz QQXYBHPHSRJRLA-MRXNPFEDSA-N 2 2 301.434 3.356 20 10 DGCDLP COc1ccc(O)c([C@H](C)[NH2+][C@@H](Cn2cc[nH+]c2)C(C)(C)C)c1 ZINC000319981729 657304102 /nfs/dbraw/zinc/30/41/02/657304102.db2.gz JRGMCEMQTDUTHG-GUYCJALGSA-N 2 2 317.433 3.363 20 10 DGCDLP Oc1cc(F)c(F)cc1C[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC001657230454 1196120984 /nfs/dbraw/zinc/12/09/84/1196120984.db2.gz ZZDBQLOLUXCZOS-PXAZEXFGSA-N 2 2 322.399 3.119 20 10 DGCDLP Oc1cc(F)c(F)cc1C[N@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC001657230454 1196120987 /nfs/dbraw/zinc/12/09/87/1196120987.db2.gz ZZDBQLOLUXCZOS-PXAZEXFGSA-N 2 2 322.399 3.119 20 10 DGCDLP Oc1cc(F)c(F)cc1C[NH+]1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC001657230454 1196120988 /nfs/dbraw/zinc/12/09/88/1196120988.db2.gz ZZDBQLOLUXCZOS-PXAZEXFGSA-N 2 2 322.399 3.119 20 10 DGCDLP Oc1cc(F)c(F)cc1C[NH+]1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC001657230454 1196120991 /nfs/dbraw/zinc/12/09/91/1196120991.db2.gz ZZDBQLOLUXCZOS-PXAZEXFGSA-N 2 2 322.399 3.119 20 10 DGCDLP CC1(C)CC([NH3+])CC(C)(C)N1c1ccc(Cn2cc[nH+]c2)cc1 ZINC001167624860 1082619210 /nfs/dbraw/zinc/61/92/10/1082619210.db2.gz HNMKCIPDGGXPAL-UHFFFAOYSA-N 2 2 312.461 3.416 20 10 DGCDLP CN(C)c1ccc(C[N@H+]2C[C@H]3[C@H](C2)CCC[NH+]3C)c2ccccc21 ZINC001204240392 1090932953 /nfs/dbraw/zinc/93/29/53/1090932953.db2.gz QXKGVIARFUIZRR-UWJYYQICSA-N 2 2 323.484 3.432 20 10 DGCDLP CN(C)c1ccc(C[N@@H+]2C[C@H]3[C@H](C2)CCC[NH+]3C)c2ccccc21 ZINC001204240392 1090932959 /nfs/dbraw/zinc/93/29/59/1090932959.db2.gz QXKGVIARFUIZRR-UWJYYQICSA-N 2 2 323.484 3.432 20 10 DGCDLP CN(C)c1ccc(C[NH+]2C[C@H]3[C@H](C2)CCC[N@@H+]3C)c2ccccc21 ZINC001204240392 1090932962 /nfs/dbraw/zinc/93/29/62/1090932962.db2.gz QXKGVIARFUIZRR-UWJYYQICSA-N 2 2 323.484 3.432 20 10 DGCDLP CN(C)c1ccc(C[NH+]2C[C@H]3[C@H](C2)CCC[N@H+]3C)c2ccccc21 ZINC001204240392 1090932966 /nfs/dbraw/zinc/93/29/66/1090932966.db2.gz QXKGVIARFUIZRR-UWJYYQICSA-N 2 2 323.484 3.432 20 10 DGCDLP c1cn(C2CC[NH+](Cc3ccc(N4CCCC4)cc3)CC2)c[nH+]1 ZINC001204320750 1090948070 /nfs/dbraw/zinc/94/80/70/1090948070.db2.gz ACOYLCCXCJEXHP-UHFFFAOYSA-N 2 2 310.445 3.320 20 10 DGCDLP c1cc(N2CCCC2)ccc1C[NH+]1CCC([NH+]2CCCC2)CC1 ZINC001204319005 1090948357 /nfs/dbraw/zinc/94/83/57/1090948357.db2.gz CWOCDNLWSXKQDF-UHFFFAOYSA-N 2 2 313.489 3.347 20 10 DGCDLP CC[N@H+](Cc1ccc(N(C)C)cc1Cl)C1CC[NH+](C)CC1 ZINC001140923747 1092064354 /nfs/dbraw/zinc/06/43/54/1092064354.db2.gz HLABLPSSOCTRGW-UHFFFAOYSA-N 2 2 309.885 3.322 20 10 DGCDLP CC[N@@H+](Cc1ccc(N(C)C)cc1Cl)C1CC[NH+](C)CC1 ZINC001140923747 1092064362 /nfs/dbraw/zinc/06/43/62/1092064362.db2.gz HLABLPSSOCTRGW-UHFFFAOYSA-N 2 2 309.885 3.322 20 10 DGCDLP C[N@@H+]1CCC[C@@H]2C[NH+](Cc3cccc(C(C)(C)C)c3O)C[C@@H]21 ZINC001143116415 1092617793 /nfs/dbraw/zinc/61/77/93/1092617793.db2.gz ANFDCINLQIZNDO-PBHICJAKSA-N 2 2 302.462 3.216 20 10 DGCDLP C[N@H+]1CCC[C@@H]2C[NH+](Cc3cccc(C(C)(C)C)c3O)C[C@@H]21 ZINC001143116415 1092617796 /nfs/dbraw/zinc/61/77/96/1092617796.db2.gz ANFDCINLQIZNDO-PBHICJAKSA-N 2 2 302.462 3.216 20 10 DGCDLP C[NH+]1CCC[C@@H]2C[N@H+](Cc3cccc(C(C)(C)C)c3O)C[C@@H]21 ZINC001143116415 1092617800 /nfs/dbraw/zinc/61/78/00/1092617800.db2.gz ANFDCINLQIZNDO-PBHICJAKSA-N 2 2 302.462 3.216 20 10 DGCDLP C[NH+]1CCC[C@@H]2C[N@@H+](Cc3cccc(C(C)(C)C)c3O)C[C@@H]21 ZINC001143116415 1092617806 /nfs/dbraw/zinc/61/78/06/1092617806.db2.gz ANFDCINLQIZNDO-PBHICJAKSA-N 2 2 302.462 3.216 20 10 DGCDLP CC(C)(C)c1ccc(O)c(C[N@@H+]2CCC[C@@]3(CCC[NH2+]3)C2)c1 ZINC001222355735 1095570650 /nfs/dbraw/zinc/57/06/50/1095570650.db2.gz UPRXZFYFQMNFEL-IBGZPJMESA-N 2 2 302.462 3.408 20 10 DGCDLP CC(C)(C)c1ccc(O)c(C[N@H+]2CCC[C@@]3(CCC[NH2+]3)C2)c1 ZINC001222355735 1095570657 /nfs/dbraw/zinc/57/06/57/1095570657.db2.gz UPRXZFYFQMNFEL-IBGZPJMESA-N 2 2 302.462 3.408 20 10 DGCDLP Oc1c(F)cc(Cl)cc1C[NH+]1CCC2(CCC[NH2+]C2)CC1 ZINC001222461004 1095624921 /nfs/dbraw/zinc/62/49/21/1095624921.db2.gz KJMXLYYWOKZZAI-UHFFFAOYSA-N 2 2 312.816 3.150 20 10 DGCDLP C[N@@H+](Cc1cccc(C(F)(F)F)c1O)CC1CC[NH+](C)CC1 ZINC001233417885 1098322741 /nfs/dbraw/zinc/32/27/41/1098322741.db2.gz LWYVCYJBIXTJFW-UHFFFAOYSA-N 2 2 316.367 3.185 20 10 DGCDLP C[N@H+](Cc1cccc(C(F)(F)F)c1O)CC1CC[NH+](C)CC1 ZINC001233417885 1098322748 /nfs/dbraw/zinc/32/27/48/1098322748.db2.gz LWYVCYJBIXTJFW-UHFFFAOYSA-N 2 2 316.367 3.185 20 10 DGCDLP CC[N@H+](Cc1ccc(C(F)(F)F)cc1O)C1CC[NH+](C)CC1 ZINC001233454080 1098341441 /nfs/dbraw/zinc/34/14/41/1098341441.db2.gz GGFFVNGTWSTUFN-UHFFFAOYSA-N 2 2 316.367 3.327 20 10 DGCDLP CC[N@@H+](Cc1ccc(C(F)(F)F)cc1O)C1CC[NH+](C)CC1 ZINC001233454080 1098341448 /nfs/dbraw/zinc/34/14/48/1098341448.db2.gz GGFFVNGTWSTUFN-UHFFFAOYSA-N 2 2 316.367 3.327 20 10 DGCDLP C[C@@]1(C[NH3+])CCC[N@H+](Cc2cc(F)cc(Cl)c2O)CC1 ZINC001206326939 1098805318 /nfs/dbraw/zinc/80/53/18/1098805318.db2.gz QWBMEHNLZDYSQO-OAHLLOKOSA-N 2 2 300.805 3.136 20 10 DGCDLP C[C@@]1(C[NH3+])CCC[N@@H+](Cc2cc(F)cc(Cl)c2O)CC1 ZINC001206326939 1098805333 /nfs/dbraw/zinc/80/53/33/1098805333.db2.gz QWBMEHNLZDYSQO-OAHLLOKOSA-N 2 2 300.805 3.136 20 10 DGCDLP CC(C)(C)c1cccc(C[N@@H+]2CCCC[C@@]23CC[NH2+]C3)c1O ZINC001235118677 1098819086 /nfs/dbraw/zinc/81/90/86/1098819086.db2.gz GWDXXRDZCCQWJR-IBGZPJMESA-N 2 2 302.462 3.408 20 10 DGCDLP CC(C)(C)c1cccc(C[N@H+]2CCCC[C@@]23CC[NH2+]C3)c1O ZINC001235118677 1098819100 /nfs/dbraw/zinc/81/91/00/1098819100.db2.gz GWDXXRDZCCQWJR-IBGZPJMESA-N 2 2 302.462 3.408 20 10 DGCDLP Cc1cc(C[N@@H+]2CC[C@H]3[NH2+]CC[C@@H]3C2)c(C)n1-c1ccccc1 ZINC001235265267 1098936941 /nfs/dbraw/zinc/93/69/41/1098936941.db2.gz CMCGAWOVMSRYKG-YLJYHZDGSA-N 2 2 309.457 3.278 20 10 DGCDLP Cc1cc(C[N@H+]2CC[C@H]3[NH2+]CC[C@@H]3C2)c(C)n1-c1ccccc1 ZINC001235265267 1098936944 /nfs/dbraw/zinc/93/69/44/1098936944.db2.gz CMCGAWOVMSRYKG-YLJYHZDGSA-N 2 2 309.457 3.278 20 10 DGCDLP [NH3+]C[C@@]1(F)CCCC[N@H+](Cc2ccc(C(F)(F)F)cc2O)C1 ZINC001206369420 1099020654 /nfs/dbraw/zinc/02/06/54/1099020654.db2.gz DRFIDIRUCRGMJO-AWEZNQCLSA-N 2 2 320.330 3.064 20 10 DGCDLP [NH3+]C[C@@]1(F)CCCC[N@@H+](Cc2ccc(C(F)(F)F)cc2O)C1 ZINC001206369420 1099020665 /nfs/dbraw/zinc/02/06/65/1099020665.db2.gz DRFIDIRUCRGMJO-AWEZNQCLSA-N 2 2 320.330 3.064 20 10 DGCDLP CC[N@H+](CCn1cc[nH+]c1)Cc1ccc(C(C)(C)C)cc1O ZINC001235681498 1099123846 /nfs/dbraw/zinc/12/38/46/1099123846.db2.gz MNURXOQZMRAHOV-UHFFFAOYSA-N 2 2 301.434 3.408 20 10 DGCDLP CC[N@@H+](CCn1cc[nH+]c1)Cc1ccc(C(C)(C)C)cc1O ZINC001235681498 1099123853 /nfs/dbraw/zinc/12/38/53/1099123853.db2.gz MNURXOQZMRAHOV-UHFFFAOYSA-N 2 2 301.434 3.408 20 10 DGCDLP CCC[N@H+](Cc1cc(F)c(Cl)cc1O)C1CC[NH2+]CC1 ZINC001236185166 1099455312 /nfs/dbraw/zinc/45/53/12/1099455312.db2.gz YUYGQHJKVRBELG-UHFFFAOYSA-N 2 2 300.805 3.149 20 10 DGCDLP CCC[N@@H+](Cc1cc(F)c(Cl)cc1O)C1CC[NH2+]CC1 ZINC001236185166 1099455317 /nfs/dbraw/zinc/45/53/17/1099455317.db2.gz YUYGQHJKVRBELG-UHFFFAOYSA-N 2 2 300.805 3.149 20 10 DGCDLP C[N@H+](Cc1cc(Cl)c(Cl)cc1O)[C@@H]1CCCC[C@@H]1[NH3+] ZINC001236215022 1099471794 /nfs/dbraw/zinc/47/17/94/1099471794.db2.gz GZMPWERFYQSJSR-QWHCGFSZSA-N 2 2 303.233 3.401 20 10 DGCDLP C[N@@H+](Cc1cc(Cl)c(Cl)cc1O)[C@@H]1CCCC[C@@H]1[NH3+] ZINC001236215022 1099471799 /nfs/dbraw/zinc/47/17/99/1099471799.db2.gz GZMPWERFYQSJSR-QWHCGFSZSA-N 2 2 303.233 3.401 20 10 DGCDLP CC(C)(C)c1ccc(C[N@H+](C2CC2)[C@@H]2CCC[NH2+]C2)c(O)c1 ZINC001236240518 1099495590 /nfs/dbraw/zinc/49/55/90/1099495590.db2.gz MQDRTMPREIKNOK-QGZVFWFLSA-N 2 2 302.462 3.406 20 10 DGCDLP CC(C)(C)c1ccc(C[N@@H+](C2CC2)[C@@H]2CCC[NH2+]C2)c(O)c1 ZINC001236240518 1099495596 /nfs/dbraw/zinc/49/55/96/1099495596.db2.gz MQDRTMPREIKNOK-QGZVFWFLSA-N 2 2 302.462 3.406 20 10 DGCDLP CC(C)(C)C[N@H+](Cc1cc(F)c(F)cc1O)C1CC[NH2+]CC1 ZINC001236457139 1099620569 /nfs/dbraw/zinc/62/05/69/1099620569.db2.gz JMHQKSDRMKTKLS-UHFFFAOYSA-N 2 2 312.404 3.271 20 10 DGCDLP CC(C)(C)C[N@@H+](Cc1cc(F)c(F)cc1O)C1CC[NH2+]CC1 ZINC001236457139 1099620573 /nfs/dbraw/zinc/62/05/73/1099620573.db2.gz JMHQKSDRMKTKLS-UHFFFAOYSA-N 2 2 312.404 3.271 20 10 DGCDLP CC[N@H+](CCC[NH+](C)C)Cc1cc(Cl)c(Cl)cc1O ZINC001236803880 1099797920 /nfs/dbraw/zinc/79/79/20/1099797920.db2.gz QBHIPVPBXWNGCJ-UHFFFAOYSA-N 2 2 305.249 3.473 20 10 DGCDLP CC[N@@H+](CCC[NH+](C)C)Cc1cc(Cl)c(Cl)cc1O ZINC001236803880 1099797930 /nfs/dbraw/zinc/79/79/30/1099797930.db2.gz QBHIPVPBXWNGCJ-UHFFFAOYSA-N 2 2 305.249 3.473 20 10 DGCDLP COCC[N@H+](Cc1ccc(C(C)C)cc1O)C1CC[NH+](C)CC1 ZINC001237053145 1099946667 /nfs/dbraw/zinc/94/66/67/1099946667.db2.gz HFMYNKVODGSIRT-UHFFFAOYSA-N 2 2 320.477 3.058 20 10 DGCDLP COCC[N@@H+](Cc1ccc(C(C)C)cc1O)C1CC[NH+](C)CC1 ZINC001237053145 1099946675 /nfs/dbraw/zinc/94/66/75/1099946675.db2.gz HFMYNKVODGSIRT-UHFFFAOYSA-N 2 2 320.477 3.058 20 10 DGCDLP C[C@]1(C[NH3+])CCCC[N@H+](Cc2cccc(C(F)(F)F)c2O)C1 ZINC001206563649 1103792394 /nfs/dbraw/zinc/79/23/94/1103792394.db2.gz GDBXJJXTLJXIMO-OAHLLOKOSA-N 2 2 316.367 3.362 20 10 DGCDLP C[C@]1(C[NH3+])CCCC[N@@H+](Cc2cccc(C(F)(F)F)c2O)C1 ZINC001206563649 1103792414 /nfs/dbraw/zinc/79/24/14/1103792414.db2.gz GDBXJJXTLJXIMO-OAHLLOKOSA-N 2 2 316.367 3.362 20 10 DGCDLP CC(C)[NH+]1CCC([NH2+]Cc2cc(Cl)cc(F)c2O)CC1 ZINC001308188731 1111393002 /nfs/dbraw/zinc/39/30/02/1111393002.db2.gz XFZUZQUUHCMAOJ-UHFFFAOYSA-N 2 2 300.805 3.147 20 10 DGCDLP Oc1cc(F)c(F)cc1C[N@@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC001308609605 1111450827 /nfs/dbraw/zinc/45/08/27/1111450827.db2.gz CHPXNTRCGJFCGY-CQSZACIVSA-N 2 2 310.388 3.121 20 10 DGCDLP Oc1cc(F)c(F)cc1C[N@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC001308609605 1111450831 /nfs/dbraw/zinc/45/08/31/1111450831.db2.gz CHPXNTRCGJFCGY-CQSZACIVSA-N 2 2 310.388 3.121 20 10 DGCDLP C[C@H](C[NH2+]Cc1ccc(N2CCCCC2)cc1)Cn1cc[nH+]c1 ZINC000062254702 432002742 /nfs/dbraw/zinc/00/27/42/432002742.db2.gz ZTTXHFFFSPYWHI-QGZVFWFLSA-N 2 2 312.461 3.299 20 10 DGCDLP C[N@@H+](Cc1cc(Cl)cc(Cl)c1O)CC1CC[NH+](C)CC1 ZINC000133998405 432072328 /nfs/dbraw/zinc/07/23/28/432072328.db2.gz MACQXXBIFOCHCW-UHFFFAOYSA-N 2 2 317.260 3.473 20 10 DGCDLP C[N@H+](Cc1cc(Cl)cc(Cl)c1O)CC1CC[NH+](C)CC1 ZINC000133998405 432072330 /nfs/dbraw/zinc/07/23/30/432072330.db2.gz MACQXXBIFOCHCW-UHFFFAOYSA-N 2 2 317.260 3.473 20 10 DGCDLP CCN(CC)c1ccc(C[N@@H+]2CC[C@H](C[NH+](C)C)C2)cc1F ZINC000125490816 431927729 /nfs/dbraw/zinc/92/77/29/431927729.db2.gz GSXKVPHYJCZQMM-MRXNPFEDSA-N 2 2 307.457 3.055 20 10 DGCDLP CCN(CC)c1ccc(C[N@H+]2CC[C@H](C[NH+](C)C)C2)cc1F ZINC000125490816 431927731 /nfs/dbraw/zinc/92/77/31/431927731.db2.gz GSXKVPHYJCZQMM-MRXNPFEDSA-N 2 2 307.457 3.055 20 10 DGCDLP C[C@@H]([NH2+]CCn1cc[nH+]c1)c1cc(Cl)c(Cl)cc1O ZINC000192604375 432392033 /nfs/dbraw/zinc/39/20/33/432392033.db2.gz BMGOPHQFFCUESA-SECBINFHSA-N 2 2 300.189 3.246 20 10 DGCDLP C[C@@H]([NH2+]C1CC[NH+](C2CCC2)CC1)c1ccc(F)c(F)c1O ZINC000276854492 432827027 /nfs/dbraw/zinc/82/70/27/432827027.db2.gz BKAFASQAGRGBFN-LLVKDONJSA-N 2 2 310.388 3.338 20 10 DGCDLP Cc1cccc(C[NH+](C)CCC[N@@H+](C)Cc2ccco2)c1O ZINC000289766720 432974843 /nfs/dbraw/zinc/97/48/43/432974843.db2.gz KGGGSKFRRSMGDY-UHFFFAOYSA-N 2 2 302.418 3.248 20 10 DGCDLP Cc1cccc(C[NH+](C)CCC[N@H+](C)Cc2ccco2)c1O ZINC000289766720 432974849 /nfs/dbraw/zinc/97/48/49/432974849.db2.gz KGGGSKFRRSMGDY-UHFFFAOYSA-N 2 2 302.418 3.248 20 10 DGCDLP Cc1cccc(C[N@@H+](C)CCC[NH+](C)Cc2ccco2)c1O ZINC000289766720 432974852 /nfs/dbraw/zinc/97/48/52/432974852.db2.gz KGGGSKFRRSMGDY-UHFFFAOYSA-N 2 2 302.418 3.248 20 10 DGCDLP Cc1cccc(C[N@H+](C)CCC[NH+](C)Cc2ccco2)c1O ZINC000289766720 432974857 /nfs/dbraw/zinc/97/48/57/432974857.db2.gz KGGGSKFRRSMGDY-UHFFFAOYSA-N 2 2 302.418 3.248 20 10 DGCDLP C[NH+]1CCC([C@@H]2CC[N@H+](Cc3cccc(Cl)c3O)C2)CC1 ZINC000290605304 433114712 /nfs/dbraw/zinc/11/47/12/433114712.db2.gz WGKMVTGBPCHZNX-CQSZACIVSA-N 2 2 308.853 3.209 20 10 DGCDLP C[NH+]1CCC([C@@H]2CC[N@@H+](Cc3cccc(Cl)c3O)C2)CC1 ZINC000290605304 433114718 /nfs/dbraw/zinc/11/47/18/433114718.db2.gz WGKMVTGBPCHZNX-CQSZACIVSA-N 2 2 308.853 3.209 20 10 DGCDLP CCC[N@@H+]1CC[C@H](C[NH2+]Cc2cc(Cl)c(F)cc2O)C1 ZINC000293506758 433763381 /nfs/dbraw/zinc/76/33/81/433763381.db2.gz AHEAZXFAQQILFP-LLVKDONJSA-N 2 2 300.805 3.006 20 10 DGCDLP CCC[N@H+]1CC[C@H](C[NH2+]Cc2cc(Cl)c(F)cc2O)C1 ZINC000293506758 433763391 /nfs/dbraw/zinc/76/33/91/433763391.db2.gz AHEAZXFAQQILFP-LLVKDONJSA-N 2 2 300.805 3.006 20 10 DGCDLP Oc1cc(F)c(Cl)cc1C[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000293818867 433878302 /nfs/dbraw/zinc/87/83/02/433878302.db2.gz DBWHXJDWDYXPEA-UHFFFAOYSA-N 2 2 312.816 3.149 20 10 DGCDLP Cc1cc(C[N@H+]2CC[C@@H](C)[C@H](n3cc[nH+]c3)C2)ccc1N(C)C ZINC000293815578 433881387 /nfs/dbraw/zinc/88/13/87/433881387.db2.gz ONVSRODZTSLWJH-DNVCBOLYSA-N 2 2 312.461 3.341 20 10 DGCDLP Cc1cc(C[N@@H+]2CC[C@@H](C)[C@H](n3cc[nH+]c3)C2)ccc1N(C)C ZINC000293815578 433881394 /nfs/dbraw/zinc/88/13/94/433881394.db2.gz ONVSRODZTSLWJH-DNVCBOLYSA-N 2 2 312.461 3.341 20 10 DGCDLP Cc1[nH+]ccn1CCCC[NH2+][C@H](C)c1ccc(F)c(F)c1O ZINC000187734355 333236901 /nfs/dbraw/zinc/23/69/01/333236901.db2.gz PLATVAWEZARABZ-LLVKDONJSA-N 2 2 309.360 3.306 20 10 DGCDLP Oc1c(Cl)cccc1C[NH+]1CCC([NH+]2CCCCC2)CC1 ZINC000158025489 526326135 /nfs/dbraw/zinc/32/61/35/526326135.db2.gz UPMQTVUQKKXRFZ-UHFFFAOYSA-N 2 2 308.853 3.496 20 10 DGCDLP CC[C@H]([NH2+][C@@H]1C[NH2+]C[C@H]1C)c1ccc(C(F)(F)F)cc1O ZINC000925784387 618619397 /nfs/dbraw/zinc/61/93/97/618619397.db2.gz NDNVRQLQWMHCIV-JIMOISOXSA-N 2 2 302.340 3.060 20 10 DGCDLP Cc1ccc(O)c([C@H](C)[NH2+][C@@H](CC[NH+](C)C)c2cccnc2)c1 ZINC000903378470 619768303 /nfs/dbraw/zinc/76/83/03/619768303.db2.gz CJPAQOLGAMFNJI-YJBOKZPZSA-N 2 2 313.445 3.439 20 10 DGCDLP CC(C)(C[NH3+])C1CC[NH+](Cc2cc(Cl)cc(F)c2O)CC1 ZINC000904445136 619923113 /nfs/dbraw/zinc/92/31/13/619923113.db2.gz WTXKGORRDSWTKL-UHFFFAOYSA-N 2 2 314.832 3.382 20 10 DGCDLP CCC[N@H+](C)C[C@@H]1CC[NH+](Cc2ccc(N(C)C)c(F)c2)C1 ZINC000769506119 622535523 /nfs/dbraw/zinc/53/55/23/622535523.db2.gz ATVQBAWNTNGSMX-INIZCTEOSA-N 2 2 307.457 3.055 20 10 DGCDLP CCC[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccc(N(C)C)c(F)c2)C1 ZINC000769506119 622535524 /nfs/dbraw/zinc/53/55/24/622535524.db2.gz ATVQBAWNTNGSMX-INIZCTEOSA-N 2 2 307.457 3.055 20 10 DGCDLP CCC[NH+](C)C[C@@H]1CC[N@H+](Cc2ccc(N(C)C)c(F)c2)C1 ZINC000769506119 622535526 /nfs/dbraw/zinc/53/55/26/622535526.db2.gz ATVQBAWNTNGSMX-INIZCTEOSA-N 2 2 307.457 3.055 20 10 DGCDLP CCC[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccc(N(C)C)c(F)c2)C1 ZINC000769506119 622535529 /nfs/dbraw/zinc/53/55/29/622535529.db2.gz ATVQBAWNTNGSMX-INIZCTEOSA-N 2 2 307.457 3.055 20 10 DGCDLP CN(C)c1ccc(C[N@@H+]2CC[C@@H](C[NH+](C)CC3CC3)C2)cc1F ZINC000769516959 622537523 /nfs/dbraw/zinc/53/75/23/622537523.db2.gz WOLMVMUJHLBELL-KRWDZBQOSA-N 2 2 319.468 3.055 20 10 DGCDLP CN(C)c1ccc(C[N@H+]2CC[C@@H](C[NH+](C)CC3CC3)C2)cc1F ZINC000769516959 622537524 /nfs/dbraw/zinc/53/75/24/622537524.db2.gz WOLMVMUJHLBELL-KRWDZBQOSA-N 2 2 319.468 3.055 20 10 DGCDLP CN(C)c1ccc(C[NH+]2CC[C@@H](C[N@H+](C)CC3CC3)C2)cc1F ZINC000769516959 622537527 /nfs/dbraw/zinc/53/75/27/622537527.db2.gz WOLMVMUJHLBELL-KRWDZBQOSA-N 2 2 319.468 3.055 20 10 DGCDLP CN(C)c1ccc(C[NH+]2CC[C@@H](C[N@@H+](C)CC3CC3)C2)cc1F ZINC000769516959 622537530 /nfs/dbraw/zinc/53/75/30/622537530.db2.gz WOLMVMUJHLBELL-KRWDZBQOSA-N 2 2 319.468 3.055 20 10 DGCDLP C[N@H+](CC1CC1)C[C@H]1CC[NH+](Cc2cccc(Cl)c2O)C1 ZINC000775725985 623319855 /nfs/dbraw/zinc/31/98/55/623319855.db2.gz NOGIVDPSFGBICA-CQSZACIVSA-N 2 2 308.853 3.209 20 10 DGCDLP C[N@@H+](CC1CC1)C[C@H]1CC[NH+](Cc2cccc(Cl)c2O)C1 ZINC000775725985 623319859 /nfs/dbraw/zinc/31/98/59/623319859.db2.gz NOGIVDPSFGBICA-CQSZACIVSA-N 2 2 308.853 3.209 20 10 DGCDLP C[NH+](CC1CC1)C[C@H]1CC[N@H+](Cc2cccc(Cl)c2O)C1 ZINC000775725985 623319864 /nfs/dbraw/zinc/31/98/64/623319864.db2.gz NOGIVDPSFGBICA-CQSZACIVSA-N 2 2 308.853 3.209 20 10 DGCDLP C[NH+](CC1CC1)C[C@H]1CC[N@@H+](Cc2cccc(Cl)c2O)C1 ZINC000775725985 623319867 /nfs/dbraw/zinc/31/98/67/623319867.db2.gz NOGIVDPSFGBICA-CQSZACIVSA-N 2 2 308.853 3.209 20 10 DGCDLP CC(C)[N@@H+]1CC[C@@H](C[NH2+]Cc2c(O)ccc(Cl)c2F)C1 ZINC000790963051 625724369 /nfs/dbraw/zinc/72/43/69/625724369.db2.gz XNGNJOVINQNZEL-NSHDSACASA-N 2 2 300.805 3.005 20 10 DGCDLP CC(C)[N@H+]1CC[C@@H](C[NH2+]Cc2c(O)ccc(Cl)c2F)C1 ZINC000790963051 625724377 /nfs/dbraw/zinc/72/43/77/625724377.db2.gz XNGNJOVINQNZEL-NSHDSACASA-N 2 2 300.805 3.005 20 10 DGCDLP CC[NH+](CC)CCC[C@@H](C)[NH2+]Cc1cc(F)cc(F)c1O ZINC000882877763 625840654 /nfs/dbraw/zinc/84/06/54/625840654.db2.gz DATZDHGCSFCAST-GFCCVEGCSA-N 2 2 300.393 3.271 20 10 DGCDLP Oc1ccc(F)cc1C[NH+]1CCC(CCCn2cc[nH+]c2)CC1 ZINC000809749336 626946581 /nfs/dbraw/zinc/94/65/81/626946581.db2.gz MRSFUDXGXWDODN-UHFFFAOYSA-N 2 2 317.408 3.420 20 10 DGCDLP C[C@@H]([NH2+][C@@H](C)CC[NH+](C)C)c1cccc(C(F)(F)F)c1O ZINC000815570992 627685408 /nfs/dbraw/zinc/68/54/08/627685408.db2.gz QSBNUAPMOIPHDY-WDEREUQCSA-N 2 2 304.356 3.402 20 10 DGCDLP C[C@@H](CC[NH+](C)C)[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O ZINC000815570991 627685643 /nfs/dbraw/zinc/68/56/43/627685643.db2.gz QSBNUAPMOIPHDY-QWRGUYRKSA-N 2 2 304.356 3.402 20 10 DGCDLP C[NH+](C)C1CCC([NH2+]Cc2cc(Cl)c(F)cc2O)CC1 ZINC000817414143 627896115 /nfs/dbraw/zinc/89/61/15/627896115.db2.gz SZSSDOPDEFJAHO-UHFFFAOYSA-N 2 2 300.805 3.147 20 10 DGCDLP C[C@H]([NH2+]Cc1ccc(N2CCC(C)CC2)cc1)[C@H]1CCC[NH2+]1 ZINC000817902526 627957423 /nfs/dbraw/zinc/95/74/23/627957423.db2.gz SKKMUDPIIZVUAM-QFBILLFUSA-N 2 2 301.478 3.153 20 10 DGCDLP Cc1ccc2c(c1)CC[C@@H]2[NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000817938556 627966277 /nfs/dbraw/zinc/96/62/77/627966277.db2.gz MZMAICANSUOCOG-PMACEKPBSA-N 2 2 309.457 3.338 20 10 DGCDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+][C@H]2CCCc3sccc32)cc1 ZINC000817938750 627967307 /nfs/dbraw/zinc/96/73/07/627967307.db2.gz RHCNELAYAHIGIU-IRXDYDNUSA-N 2 2 315.486 3.481 20 10 DGCDLP Cc1cc([C@@H](C)[NH2+]C[C@H]([NH3+])c2ccc(N(C)C)cc2)c(C)o1 ZINC000817939213 627967867 /nfs/dbraw/zinc/96/78/67/627967867.db2.gz AMMIEAOHFFGXKI-ACJLOTCBSA-N 2 2 301.434 3.313 20 10 DGCDLP C[C@@H]1Cc2ccccc2[C@@H]1[NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000817940726 627968513 /nfs/dbraw/zinc/96/85/13/627968513.db2.gz HMYZVRCSHRITFZ-JSNMRZPZSA-N 2 2 309.457 3.276 20 10 DGCDLP Cc1ccc(O)c([C@H](C)[NH2+]C[C@@H]([NH3+])c2ccc(N(C)C)cc2)c1 ZINC000817940784 627968714 /nfs/dbraw/zinc/96/87/14/627968714.db2.gz HSXVBHSSCKEOEE-KBXCAEBGSA-N 2 2 313.445 3.117 20 10 DGCDLP C[C@@H]([NH2+]CCC[NH2+]Cc1cccnc1)c1cc(Cl)ccc1O ZINC000817941310 627969064 /nfs/dbraw/zinc/96/90/64/627969064.db2.gz RZPURIDVKJTJFP-CYBMUJFWSA-N 2 2 319.836 3.271 20 10 DGCDLP CCO[C@H](C[NH2+][C@@H](C)c1ccc2ccccc2c1O)C[NH+](C)C ZINC000926965053 627990405 /nfs/dbraw/zinc/99/04/05/627990405.db2.gz ZWEGWFBGTHJFBH-GOEBONIOSA-N 2 2 316.445 3.163 20 10 DGCDLP CN(C)c1ccc(/C=C/C[NH2+]CCCNc2cccc[nH+]2)cc1 ZINC000835043743 629833718 /nfs/dbraw/zinc/83/37/18/629833718.db2.gz BUGOQBNGBAPLQR-FNORWQNLSA-N 2 2 310.445 3.253 20 10 DGCDLP Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@H]1C[N@@H+](C2CC2)C[C@@H]1C ZINC000840893872 630373965 /nfs/dbraw/zinc/37/39/65/630373965.db2.gz NNWVPLKOMUJRQN-FTRWYGJKSA-N 2 2 315.505 3.064 20 10 DGCDLP Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@H]1C[N@H+](C2CC2)C[C@@H]1C ZINC000840893872 630373967 /nfs/dbraw/zinc/37/39/67/630373967.db2.gz NNWVPLKOMUJRQN-FTRWYGJKSA-N 2 2 315.505 3.064 20 10 DGCDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+]Cc2ccc(Cl)c(F)c2)cc1 ZINC000841041165 630400635 /nfs/dbraw/zinc/40/06/35/630400635.db2.gz BCTXTWDRQNBJFZ-KRWDZBQOSA-N 2 2 321.827 3.335 20 10 DGCDLP C[C@H](Cc1ccccc1F)[NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000841044067 630401166 /nfs/dbraw/zinc/40/11/66/630401166.db2.gz USOXDEZPXIABLY-KUHUBIRLSA-N 2 2 315.436 3.112 20 10 DGCDLP C[C@H](CCC(F)(F)F)[NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000841044980 630401209 /nfs/dbraw/zinc/40/12/09/630401209.db2.gz HEKMDTAZKHJNJD-BXUZGUMPSA-N 2 2 303.372 3.073 20 10 DGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+]Cc2cccc3cnccc32)cc1 ZINC000841046098 630401788 /nfs/dbraw/zinc/40/17/88/630401788.db2.gz WBUCGOCXYRKEGI-HXUWFJFHSA-N 2 2 320.440 3.090 20 10 DGCDLP CC[C@H](Cc1ccccc1)[NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000841046148 630401830 /nfs/dbraw/zinc/40/18/30/630401830.db2.gz WZKXDEPBCVRUFZ-QUCCMNQESA-N 2 2 311.473 3.363 20 10 DGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+]Cc2cncc3ccccc32)cc1 ZINC000841045686 630401839 /nfs/dbraw/zinc/40/18/39/630401839.db2.gz OFXJBHXSPFSDDZ-HXUWFJFHSA-N 2 2 320.440 3.090 20 10 DGCDLP CC[C@@H](Cc1ccccc1)[NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000841046147 630401943 /nfs/dbraw/zinc/40/19/43/630401943.db2.gz WZKXDEPBCVRUFZ-ICSRJNTNSA-N 2 2 311.473 3.363 20 10 DGCDLP CC[NH2+][C@H](C)C[NH2+]Cc1ccc(OCc2ccccc2)cc1O ZINC000841065000 630403538 /nfs/dbraw/zinc/40/35/38/630403538.db2.gz FUAMKXCGTRBSNK-OAHLLOKOSA-N 2 2 314.429 3.059 20 10 DGCDLP CN(C)c1ccc(C[NH2+][C@@H]2CC[NH2+]C2(C)C)c(C(F)(F)F)c1 ZINC000841085424 630405980 /nfs/dbraw/zinc/40/59/80/630405980.db2.gz BXKDKZNWXLVABX-CQSZACIVSA-N 2 2 315.383 3.002 20 10 DGCDLP C[C@@H]([NH2+]CCc1cn2c([nH+]1)CCCC2)c1ccc(Cl)cc1O ZINC000841745659 630461662 /nfs/dbraw/zinc/46/16/62/630461662.db2.gz RYRHLDHVWAXEDB-GFCCVEGCSA-N 2 2 319.836 3.472 20 10 DGCDLP Oc1ccc(Cl)c(F)c1C[N@@H+]1CCC[C@H]([C@@H]2CCC[NH2+]2)C1 ZINC000843045345 630607449 /nfs/dbraw/zinc/60/74/49/630607449.db2.gz NUUXCWMCAZCCRE-FZMZJTMJSA-N 2 2 312.816 3.149 20 10 DGCDLP Oc1ccc(Cl)c(F)c1C[N@H+]1CCC[C@H]([C@@H]2CCC[NH2+]2)C1 ZINC000843045345 630607450 /nfs/dbraw/zinc/60/74/50/630607450.db2.gz NUUXCWMCAZCCRE-FZMZJTMJSA-N 2 2 312.816 3.149 20 10 DGCDLP CN(C)c1ccc(/C=C\C[N@@H+]2CCCC[C@@H]2[C@@H]2CCC[NH2+]2)cc1 ZINC000843048123 630608429 /nfs/dbraw/zinc/60/84/29/630608429.db2.gz OAFVERRODSYCKB-SLVIYJBESA-N 2 2 313.489 3.372 20 10 DGCDLP CN(C)c1ccc(/C=C\C[N@H+]2CCCC[C@@H]2[C@@H]2CCC[NH2+]2)cc1 ZINC000843048123 630608432 /nfs/dbraw/zinc/60/84/32/630608432.db2.gz OAFVERRODSYCKB-SLVIYJBESA-N 2 2 313.489 3.372 20 10 DGCDLP [NH3+]CCC[N@H+](Cc1ccccc1)Cc1cccc(Cl)c1O ZINC000843107220 630614584 /nfs/dbraw/zinc/61/45/84/630614584.db2.gz CLUGJUBDFNVPNB-UHFFFAOYSA-N 2 2 304.821 3.397 20 10 DGCDLP [NH3+]CCC[N@@H+](Cc1ccccc1)Cc1cccc(Cl)c1O ZINC000843107220 630614588 /nfs/dbraw/zinc/61/45/88/630614588.db2.gz CLUGJUBDFNVPNB-UHFFFAOYSA-N 2 2 304.821 3.397 20 10 DGCDLP CN(C)c1ccc(/C=C\C[NH2+][C@@H]2CCC[N@@H+]3CCCC[C@H]23)cc1 ZINC000848574128 631700413 /nfs/dbraw/zinc/70/04/13/631700413.db2.gz AAJHLSQTOZKVGQ-JZOYJOIISA-N 2 2 313.489 3.372 20 10 DGCDLP CN(C)c1ccc(/C=C\C[NH2+][C@@H]2CCC[N@H+]3CCCC[C@H]23)cc1 ZINC000848574128 631700416 /nfs/dbraw/zinc/70/04/16/631700416.db2.gz AAJHLSQTOZKVGQ-JZOYJOIISA-N 2 2 313.489 3.372 20 10 DGCDLP Oc1c(Cl)cccc1C[NH+]1CCC([C@H]2CCC[NH2+]C2)CC1 ZINC000849349518 631900520 /nfs/dbraw/zinc/90/05/20/631900520.db2.gz BXWCWOJCZJTBBL-AWEZNQCLSA-N 2 2 308.853 3.257 20 10 DGCDLP [NH3+]C[C@@]12C[N@H+](Cc3c(O)ccc(Cl)c3F)C[C@@H]1CCCC2 ZINC001580256858 1192016718 /nfs/dbraw/zinc/01/67/18/1192016718.db2.gz YNHAUXUQZFHCCC-ZBEGNZNMSA-N 2 2 312.816 3.136 20 10 DGCDLP [NH3+]C[C@@]12C[N@@H+](Cc3c(O)ccc(Cl)c3F)C[C@@H]1CCCC2 ZINC001580256858 1192016721 /nfs/dbraw/zinc/01/67/21/1192016721.db2.gz YNHAUXUQZFHCCC-ZBEGNZNMSA-N 2 2 312.816 3.136 20 10 DGCDLP [NH3+][C@@H]1c2ccccc2C[C@H]1[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001335289163 1178885194 /nfs/dbraw/zinc/88/51/94/1178885194.db2.gz KIZDPHZTQFYZIZ-WOJBJXKFSA-N 2 2 307.441 3.001 20 10 DGCDLP CC[NH+](CC)CC[C@@H](C)[NH2+]Cc1cc(Cl)c(F)cc1O ZINC001660261733 1196463879 /nfs/dbraw/zinc/46/38/79/1196463879.db2.gz HPWDKKAWZKDILO-LLVKDONJSA-N 2 2 302.821 3.395 20 10 DGCDLP C[C@H]1C[C@H](C)C[NH+](CCC[NH2+]Cc2cc(F)cc(F)c2O)C1 ZINC001660944792 1196544064 /nfs/dbraw/zinc/54/40/64/1196544064.db2.gz JDSQYVLLPBTTIV-STQMWFEESA-N 2 2 312.404 3.128 20 10 DGCDLP COc1ccc(C[N@H+](C)Cc2ccc(-n3cc[nH+]c3)cc2)c(O)c1 ZINC001203634582 1090770433 /nfs/dbraw/zinc/77/04/33/1090770433.db2.gz MSFOYTBUYBWTTN-UHFFFAOYSA-N 2 2 323.396 3.219 20 10 DGCDLP COc1ccc(C[N@@H+](C)Cc2ccc(-n3cc[nH+]c3)cc2)c(O)c1 ZINC001203634582 1090770437 /nfs/dbraw/zinc/77/04/37/1090770437.db2.gz MSFOYTBUYBWTTN-UHFFFAOYSA-N 2 2 323.396 3.219 20 10 DGCDLP CCN(CC)c1ccc(C[NH+]2CCC([NH+]3CCC3)CC2)cc1 ZINC001203943748 1090847391 /nfs/dbraw/zinc/84/73/91/1090847391.db2.gz GKISPJOMEUQEQU-UHFFFAOYSA-N 2 2 301.478 3.203 20 10 DGCDLP COc1ccc2ccc(O)c(C[N@@H+]3C[C@@H](C)CC[C@@H]3C[NH3+])c2c1 ZINC001205842022 1091375062 /nfs/dbraw/zinc/37/50/62/1091375062.db2.gz MCDSCPSZOVBWGZ-DZGCQCFKSA-N 2 2 314.429 3.113 20 10 DGCDLP COc1ccc2ccc(O)c(C[N@H+]3C[C@@H](C)CC[C@@H]3C[NH3+])c2c1 ZINC001205842022 1091375067 /nfs/dbraw/zinc/37/50/67/1091375067.db2.gz MCDSCPSZOVBWGZ-DZGCQCFKSA-N 2 2 314.429 3.113 20 10 DGCDLP Cc1cc(C[N@@H+](C(C)C)C2CC[NH+](C)CC2)ccc1N(C)C ZINC001139674202 1091639835 /nfs/dbraw/zinc/63/98/35/1091639835.db2.gz OZBLRNCDNYOUAY-UHFFFAOYSA-N 2 2 303.494 3.366 20 10 DGCDLP Cc1cc(C[N@H+](C(C)C)C2CC[NH+](C)CC2)ccc1N(C)C ZINC001139674202 1091639838 /nfs/dbraw/zinc/63/98/38/1091639838.db2.gz OZBLRNCDNYOUAY-UHFFFAOYSA-N 2 2 303.494 3.366 20 10 DGCDLP C[C@]1(C[NH3+])CCCC[N@H+](Cc2cc(Cl)cc(F)c2O)C1 ZINC001206574162 1091675131 /nfs/dbraw/zinc/67/51/31/1091675131.db2.gz PVAPMUZKPQTZOF-OAHLLOKOSA-N 2 2 300.805 3.136 20 10 DGCDLP C[C@]1(C[NH3+])CCCC[N@@H+](Cc2cc(Cl)cc(F)c2O)C1 ZINC001206574162 1091675134 /nfs/dbraw/zinc/67/51/34/1091675134.db2.gz PVAPMUZKPQTZOF-OAHLLOKOSA-N 2 2 300.805 3.136 20 10 DGCDLP COc1cc(O)c(C[N@@H+]2CCC[C@@]3(CCC[NH2+]C3)C2)cc1Cl ZINC001222270984 1095522418 /nfs/dbraw/zinc/52/24/18/1095522418.db2.gz BOZCRPGQAXXSTE-QGZVFWFLSA-N 2 2 324.852 3.020 20 10 DGCDLP COc1cc(O)c(C[N@H+]2CCC[C@@]3(CCC[NH2+]C3)C2)cc1Cl ZINC001222270984 1095522428 /nfs/dbraw/zinc/52/24/28/1095522428.db2.gz BOZCRPGQAXXSTE-QGZVFWFLSA-N 2 2 324.852 3.020 20 10 DGCDLP Oc1c(C[N@@H+]2CCC[C@@]3(CC[NH2+]3)C2)cccc1-c1ccccc1 ZINC001222287531 1095531223 /nfs/dbraw/zinc/53/12/23/1095531223.db2.gz LOYMAFGELTUPPM-HXUWFJFHSA-N 2 2 308.425 3.387 20 10 DGCDLP Oc1c(C[N@H+]2CCC[C@@]3(CC[NH2+]3)C2)cccc1-c1ccccc1 ZINC001222287531 1095531231 /nfs/dbraw/zinc/53/12/31/1095531231.db2.gz LOYMAFGELTUPPM-HXUWFJFHSA-N 2 2 308.425 3.387 20 10 DGCDLP Oc1c(F)cccc1C[N@@H+]1CCCC[C@@H]1CC[NH+]1CCCC1 ZINC001138127661 1095900141 /nfs/dbraw/zinc/90/01/41/1095900141.db2.gz KFFBTKCEFBOXDD-MRXNPFEDSA-N 2 2 306.425 3.372 20 10 DGCDLP Oc1c(F)cccc1C[N@H+]1CCCC[C@@H]1CC[NH+]1CCCC1 ZINC001138127661 1095900148 /nfs/dbraw/zinc/90/01/48/1095900148.db2.gz KFFBTKCEFBOXDD-MRXNPFEDSA-N 2 2 306.425 3.372 20 10 DGCDLP Oc1c(F)cccc1C[N@@H+]1CCCC[C@H]1CC[NH+]1CCCC1 ZINC001138127660 1095901651 /nfs/dbraw/zinc/90/16/51/1095901651.db2.gz KFFBTKCEFBOXDD-INIZCTEOSA-N 2 2 306.425 3.372 20 10 DGCDLP Oc1c(F)cccc1C[N@H+]1CCCC[C@H]1CC[NH+]1CCCC1 ZINC001138127660 1095901663 /nfs/dbraw/zinc/90/16/63/1095901663.db2.gz KFFBTKCEFBOXDD-INIZCTEOSA-N 2 2 306.425 3.372 20 10 DGCDLP Cc1c[nH+]ccc1N1CC[NH+](Cc2cccc(Cl)c2O)CC1 ZINC001231913858 1097892372 /nfs/dbraw/zinc/89/23/72/1097892372.db2.gz UDQNAXXSMKYTGN-UHFFFAOYSA-N 2 2 317.820 3.071 20 10 DGCDLP COc1ccc2ccc(O)c(C[N@H+](C)C3CC[NH+](C)CC3)c2c1 ZINC001234519163 1098576776 /nfs/dbraw/zinc/57/67/76/1098576776.db2.gz QYCJHNPVXKZQEI-UHFFFAOYSA-N 2 2 314.429 3.080 20 10 DGCDLP COc1ccc2ccc(O)c(C[N@@H+](C)C3CC[NH+](C)CC3)c2c1 ZINC001234519163 1098576785 /nfs/dbraw/zinc/57/67/85/1098576785.db2.gz QYCJHNPVXKZQEI-UHFFFAOYSA-N 2 2 314.429 3.080 20 10 DGCDLP Cc1ccc(C)n1-c1ccc(C[N@@H+]2CCC[C@@]23CC[NH2+]C3)cc1 ZINC001235111140 1098809722 /nfs/dbraw/zinc/80/97/22/1098809722.db2.gz PAOMQKVIXKWLDP-FQEVSTJZSA-N 2 2 309.457 3.422 20 10 DGCDLP Cc1ccc(C)n1-c1ccc(C[N@H+]2CCC[C@@]23CC[NH2+]C3)cc1 ZINC001235111140 1098809740 /nfs/dbraw/zinc/80/97/40/1098809740.db2.gz PAOMQKVIXKWLDP-FQEVSTJZSA-N 2 2 309.457 3.422 20 10 DGCDLP C[N@@H+]1CCC[C@@H]2C[NH+](Cc3ccc(C(C)(C)C)cc3O)C[C@H]21 ZINC001235678085 1099119339 /nfs/dbraw/zinc/11/93/39/1099119339.db2.gz ADYPRGVBONWUPI-RHSMWYFYSA-N 2 2 302.462 3.216 20 10 DGCDLP C[N@H+]1CCC[C@@H]2C[NH+](Cc3ccc(C(C)(C)C)cc3O)C[C@H]21 ZINC001235678085 1099119342 /nfs/dbraw/zinc/11/93/42/1099119342.db2.gz ADYPRGVBONWUPI-RHSMWYFYSA-N 2 2 302.462 3.216 20 10 DGCDLP CC[N@H+](CC[NH3+])Cc1c(O)ccc2cc(Br)ccc21 ZINC001236143023 1099427837 /nfs/dbraw/zinc/42/78/37/1099427837.db2.gz DFRDCJYXZDJAAX-UHFFFAOYSA-N 2 2 323.234 3.089 20 10 DGCDLP CC[N@@H+](CC[NH3+])Cc1c(O)ccc2cc(Br)ccc21 ZINC001236143023 1099427842 /nfs/dbraw/zinc/42/78/42/1099427842.db2.gz DFRDCJYXZDJAAX-UHFFFAOYSA-N 2 2 323.234 3.089 20 10 DGCDLP C[N@H+](Cc1ccc(N2CCCCC2)cc1)[C@@]1(C)CCC[NH2+]C1 ZINC001236207160 1099464440 /nfs/dbraw/zinc/46/44/40/1099464440.db2.gz MQQMQAPSDDQPPX-IBGZPJMESA-N 2 2 301.478 3.251 20 10 DGCDLP C[N@@H+](Cc1ccc(N2CCCCC2)cc1)[C@@]1(C)CCC[NH2+]C1 ZINC001236207160 1099464449 /nfs/dbraw/zinc/46/44/49/1099464449.db2.gz MQQMQAPSDDQPPX-IBGZPJMESA-N 2 2 301.478 3.251 20 10 DGCDLP CC[N@@H+](Cc1ccc(N(C)C)cc1)C[C@H]([NH3+])Cc1ccccc1 ZINC001236281025 1099517222 /nfs/dbraw/zinc/51/72/22/1099517222.db2.gz XVVOLNIWZHEJOT-LJQANCHMSA-N 2 2 311.473 3.145 20 10 DGCDLP CC[N@H+](Cc1ccc(N(C)C)cc1)C[C@H]([NH3+])Cc1ccccc1 ZINC001236281025 1099517234 /nfs/dbraw/zinc/51/72/34/1099517234.db2.gz XVVOLNIWZHEJOT-LJQANCHMSA-N 2 2 311.473 3.145 20 10 DGCDLP CC(C)[N@H+](Cc1ccc2c(c1O)C=CC(C)(C)O2)[C@H]1CC[NH2+]C1 ZINC001236527711 1099661949 /nfs/dbraw/zinc/66/19/49/1099661949.db2.gz AHTUSNDFVFQOJB-HNNXBMFYSA-N 2 2 316.445 3.149 20 10 DGCDLP CC(C)[N@@H+](Cc1ccc2c(c1O)C=CC(C)(C)O2)[C@H]1CC[NH2+]C1 ZINC001236527711 1099661958 /nfs/dbraw/zinc/66/19/58/1099661958.db2.gz AHTUSNDFVFQOJB-HNNXBMFYSA-N 2 2 316.445 3.149 20 10 DGCDLP CC[N@H+](Cc1cc(F)c(Cl)cc1O)C1CC[NH+](C)CC1 ZINC001237935166 1100297061 /nfs/dbraw/zinc/29/70/61/1100297061.db2.gz AOBQMLFJAKXYLK-UHFFFAOYSA-N 2 2 300.805 3.101 20 10 DGCDLP CC[N@@H+](Cc1cc(F)c(Cl)cc1O)C1CC[NH+](C)CC1 ZINC001237935166 1100297065 /nfs/dbraw/zinc/29/70/65/1100297065.db2.gz AOBQMLFJAKXYLK-UHFFFAOYSA-N 2 2 300.805 3.101 20 10 DGCDLP C[N@@H+]1CCC[C@]2(CCC[NH+](Cc3cc(Cl)ccc3O)C2)C1 ZINC001275275318 1104700943 /nfs/dbraw/zinc/70/09/43/1104700943.db2.gz GWFUYIXXHWVXSJ-KRWDZBQOSA-N 2 2 308.853 3.353 20 10 DGCDLP C[N@H+]1CCC[C@]2(CCC[NH+](Cc3cc(Cl)ccc3O)C2)C1 ZINC001275275318 1104700948 /nfs/dbraw/zinc/70/09/48/1104700948.db2.gz GWFUYIXXHWVXSJ-KRWDZBQOSA-N 2 2 308.853 3.353 20 10 DGCDLP C[NH+]1CCC[C@]2(CCC[N@H+](Cc3cc(Cl)ccc3O)C2)C1 ZINC001275275318 1104700954 /nfs/dbraw/zinc/70/09/54/1104700954.db2.gz GWFUYIXXHWVXSJ-KRWDZBQOSA-N 2 2 308.853 3.353 20 10 DGCDLP C[NH+]1CCC[C@]2(CCC[N@@H+](Cc3cc(Cl)ccc3O)C2)C1 ZINC001275275318 1104700962 /nfs/dbraw/zinc/70/09/62/1104700962.db2.gz GWFUYIXXHWVXSJ-KRWDZBQOSA-N 2 2 308.853 3.353 20 10 DGCDLP C[N@@H+]1CCC[C@H]([NH2+]Cc2cc(Cl)c3cccnc3c2O)CC1 ZINC001254504331 1106085110 /nfs/dbraw/zinc/08/51/10/1106085110.db2.gz UEAUJQWPLJAQFV-ZDUSSCGKSA-N 2 2 319.836 3.168 20 10 DGCDLP C[N@H+]1CCC[C@H]([NH2+]Cc2cc(Cl)c3cccnc3c2O)CC1 ZINC001254504331 1106085116 /nfs/dbraw/zinc/08/51/16/1106085116.db2.gz UEAUJQWPLJAQFV-ZDUSSCGKSA-N 2 2 319.836 3.168 20 10 DGCDLP Cc1[nH+]ccn1CC[NH2+][C@@H](C)c1ccc(Br)cc1O ZINC000273564543 130136759 /nfs/dbraw/zinc/13/67/59/130136759.db2.gz JBFATDUBZMAUSR-JTQLQIEISA-N 2 2 324.222 3.010 20 10 DGCDLP COc1cc(Cl)cc(C[NH+]2CCC(c3[nH]cc[nH+]3)CC2)c1O ZINC000273750087 130162425 /nfs/dbraw/zinc/16/24/25/130162425.db2.gz NGVXDQDOALNZFV-UHFFFAOYSA-N 2 2 321.808 3.157 20 10 DGCDLP Cn1cc[nH+]c1C[C@@H]1CCC[N@H+](Cc2cc(Cl)ccc2O)C1 ZINC000182090165 228367039 /nfs/dbraw/zinc/36/70/39/228367039.db2.gz KRFNRGDKDVQHRG-ZDUSSCGKSA-N 2 2 319.836 3.234 20 10 DGCDLP Cn1cc[nH+]c1C[C@@H]1CCC[N@@H+](Cc2cc(Cl)ccc2O)C1 ZINC000182090165 228367043 /nfs/dbraw/zinc/36/70/43/228367043.db2.gz KRFNRGDKDVQHRG-ZDUSSCGKSA-N 2 2 319.836 3.234 20 10 DGCDLP Cc1c2ccccc2n(C)c1C[NH2+]Cc1cccc2[nH+]ccn21 ZINC000355129217 229304455 /nfs/dbraw/zinc/30/44/55/229304455.db2.gz WHSYMFXPQYJOGJ-UHFFFAOYSA-N 2 2 304.397 3.424 20 10 DGCDLP CC[C@H]([NH2+]C[C@H]1CCc2[nH+]ccn2C1)c1ccc(F)cc1O ZINC000287675872 288049963 /nfs/dbraw/zinc/04/99/63/288049963.db2.gz VZPUOQPYEZOQOV-DOMZBBRYSA-N 2 2 303.381 3.031 20 10 DGCDLP COc1c(C)c[nH+]c(CN(C)Cc2cc(F)ccc2O)c1C ZINC000183782664 432325754 /nfs/dbraw/zinc/32/57/54/432325754.db2.gz HGSSZEDUEZYWHL-UHFFFAOYSA-N 2 2 304.365 3.184 20 10 DGCDLP Cc1cccc(C[NH+]2CCC(Oc3cc[nH+]cc3C)CC2)c1O ZINC000278656777 432898109 /nfs/dbraw/zinc/89/81/09/432898109.db2.gz JYXIASGZUMYMJB-UHFFFAOYSA-N 2 2 312.413 3.447 20 10 DGCDLP COc1ccc(O)c([C@H](C)[NH2+]CC[N@H+](C)Cc2ccccc2)c1 ZINC000185111434 534204650 /nfs/dbraw/zinc/20/46/50/534204650.db2.gz FVDSHGSTAWKKTH-HNNXBMFYSA-N 2 2 314.429 3.183 20 10 DGCDLP COc1ccc(O)c([C@H](C)[NH2+]CC[N@@H+](C)Cc2ccccc2)c1 ZINC000185111434 534204656 /nfs/dbraw/zinc/20/46/56/534204656.db2.gz FVDSHGSTAWKKTH-HNNXBMFYSA-N 2 2 314.429 3.183 20 10 DGCDLP Oc1c(Cl)cccc1C[N@@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000180470872 526327374 /nfs/dbraw/zinc/32/73/74/526327374.db2.gz SYASCRZHDNQBHB-CQSZACIVSA-N 2 2 308.853 3.353 20 10 DGCDLP Oc1c(Cl)cccc1C[N@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000180470872 526327380 /nfs/dbraw/zinc/32/73/80/526327380.db2.gz SYASCRZHDNQBHB-CQSZACIVSA-N 2 2 308.853 3.353 20 10 DGCDLP CC[N@H+](C)C[C@H]1CC[NH+](Cc2cc(Cl)cc(C(C)=O)c2O)C1 ZINC000177356078 527835394 /nfs/dbraw/zinc/83/53/94/527835394.db2.gz NSHRFKJBSAKXAX-CYBMUJFWSA-N 2 2 324.852 3.022 20 10 DGCDLP CC[N@@H+](C)C[C@H]1CC[NH+](Cc2cc(Cl)cc(C(C)=O)c2O)C1 ZINC000177356078 527835397 /nfs/dbraw/zinc/83/53/97/527835397.db2.gz NSHRFKJBSAKXAX-CYBMUJFWSA-N 2 2 324.852 3.022 20 10 DGCDLP CC[NH+](C)C[C@H]1CC[N@H+](Cc2cc(Cl)cc(C(C)=O)c2O)C1 ZINC000177356078 527835403 /nfs/dbraw/zinc/83/54/03/527835403.db2.gz NSHRFKJBSAKXAX-CYBMUJFWSA-N 2 2 324.852 3.022 20 10 DGCDLP CC[NH+](C)C[C@H]1CC[N@@H+](Cc2cc(Cl)cc(C(C)=O)c2O)C1 ZINC000177356078 527835409 /nfs/dbraw/zinc/83/54/09/527835409.db2.gz NSHRFKJBSAKXAX-CYBMUJFWSA-N 2 2 324.852 3.022 20 10 DGCDLP C[C@@H]1CC[N@H+](CC[NH2+]Cc2ccc(N3CCCCC3)cc2)C1 ZINC000744450030 575344047 /nfs/dbraw/zinc/34/40/47/575344047.db2.gz JJYSAMVIESMYDF-QGZVFWFLSA-N 2 2 301.478 3.108 20 10 DGCDLP C[C@@H]1CC[N@@H+](CC[NH2+]Cc2ccc(N3CCCCC3)cc2)C1 ZINC000744450030 575344048 /nfs/dbraw/zinc/34/40/48/575344048.db2.gz JJYSAMVIESMYDF-QGZVFWFLSA-N 2 2 301.478 3.108 20 10 DGCDLP CC[N@@H+]1CC[C@H]([NH+](C)Cc2cc(F)cc(C(C)=O)c2O)C[C@@H]1C ZINC000750827076 575754160 /nfs/dbraw/zinc/75/41/60/575754160.db2.gz VJTVNYCWBRCLNJ-LRDDRELGSA-N 2 2 322.424 3.039 20 10 DGCDLP CC[NH+]1CC[C@H]([N@@H+](C)Cc2cc(F)cc(C(C)=O)c2O)C[C@@H]1C ZINC000750827076 575754163 /nfs/dbraw/zinc/75/41/63/575754163.db2.gz VJTVNYCWBRCLNJ-LRDDRELGSA-N 2 2 322.424 3.039 20 10 DGCDLP Cc1cc(O)c(C[NH+]2CCC([NH2+]C3CCC3)CC2)cc1Cl ZINC000897982741 619202957 /nfs/dbraw/zinc/20/29/57/619202957.db2.gz QPNCYNZKGZQBBQ-UHFFFAOYSA-N 2 2 308.853 3.461 20 10 DGCDLP C[C@@H]1C[C@H]([NH2+][C@@H]2Cc3ccccc3[C@H]2[NH3+])c2c1c(F)ccc2O ZINC000902437013 619635845 /nfs/dbraw/zinc/63/58/45/619635845.db2.gz GHLKTPQPWANSFV-NYGAIPDWSA-N 2 2 312.388 3.294 20 10 DGCDLP C[N@@H+]1CCC[C@H](CC[NH2+]Cc2cc(Cl)cc(F)c2O)C1 ZINC000839180113 621343187 /nfs/dbraw/zinc/34/31/87/621343187.db2.gz CIRKRLQYXCJHKG-LLVKDONJSA-N 2 2 300.805 3.006 20 10 DGCDLP C[N@H+]1CCC[C@H](CC[NH2+]Cc2cc(Cl)cc(F)c2O)C1 ZINC000839180113 621343190 /nfs/dbraw/zinc/34/31/90/621343190.db2.gz CIRKRLQYXCJHKG-LLVKDONJSA-N 2 2 300.805 3.006 20 10 DGCDLP CN(C)c1cc(F)c(C[NH+]2CCC(c3[nH]cc[nH+]3)CC2)cc1F ZINC000862235367 621564884 /nfs/dbraw/zinc/56/48/84/621564884.db2.gz HJNTUTXKOCDGHM-UHFFFAOYSA-N 2 2 320.387 3.134 20 10 DGCDLP C[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2Cc2c(O)ccc(Cl)c2F)C1 ZINC000809767491 626948615 /nfs/dbraw/zinc/94/86/15/626948615.db2.gz MTDJHSJZKAGEMF-RISCZKNCSA-N 2 2 312.816 3.101 20 10 DGCDLP C[N@H+]1CC[C@H]2[C@H](CCC[NH+]2Cc2c(O)ccc(Cl)c2F)C1 ZINC000809767491 626948618 /nfs/dbraw/zinc/94/86/18/626948618.db2.gz MTDJHSJZKAGEMF-RISCZKNCSA-N 2 2 312.816 3.101 20 10 DGCDLP C[NH+]1CC[C@H]2[C@H](CCC[N@@H+]2Cc2c(O)ccc(Cl)c2F)C1 ZINC000809767491 626948622 /nfs/dbraw/zinc/94/86/22/626948622.db2.gz MTDJHSJZKAGEMF-RISCZKNCSA-N 2 2 312.816 3.101 20 10 DGCDLP C[NH+]1CC[C@H]2[C@H](CCC[N@H+]2Cc2c(O)ccc(Cl)c2F)C1 ZINC000809767491 626948625 /nfs/dbraw/zinc/94/86/25/626948625.db2.gz MTDJHSJZKAGEMF-RISCZKNCSA-N 2 2 312.816 3.101 20 10 DGCDLP Cc1cccc2c1CC[C@H]2[NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000817938383 627966435 /nfs/dbraw/zinc/96/64/35/627966435.db2.gz JQZDRKURRBBHRH-VQTJNVASSA-N 2 2 309.457 3.338 20 10 DGCDLP C[C@H]([NH2+][C@H]1CCC[NH2+]C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000817940100 627967213 /nfs/dbraw/zinc/96/72/13/627967213.db2.gz DWVDMLQDCUKJJZ-HOCLYGCPSA-N 2 2 305.441 3.219 20 10 DGCDLP C[C@H](Cc1cccs1)[NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000817939068 627967347 /nfs/dbraw/zinc/96/73/47/627967347.db2.gz YLZMUOQPXMPCND-CXAGYDPISA-N 2 2 303.475 3.035 20 10 DGCDLP Cc1cc([C@@H](C)[NH2+]C[C@@H]([NH3+])c2ccc(N(C)C)cc2)c(C)o1 ZINC000817939214 627967386 /nfs/dbraw/zinc/96/73/86/627967386.db2.gz AMMIEAOHFFGXKI-FZKQIMNGSA-N 2 2 301.434 3.313 20 10 DGCDLP C[C@@H]1Cc2ccccc2[C@H]1[NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000817940728 627968841 /nfs/dbraw/zinc/96/88/41/627968841.db2.gz HMYZVRCSHRITFZ-UAOJZALGSA-N 2 2 309.457 3.276 20 10 DGCDLP CC[C@H]([NH2+][C@@H]1C[NH2+]CC[C@H]1C)c1ccc(C(F)(F)F)cc1O ZINC000817969519 627978903 /nfs/dbraw/zinc/97/89/03/627978903.db2.gz VWDJPONNEHHOJN-DDTOSNHZSA-N 2 2 316.367 3.450 20 10 DGCDLP CC[C@H]([NH2+]C[C@@H]1C[C@H](F)C[NH2+]1)c1ccc(C(F)(F)F)cc1O ZINC000817976890 627981711 /nfs/dbraw/zinc/98/17/11/627981711.db2.gz WMFFOEIMFYCFQI-GVXVVHGQSA-N 2 2 320.330 3.152 20 10 DGCDLP C[C@@H](CCC[NH3+])[NH2+][C@@H](C)c1cc(Br)cc(F)c1O ZINC000817977956 627981716 /nfs/dbraw/zinc/98/17/16/627981716.db2.gz RZECQHZIVXWATG-IUCAKERBSA-N 2 2 319.218 3.072 20 10 DGCDLP C[C@H]([NH2+]CCC[NH2+]C1CC1)c1cccc(C(F)(F)F)c1O ZINC000817984114 627983074 /nfs/dbraw/zinc/98/30/74/627983074.db2.gz NIXBMAOBOHQDLB-JTQLQIEISA-N 2 2 302.340 3.204 20 10 DGCDLP CN(C)c1ccc(/C=C\C[NH+]2CCC(n3cc[nH+]c3)CC2)cc1 ZINC000835027313 629829044 /nfs/dbraw/zinc/82/90/44/629829044.db2.gz LIRIRFGWZOYKDB-ARJAWSKDSA-N 2 2 310.445 3.299 20 10 DGCDLP CCOc1ccc(C[NH2+]CC[NH2+]C2CCCCCC2)c(O)c1 ZINC000841027376 630398149 /nfs/dbraw/zinc/39/81/49/630398149.db2.gz AJKZNHYGCFEDGQ-UHFFFAOYSA-N 2 2 306.450 3.193 20 10 DGCDLP C[C@H](CCc1ccccc1)[NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000841044575 630401183 /nfs/dbraw/zinc/40/11/83/630401183.db2.gz DIJWMNZSZNUVFA-UZLBHIALSA-N 2 2 311.473 3.363 20 10 DGCDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+]C/C=C/c2ccc(F)cc2)cc1 ZINC000841046055 630401751 /nfs/dbraw/zinc/40/17/51/630401751.db2.gz VJYDAJFRUILBEW-RTLBZRNLSA-N 2 2 313.420 3.195 20 10 DGCDLP C[C@H](C[NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1)Cc1ccccc1 ZINC000841046058 630401776 /nfs/dbraw/zinc/40/17/76/630401776.db2.gz VKGYTXBKICKYAK-OXJNMPFZSA-N 2 2 311.473 3.221 20 10 DGCDLP Oc1ccc(Cl)c(F)c1C[N@@H+]1CCCC[C@H]1[C@@H]1CC[NH2+]C1 ZINC000841085715 630406032 /nfs/dbraw/zinc/40/60/32/630406032.db2.gz BJIFPAYFKQCFMY-RISCZKNCSA-N 2 2 312.816 3.149 20 10 DGCDLP Oc1ccc(Cl)c(F)c1C[N@H+]1CCCC[C@H]1[C@@H]1CC[NH2+]C1 ZINC000841085715 630406034 /nfs/dbraw/zinc/40/60/34/630406034.db2.gz BJIFPAYFKQCFMY-RISCZKNCSA-N 2 2 312.816 3.149 20 10 DGCDLP Oc1ccc(Cl)c(F)c1C[N@@H+]1CCC[C@H]([C@H]2CCC[NH2+]2)C1 ZINC000843045348 630607819 /nfs/dbraw/zinc/60/78/19/630607819.db2.gz NUUXCWMCAZCCRE-SMDDNHRTSA-N 2 2 312.816 3.149 20 10 DGCDLP Oc1ccc(Cl)c(F)c1C[N@H+]1CCC[C@H]([C@H]2CCC[NH2+]2)C1 ZINC000843045348 630607822 /nfs/dbraw/zinc/60/78/22/630607822.db2.gz NUUXCWMCAZCCRE-SMDDNHRTSA-N 2 2 312.816 3.149 20 10 DGCDLP [NH3+]Cc1ccc2c(c1)CCCN2Cc1cc(-n2cc[nH+]c2)cs1 ZINC000843058418 630610024 /nfs/dbraw/zinc/61/00/24/630610024.db2.gz SCGDKRSRFZUPGK-UHFFFAOYSA-N 2 2 324.453 3.345 20 10 DGCDLP CC(=O)c1cc(Cl)cc(C[N@@H+](C)CC[C@@H]([NH3+])C(C)C)c1O ZINC000843354402 630648673 /nfs/dbraw/zinc/64/86/73/630648673.db2.gz DUDUXYOKUIIOAE-OAHLLOKOSA-N 2 2 312.841 3.053 20 10 DGCDLP CC(=O)c1cc(Cl)cc(C[N@H+](C)CC[C@@H]([NH3+])C(C)C)c1O ZINC000843354402 630648676 /nfs/dbraw/zinc/64/86/76/630648676.db2.gz DUDUXYOKUIIOAE-OAHLLOKOSA-N 2 2 312.841 3.053 20 10 DGCDLP Cc1ccc(O)c2c1[C@@H](C)C[C@H]2[NH2+][C@@H]1Cc2ccccc2[C@H]1[NH3+] ZINC001336077228 1178990249 /nfs/dbraw/zinc/99/02/49/1178990249.db2.gz HZMQZVOXDMFSHC-SGJCYKPQSA-N 2 2 308.425 3.463 20 10 DGCDLP Oc1cc(F)c(F)cc1C[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC001657230455 1196120742 /nfs/dbraw/zinc/12/07/42/1196120742.db2.gz ZZDBQLOLUXCZOS-SJCJKPOMSA-N 2 2 322.399 3.119 20 10 DGCDLP Oc1cc(F)c(F)cc1C[N@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC001657230455 1196120743 /nfs/dbraw/zinc/12/07/43/1196120743.db2.gz ZZDBQLOLUXCZOS-SJCJKPOMSA-N 2 2 322.399 3.119 20 10 DGCDLP Oc1cc(F)c(F)cc1C[NH+]1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC001657230455 1196120745 /nfs/dbraw/zinc/12/07/45/1196120745.db2.gz ZZDBQLOLUXCZOS-SJCJKPOMSA-N 2 2 322.399 3.119 20 10 DGCDLP Oc1cc(F)c(F)cc1C[NH+]1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC001657230455 1196120747 /nfs/dbraw/zinc/12/07/47/1196120747.db2.gz ZZDBQLOLUXCZOS-SJCJKPOMSA-N 2 2 322.399 3.119 20 10 DGCDLP Oc1cc(Cl)ccc1C[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC001657228494 1196120897 /nfs/dbraw/zinc/12/08/97/1196120897.db2.gz AKKNGVHGXDRTMM-CXAGYDPISA-N 2 2 320.864 3.494 20 10 DGCDLP Oc1cc(Cl)ccc1C[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC001657228494 1196120900 /nfs/dbraw/zinc/12/09/00/1196120900.db2.gz AKKNGVHGXDRTMM-CXAGYDPISA-N 2 2 320.864 3.494 20 10 DGCDLP Oc1cc(Cl)ccc1C[NH+]1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC001657228494 1196120903 /nfs/dbraw/zinc/12/09/03/1196120903.db2.gz AKKNGVHGXDRTMM-CXAGYDPISA-N 2 2 320.864 3.494 20 10 DGCDLP Oc1cc(Cl)ccc1C[NH+]1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC001657228494 1196120909 /nfs/dbraw/zinc/12/09/09/1196120909.db2.gz AKKNGVHGXDRTMM-CXAGYDPISA-N 2 2 320.864 3.494 20 10 DGCDLP Oc1ccc(F)cc1C[NH2+][C@H](Cn1cc[nH+]c1)c1ccccc1 ZINC001660570911 1196498125 /nfs/dbraw/zinc/49/81/25/1196498125.db2.gz SITTUGYXQQKOFQ-QGZVFWFLSA-N 2 2 311.360 3.259 20 10 DGCDLP Oc1cc(Cl)c(Cl)cc1C[N@@H+]1CCCC12CC[NH2+]CC2 ZINC001235144603 1088227912 /nfs/dbraw/zinc/22/79/12/1088227912.db2.gz NANKCCYQGPZLSP-UHFFFAOYSA-N 2 2 315.244 3.417 20 10 DGCDLP Oc1cc(Cl)c(Cl)cc1C[N@H+]1CCCC12CC[NH2+]CC2 ZINC001235144603 1088227929 /nfs/dbraw/zinc/22/79/29/1088227929.db2.gz NANKCCYQGPZLSP-UHFFFAOYSA-N 2 2 315.244 3.417 20 10 DGCDLP COc1cccc(C[N@H+](C)Cc2ccc(-n3cc[nH+]c3)cc2)c1O ZINC001203600238 1090765459 /nfs/dbraw/zinc/76/54/59/1090765459.db2.gz YNOUDSLPVGUWGH-UHFFFAOYSA-N 2 2 323.396 3.219 20 10 DGCDLP COc1cccc(C[N@@H+](C)Cc2ccc(-n3cc[nH+]c3)cc2)c1O ZINC001203600238 1090765464 /nfs/dbraw/zinc/76/54/64/1090765464.db2.gz YNOUDSLPVGUWGH-UHFFFAOYSA-N 2 2 323.396 3.219 20 10 DGCDLP CCN(CC)c1ccc(C[N@H+](CC)C2CC[NH+](C)CC2)cc1 ZINC001203938741 1090843914 /nfs/dbraw/zinc/84/39/14/1090843914.db2.gz DAJQRFPONYZVLU-UHFFFAOYSA-N 2 2 303.494 3.449 20 10 DGCDLP CCN(CC)c1ccc(C[N@@H+](CC)C2CC[NH+](C)CC2)cc1 ZINC001203938741 1090843924 /nfs/dbraw/zinc/84/39/24/1090843924.db2.gz DAJQRFPONYZVLU-UHFFFAOYSA-N 2 2 303.494 3.449 20 10 DGCDLP CCN(CC)c1ccc(C[N@@H+]2C[C@@H]3CCC[NH+](C)[C@@H]3C2)cc1 ZINC001203946855 1090848040 /nfs/dbraw/zinc/84/80/40/1090848040.db2.gz YHACHVVVABBPJI-PKOBYXMFSA-N 2 2 301.478 3.059 20 10 DGCDLP CCN(CC)c1ccc(C[N@H+]2C[C@@H]3CCC[NH+](C)[C@@H]3C2)cc1 ZINC001203946855 1090848047 /nfs/dbraw/zinc/84/80/47/1090848047.db2.gz YHACHVVVABBPJI-PKOBYXMFSA-N 2 2 301.478 3.059 20 10 DGCDLP CCN(CC)c1ccc(C[NH+]2C[C@@H]3CCC[N@H+](C)[C@@H]3C2)cc1 ZINC001203946855 1090848053 /nfs/dbraw/zinc/84/80/53/1090848053.db2.gz YHACHVVVABBPJI-PKOBYXMFSA-N 2 2 301.478 3.059 20 10 DGCDLP CCN(CC)c1ccc(C[NH+]2C[C@@H]3CCC[N@@H+](C)[C@@H]3C2)cc1 ZINC001203946855 1090848060 /nfs/dbraw/zinc/84/80/60/1090848060.db2.gz YHACHVVVABBPJI-PKOBYXMFSA-N 2 2 301.478 3.059 20 10 DGCDLP C[C@]1([NH3+])CCC[N@H+](Cc2cc(Cl)c(Cl)cc2O)CC1 ZINC001205287912 1091165771 /nfs/dbraw/zinc/16/57/71/1091165771.db2.gz DAEMFOWVXDYGLY-AWEZNQCLSA-N 2 2 303.233 3.402 20 10 DGCDLP C[C@]1([NH3+])CCC[N@@H+](Cc2cc(Cl)c(Cl)cc2O)CC1 ZINC001205287912 1091165775 /nfs/dbraw/zinc/16/57/75/1091165775.db2.gz DAEMFOWVXDYGLY-AWEZNQCLSA-N 2 2 303.233 3.402 20 10 DGCDLP C[C@@]1([NH3+])CCC[N@H+](Cc2cccc(C(F)(F)F)c2O)CC1 ZINC001205289393 1091167881 /nfs/dbraw/zinc/16/78/81/1091167881.db2.gz XOMKIRDRVNXIHN-CQSZACIVSA-N 2 2 302.340 3.114 20 10 DGCDLP C[C@@]1([NH3+])CCC[N@@H+](Cc2cccc(C(F)(F)F)c2O)CC1 ZINC001205289393 1091167893 /nfs/dbraw/zinc/16/78/93/1091167893.db2.gz XOMKIRDRVNXIHN-CQSZACIVSA-N 2 2 302.340 3.114 20 10 DGCDLP C[C@H]1CC[N@H+](Cc2c(O)ccc(Cl)c2Cl)C[C@H]1C[NH3+] ZINC001205317340 1091181617 /nfs/dbraw/zinc/18/16/17/1091181617.db2.gz OCKDREFKXYTYBG-VHSXEESVSA-N 2 2 303.233 3.116 20 10 DGCDLP C[C@H]1CC[N@@H+](Cc2c(O)ccc(Cl)c2Cl)C[C@H]1C[NH3+] ZINC001205317340 1091181625 /nfs/dbraw/zinc/18/16/25/1091181625.db2.gz OCKDREFKXYTYBG-VHSXEESVSA-N 2 2 303.233 3.116 20 10 DGCDLP C[C@@H]1[C@H](C[NH3+])CCC[N@@H+]1Cc1cc(Cl)c(Cl)cc1O ZINC001205912750 1091407593 /nfs/dbraw/zinc/40/75/93/1091407593.db2.gz BYDKIBXPMFETHV-ZJUUUORDSA-N 2 2 303.233 3.258 20 10 DGCDLP C[C@@H]1[C@H](C[NH3+])CCC[N@H+]1Cc1cc(Cl)c(Cl)cc1O ZINC001205912750 1091407601 /nfs/dbraw/zinc/40/76/01/1091407601.db2.gz BYDKIBXPMFETHV-ZJUUUORDSA-N 2 2 303.233 3.258 20 10 DGCDLP Oc1c(C[N@@H+]2CC[C@@]23CCC[NH2+]C3)cccc1-c1ccccc1 ZINC001222196777 1095487577 /nfs/dbraw/zinc/48/75/77/1095487577.db2.gz CCAZVRCJUFEJIB-HXUWFJFHSA-N 2 2 308.425 3.387 20 10 DGCDLP Oc1c(C[N@H+]2CC[C@@]23CCC[NH2+]C3)cccc1-c1ccccc1 ZINC001222196777 1095487584 /nfs/dbraw/zinc/48/75/84/1095487584.db2.gz CCAZVRCJUFEJIB-HXUWFJFHSA-N 2 2 308.425 3.387 20 10 DGCDLP CC(C)(C)c1ccc(O)c(C[N@@H+]2CC[C@@]3(C2)CCCC[NH2+]3)c1 ZINC001222436469 1095614760 /nfs/dbraw/zinc/61/47/60/1095614760.db2.gz YNQWANWYOGRUJF-LJQANCHMSA-N 2 2 302.462 3.408 20 10 DGCDLP CC(C)(C)c1ccc(O)c(C[N@H+]2CC[C@@]3(C2)CCCC[NH2+]3)c1 ZINC001222436469 1095614767 /nfs/dbraw/zinc/61/47/67/1095614767.db2.gz YNQWANWYOGRUJF-LJQANCHMSA-N 2 2 302.462 3.408 20 10 DGCDLP CN(C)c1ccc(C[NH+]2CCC3(CCC[NH2+]3)CC2)c(Cl)c1 ZINC001226783068 1096776001 /nfs/dbraw/zinc/77/60/01/1096776001.db2.gz DXNPHCKCMDCKRR-UHFFFAOYSA-N 2 2 307.869 3.124 20 10 DGCDLP CC[NH+]1CCN(c2ccc([N@H+](C)c3ccc(N)cc3)cc2)CC1 ZINC001175783077 1098169696 /nfs/dbraw/zinc/16/96/96/1098169696.db2.gz XEFYLIASWRMJAG-UHFFFAOYSA-N 2 2 310.445 3.179 20 10 DGCDLP CC[NH+]1CCN(c2ccc([N@@H+](C)c3ccc(N)cc3)cc2)CC1 ZINC001175783077 1098169702 /nfs/dbraw/zinc/16/97/02/1098169702.db2.gz XEFYLIASWRMJAG-UHFFFAOYSA-N 2 2 310.445 3.179 20 10 DGCDLP Oc1ccc(-c2ccc(F)cc2)cc1C[N@@H+]1CC[C@@H]2[NH2+]CC[C@H]21 ZINC001235048883 1098774619 /nfs/dbraw/zinc/77/46/19/1098774619.db2.gz LNSPZKFFESXECH-ZWKOTPCHSA-N 2 2 312.388 3.135 20 10 DGCDLP Oc1ccc(-c2ccc(F)cc2)cc1C[N@H+]1CC[C@@H]2[NH2+]CC[C@H]21 ZINC001235048883 1098774625 /nfs/dbraw/zinc/77/46/25/1098774625.db2.gz LNSPZKFFESXECH-ZWKOTPCHSA-N 2 2 312.388 3.135 20 10 DGCDLP C[C@]1(C[NH3+])CCC[N@H+](Cc2cc(Cl)cc(F)c2O)CC1 ZINC001206324333 1098783698 /nfs/dbraw/zinc/78/36/98/1098783698.db2.gz ABKKENQOOZZOQZ-HNNXBMFYSA-N 2 2 300.805 3.136 20 10 DGCDLP C[C@]1(C[NH3+])CCC[N@@H+](Cc2cc(Cl)cc(F)c2O)CC1 ZINC001206324333 1098783711 /nfs/dbraw/zinc/78/37/11/1098783711.db2.gz ABKKENQOOZZOQZ-HNNXBMFYSA-N 2 2 300.805 3.136 20 10 DGCDLP CCN(CC)c1ccc(C[NH2+]C[C@@H]2CC[N@@H+]2C(C)(C)C)cc1 ZINC001179142195 1099018737 /nfs/dbraw/zinc/01/87/37/1099018737.db2.gz BQTCWSPOEFLZKG-SFHVURJKSA-N 2 2 303.494 3.495 20 10 DGCDLP CCN(CC)c1ccc(C[NH2+]C[C@@H]2CC[N@H+]2C(C)(C)C)cc1 ZINC001179142195 1099018748 /nfs/dbraw/zinc/01/87/48/1099018748.db2.gz BQTCWSPOEFLZKG-SFHVURJKSA-N 2 2 303.494 3.495 20 10 DGCDLP [NH3+]C[C@@H]1CCC[N@@H+]1Cc1cc(-c2ccc(F)cc2)ccc1O ZINC001235725920 1099149647 /nfs/dbraw/zinc/14/96/47/1099149647.db2.gz QNVSWNOBBMXFFE-KRWDZBQOSA-N 2 2 300.377 3.121 20 10 DGCDLP [NH3+]C[C@@H]1CCC[N@H+]1Cc1cc(-c2ccc(F)cc2)ccc1O ZINC001235725920 1099149650 /nfs/dbraw/zinc/14/96/50/1099149650.db2.gz QNVSWNOBBMXFFE-KRWDZBQOSA-N 2 2 300.377 3.121 20 10 DGCDLP CCN(CC)c1ccc(C[N@H+](C)[C@H]2CCCC[C@H]2[NH3+])c(OC)c1 ZINC001236219421 1099475453 /nfs/dbraw/zinc/47/54/53/1099475453.db2.gz VZMSYPYNDVYDIZ-MSOLQXFVSA-N 2 2 319.493 3.243 20 10 DGCDLP CCN(CC)c1ccc(C[N@@H+](C)[C@H]2CCCC[C@H]2[NH3+])c(OC)c1 ZINC001236219421 1099475457 /nfs/dbraw/zinc/47/54/57/1099475457.db2.gz VZMSYPYNDVYDIZ-MSOLQXFVSA-N 2 2 319.493 3.243 20 10 DGCDLP CC(C)(C)c1ccc(C[N@@H+]2CCC[C@H]([NH2+]C3CC3)C2)c(O)c1 ZINC001236223081 1099480531 /nfs/dbraw/zinc/48/05/31/1099480531.db2.gz NXNSPUNDTKJJTD-KRWDZBQOSA-N 2 2 302.462 3.406 20 10 DGCDLP CC(C)(C)c1ccc(C[N@H+]2CCC[C@H]([NH2+]C3CC3)C2)c(O)c1 ZINC001236223081 1099480537 /nfs/dbraw/zinc/48/05/37/1099480537.db2.gz NXNSPUNDTKJJTD-KRWDZBQOSA-N 2 2 302.462 3.406 20 10 DGCDLP Oc1c(C[N@H+](C2CC2)[C@@H]2CC[NH2+]C2)cccc1-c1ccccc1 ZINC001236527223 1099662286 /nfs/dbraw/zinc/66/22/86/1099662286.db2.gz ANELKIBWXXTEIE-GOSISDBHSA-N 2 2 308.425 3.386 20 10 DGCDLP Oc1c(C[N@@H+](C2CC2)[C@@H]2CC[NH2+]C2)cccc1-c1ccccc1 ZINC001236527223 1099662291 /nfs/dbraw/zinc/66/22/91/1099662291.db2.gz ANELKIBWXXTEIE-GOSISDBHSA-N 2 2 308.425 3.386 20 10 DGCDLP CN(C)c1ccc(C[N@H+](C[C@H]2CCC[NH2+]C2)C2CC2)c(Cl)c1 ZINC001236600021 1099695181 /nfs/dbraw/zinc/69/51/81/1099695181.db2.gz XZSMDURJKQIKRE-AWEZNQCLSA-N 2 2 321.896 3.370 20 10 DGCDLP CN(C)c1ccc(C[N@@H+](C[C@H]2CCC[NH2+]C2)C2CC2)c(Cl)c1 ZINC001236600021 1099695195 /nfs/dbraw/zinc/69/51/95/1099695195.db2.gz XZSMDURJKQIKRE-AWEZNQCLSA-N 2 2 321.896 3.370 20 10 DGCDLP Cn1cc[nH+]c1C[C@@H]1CCC[N@H+](Cc2c(O)cccc2Cl)C1 ZINC001319947493 1108709013 /nfs/dbraw/zinc/70/90/13/1108709013.db2.gz UEDXUDOUTXWNFG-ZDUSSCGKSA-N 2 2 319.836 3.234 20 10 DGCDLP Cn1cc[nH+]c1C[C@@H]1CCC[N@@H+](Cc2c(O)cccc2Cl)C1 ZINC001319947493 1108709023 /nfs/dbraw/zinc/70/90/23/1108709023.db2.gz UEDXUDOUTXWNFG-ZDUSSCGKSA-N 2 2 319.836 3.234 20 10 DGCDLP CC[NH+](CC)CC[C@H](C)[NH2+]Cc1cc(Cl)cc(F)c1O ZINC001308556239 1111444009 /nfs/dbraw/zinc/44/40/09/1111444009.db2.gz XVPQTLGBNPDSTN-NSHDSACASA-N 2 2 302.821 3.395 20 10 DGCDLP C[C@H]([NH2+]C1CC[NH+](Cc2ccncc2)CC1)c1ccccc1O ZINC000183430555 432293387 /nfs/dbraw/zinc/29/33/87/432293387.db2.gz ATTLWNYSDQCEIJ-HNNXBMFYSA-N 2 2 311.429 3.102 20 10 DGCDLP CCCOc1ccc(C[NH+]2CCC(c3[nH]cc[nH+]3)CC2)c(O)c1 ZINC000271190456 432348508 /nfs/dbraw/zinc/34/85/08/432348508.db2.gz LWLZWYQNBKPMPW-UHFFFAOYSA-N 2 2 315.417 3.284 20 10 DGCDLP Cc1ccc(O)c(C[NH+]2CCC(Oc3cc[nH+]cc3C)CC2)c1 ZINC000278787186 432900776 /nfs/dbraw/zinc/90/07/76/432900776.db2.gz WHMKAECFPXUPFM-UHFFFAOYSA-N 2 2 312.413 3.447 20 10 DGCDLP COc1cc(Cl)cc(C[N@H+](C)C2C[C@H]3CC[C@@H](C2)[NH+]3C)c1O ZINC000289861141 432977345 /nfs/dbraw/zinc/97/73/45/432977345.db2.gz VKBKYNMBRAZKCA-YIONKMFJSA-N 2 2 324.852 3.111 20 10 DGCDLP COc1cc(Cl)cc(C[N@@H+](C)C2C[C@H]3CC[C@@H](C2)[NH+]3C)c1O ZINC000289861141 432977351 /nfs/dbraw/zinc/97/73/51/432977351.db2.gz VKBKYNMBRAZKCA-YIONKMFJSA-N 2 2 324.852 3.111 20 10 DGCDLP COc1cc(Cl)cc(C[NH+](C)C2C[C@H]3CC[C@@H](C2)[N@H+]3C)c1O ZINC000289861141 432977355 /nfs/dbraw/zinc/97/73/55/432977355.db2.gz VKBKYNMBRAZKCA-YIONKMFJSA-N 2 2 324.852 3.111 20 10 DGCDLP COc1cc(Cl)cc(C[NH+](C)C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c1O ZINC000289861141 432977359 /nfs/dbraw/zinc/97/73/59/432977359.db2.gz VKBKYNMBRAZKCA-YIONKMFJSA-N 2 2 324.852 3.111 20 10 DGCDLP CCC[N@@H+]1CC[C@@H](C[NH2+]Cc2cc(Cl)c(F)cc2O)C1 ZINC000293506764 433761231 /nfs/dbraw/zinc/76/12/31/433761231.db2.gz AHEAZXFAQQILFP-NSHDSACASA-N 2 2 300.805 3.006 20 10 DGCDLP CCC[N@H+]1CC[C@@H](C[NH2+]Cc2cc(Cl)c(F)cc2O)C1 ZINC000293506764 433761240 /nfs/dbraw/zinc/76/12/40/433761240.db2.gz AHEAZXFAQQILFP-NSHDSACASA-N 2 2 300.805 3.006 20 10 DGCDLP Cc1cc(C[N@H+]2CC[C@H](C)[C@H](n3cc[nH+]c3)C2)ccc1N(C)C ZINC000293815582 433880975 /nfs/dbraw/zinc/88/09/75/433880975.db2.gz ONVSRODZTSLWJH-HNAYVOBHSA-N 2 2 312.461 3.341 20 10 DGCDLP Cc1cc(C[N@@H+]2CC[C@H](C)[C@H](n3cc[nH+]c3)C2)ccc1N(C)C ZINC000293815582 433880987 /nfs/dbraw/zinc/88/09/87/433880987.db2.gz ONVSRODZTSLWJH-HNAYVOBHSA-N 2 2 312.461 3.341 20 10 DGCDLP Oc1cc(F)c(Cl)cc1C[NH2+]C1CC[NH+](C2CCC2)CC1 ZINC000294145403 434015365 /nfs/dbraw/zinc/01/53/65/434015365.db2.gz HRFCBCDVTYDCPH-UHFFFAOYSA-N 2 2 312.816 3.291 20 10 DGCDLP Cn1cc[nH+]c1[C@@H]1CC[N@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000377891011 434028214 /nfs/dbraw/zinc/02/82/14/434028214.db2.gz ZTDZMPWYAPZYIL-GOSISDBHSA-N 2 2 324.472 3.400 20 10 DGCDLP Cn1cc[nH+]c1[C@@H]1CC[N@@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000377891011 434028223 /nfs/dbraw/zinc/02/82/23/434028223.db2.gz ZTDZMPWYAPZYIL-GOSISDBHSA-N 2 2 324.472 3.400 20 10 DGCDLP Cc1[nH+]c2ccccc2n1CC[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000296126444 434514388 /nfs/dbraw/zinc/51/43/88/434514388.db2.gz VOXURFMGPSPXPE-MRXNPFEDSA-N 2 2 307.397 3.327 20 10 DGCDLP CCN(CC)c1ccc(C[NH2+]C[C@H]2CCC[N@@H+]2CC)cc1F ZINC000740001994 574917955 /nfs/dbraw/zinc/91/79/55/574917955.db2.gz KUQMBTJKDGXBEV-MRXNPFEDSA-N 2 2 307.457 3.246 20 10 DGCDLP CCN(CC)c1ccc(C[NH2+]C[C@H]2CCC[N@H+]2CC)cc1F ZINC000740001994 574917957 /nfs/dbraw/zinc/91/79/57/574917957.db2.gz KUQMBTJKDGXBEV-MRXNPFEDSA-N 2 2 307.457 3.246 20 10 DGCDLP c1csc(SCCC[NH2+][C@H]2CCC[N@@H+]3CCCC[C@H]23)n1 ZINC000925102152 618505891 /nfs/dbraw/zinc/50/58/91/618505891.db2.gz LMRJYJARLVUHTB-UONOGXRCSA-N 2 2 311.520 3.232 20 10 DGCDLP c1csc(SCCC[NH2+][C@H]2CCC[N@H+]3CCCC[C@H]23)n1 ZINC000925102152 618505892 /nfs/dbraw/zinc/50/58/92/618505892.db2.gz LMRJYJARLVUHTB-UONOGXRCSA-N 2 2 311.520 3.232 20 10 DGCDLP c1csc(SCCC[NH2+][C@@H]2CCC[N@@H+]3CCCC[C@H]23)n1 ZINC000925102153 618505981 /nfs/dbraw/zinc/50/59/81/618505981.db2.gz LMRJYJARLVUHTB-ZIAGYGMSSA-N 2 2 311.520 3.232 20 10 DGCDLP c1csc(SCCC[NH2+][C@@H]2CCC[N@H+]3CCCC[C@H]23)n1 ZINC000925102153 618505982 /nfs/dbraw/zinc/50/59/82/618505982.db2.gz LMRJYJARLVUHTB-ZIAGYGMSSA-N 2 2 311.520 3.232 20 10 DGCDLP COc1cccc(O)c1C[NH2+]C[C@@H]([NH3+])c1ccc(C(C)C)cc1 ZINC000841037447 619207616 /nfs/dbraw/zinc/20/76/16/619207616.db2.gz QHMAFEVHMBVEES-QGZVFWFLSA-N 2 2 314.429 3.314 20 10 DGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+]Cc2ccc(C(F)F)cc2)cc1 ZINC000841040922 619242058 /nfs/dbraw/zinc/24/20/58/619242058.db2.gz CQBRJWMFUJOVFT-QGZVFWFLSA-N 2 2 319.399 3.480 20 10 DGCDLP C[C@H]([NH2+][C@H](CC[NH+](C)C)c1cccnc1)c1cc(F)ccc1O ZINC000903381878 619769034 /nfs/dbraw/zinc/76/90/34/619769034.db2.gz ZJUPOCXANYVBII-SUMWQHHRSA-N 2 2 317.408 3.270 20 10 DGCDLP CN(C)c1ccc(C[NH2+]C[C@H]2CC[N@@H+]2C2CCCCC2)cc1 ZINC000858221333 621166042 /nfs/dbraw/zinc/16/60/42/621166042.db2.gz GHDZAPBYEPRBKV-LJQANCHMSA-N 2 2 301.478 3.249 20 10 DGCDLP CN(C)c1ccc(C[NH2+]C[C@H]2CC[N@H+]2C2CCCCC2)cc1 ZINC000858221333 621166043 /nfs/dbraw/zinc/16/60/43/621166043.db2.gz GHDZAPBYEPRBKV-LJQANCHMSA-N 2 2 301.478 3.249 20 10 DGCDLP CN(C)c1ccc(/C=C/C[NH2+]C[C@@H]2CC[N@@H+]2C2CCCC2)cc1 ZINC000858286211 621171922 /nfs/dbraw/zinc/17/19/22/621171922.db2.gz UUQCXUXSFUZVJB-XJDXJNMNSA-N 2 2 313.489 3.372 20 10 DGCDLP CN(C)c1ccc(/C=C/C[NH2+]C[C@@H]2CC[N@H+]2C2CCCC2)cc1 ZINC000858286211 621171924 /nfs/dbraw/zinc/17/19/24/621171924.db2.gz UUQCXUXSFUZVJB-XJDXJNMNSA-N 2 2 313.489 3.372 20 10 DGCDLP C[C@@H]1C[C@H]([NH2+][C@H]2CC[N@@H+]3CCCC[C@@H]23)c2c1c(F)ccc2O ZINC000756431625 621638229 /nfs/dbraw/zinc/63/82/29/621638229.db2.gz OHSBVKYHPKXZSW-UNQGMJICSA-N 2 2 304.409 3.296 20 10 DGCDLP C[C@@H]1C[C@H]([NH2+][C@H]2CC[N@H+]3CCCC[C@@H]23)c2c1c(F)ccc2O ZINC000756431625 621638231 /nfs/dbraw/zinc/63/82/31/621638231.db2.gz OHSBVKYHPKXZSW-UNQGMJICSA-N 2 2 304.409 3.296 20 10 DGCDLP CCN(C)c1ccc([C@@H](C)[NH2+]C[C@@]2([NH+](C)C)CCSC2)cc1 ZINC000766438409 622329519 /nfs/dbraw/zinc/32/95/19/622329519.db2.gz LEFNUDOJFFBEFW-QAPCUYQASA-N 2 2 321.534 3.231 20 10 DGCDLP C[C@H]([NH2+][C@H]1CCn2cc[nH+]c2C1)c1cc2c(cc1O)CCCC2 ZINC000779065648 623726768 /nfs/dbraw/zinc/72/67/68/623726768.db2.gz NIIHTIUEYCAFNR-BBRMVZONSA-N 2 2 311.429 3.133 20 10 DGCDLP C[C@@H]1CCCC[N@@H+]1CCCC[NH2+]Cc1cc(F)cc(F)c1O ZINC000882892248 625848867 /nfs/dbraw/zinc/84/88/67/625848867.db2.gz RKNJSRVAOGVIMD-CYBMUJFWSA-N 2 2 312.404 3.415 20 10 DGCDLP C[C@@H]1CCCC[N@H+]1CCCC[NH2+]Cc1cc(F)cc(F)c1O ZINC000882892248 625848869 /nfs/dbraw/zinc/84/88/69/625848869.db2.gz RKNJSRVAOGVIMD-CYBMUJFWSA-N 2 2 312.404 3.415 20 10 DGCDLP C[C@H]([NH2+]Cc1cc(F)cc(F)c1O)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000883085169 625921478 /nfs/dbraw/zinc/92/14/78/625921478.db2.gz KGOKKKSHFVCPSP-STQMWFEESA-N 2 2 324.415 3.413 20 10 DGCDLP C[C@H]([NH2+]Cc1cc(F)cc(F)c1O)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000883085169 625921481 /nfs/dbraw/zinc/92/14/81/625921481.db2.gz KGOKKKSHFVCPSP-STQMWFEESA-N 2 2 324.415 3.413 20 10 DGCDLP Cc1nc(C)c([C@@H](C)[NH2+]C[C@@H]([NH3+])c2ccc(N(C)C)cc2)s1 ZINC000817938655 627967327 /nfs/dbraw/zinc/96/73/27/627967327.db2.gz OYUOHGYPLIACFH-BDJLRTHQSA-N 2 2 318.490 3.177 20 10 DGCDLP Cc1ccc([C@@H](C)[NH2+]C[C@@H]([NH3+])c2ccc(N(C)C)cc2)s1 ZINC000817939118 627967667 /nfs/dbraw/zinc/96/76/67/627967667.db2.gz ZEZGXRIWUUKZNH-CZUORRHYSA-N 2 2 303.475 3.473 20 10 DGCDLP C[C@@H]([NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1)c1cccc(F)c1 ZINC000817938791 627967905 /nfs/dbraw/zinc/96/79/05/627967905.db2.gz SLMGXSZXBPVSCA-ACJLOTCBSA-N 2 2 301.409 3.242 20 10 DGCDLP CC[C@@H](Cc1cccs1)[NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000817941127 627968590 /nfs/dbraw/zinc/96/85/90/627968590.db2.gz JCZHDNYUFDHOLB-YJBOKZPZSA-N 2 2 317.502 3.425 20 10 DGCDLP CC[C@H]([NH2+][C@H]1CCC[NH2+]C1)c1ccc(C(F)(F)F)cc1O ZINC000817941890 627969028 /nfs/dbraw/zinc/96/90/28/627969028.db2.gz SVYIAVYWXXFMHL-AAEUAGOBSA-N 2 2 302.340 3.204 20 10 DGCDLP COc1ccc(O)c([C@@H](C)[NH2+]CC[NH2+]C2CCCCCC2)c1 ZINC000817961272 627975515 /nfs/dbraw/zinc/97/55/15/627975515.db2.gz ZWCQQYSAGRBVJM-CQSZACIVSA-N 2 2 306.450 3.364 20 10 DGCDLP CCCC[C@@H](C[NH3+])[NH2+][C@H](C)c1cc(Br)ccc1O ZINC000817961681 627975934 /nfs/dbraw/zinc/97/59/34/627975934.db2.gz CGVNXSPYRLWYEF-PWSUYJOCSA-N 2 2 315.255 3.323 20 10 DGCDLP CC[NH2+][C@H](C)C[NH2+][C@@H](C)c1cc(Br)cc(C)c1O ZINC000817973495 627980374 /nfs/dbraw/zinc/98/03/74/627980374.db2.gz UNXRLWGOTUYSHZ-MNOVXSKESA-N 2 2 315.255 3.112 20 10 DGCDLP C[C@@H]([NH2+][C@@H](C)CCC[NH3+])c1cc(Br)c(F)cc1O ZINC000817977931 627981889 /nfs/dbraw/zinc/98/18/89/627981889.db2.gz RSJUTCAHTCRBAE-DTWKUNHWSA-N 2 2 319.218 3.072 20 10 DGCDLP C[N@H+](CCCC[NH2+]Cc1cc(Cl)c(F)cc1O)C1CC1 ZINC000835063390 629841269 /nfs/dbraw/zinc/84/12/69/629841269.db2.gz KUFUJPWDBXUBIU-UHFFFAOYSA-N 2 2 300.805 3.149 20 10 DGCDLP C[N@@H+](CCCC[NH2+]Cc1cc(Cl)c(F)cc1O)C1CC1 ZINC000835063390 629841273 /nfs/dbraw/zinc/84/12/73/629841273.db2.gz KUFUJPWDBXUBIU-UHFFFAOYSA-N 2 2 300.805 3.149 20 10 DGCDLP Cc1cc(O)c(C[NH+]2CC[C@@]3(C2)CCC[N@@H+](C)C3)c(Cl)c1 ZINC000840949356 630383527 /nfs/dbraw/zinc/38/35/27/630383527.db2.gz STXHBRCPMWUZLO-KRWDZBQOSA-N 2 2 308.853 3.272 20 10 DGCDLP Cc1cc(O)c(C[NH+]2CC[C@@]3(C2)CCC[N@H+](C)C3)c(Cl)c1 ZINC000840949356 630383532 /nfs/dbraw/zinc/38/35/32/630383532.db2.gz STXHBRCPMWUZLO-KRWDZBQOSA-N 2 2 308.853 3.272 20 10 DGCDLP Cc1cc(O)c(C[N@H+]2CC[C@@]3(C2)CCC[NH+](C)C3)c(Cl)c1 ZINC000840949356 630383533 /nfs/dbraw/zinc/38/35/33/630383533.db2.gz STXHBRCPMWUZLO-KRWDZBQOSA-N 2 2 308.853 3.272 20 10 DGCDLP Cc1cc(O)c(C[N@@H+]2CC[C@@]3(C2)CCC[NH+](C)C3)c(Cl)c1 ZINC000840949356 630383537 /nfs/dbraw/zinc/38/35/37/630383537.db2.gz STXHBRCPMWUZLO-KRWDZBQOSA-N 2 2 308.853 3.272 20 10 DGCDLP COc1ccc(O)c(C[NH2+]C[C@@H]([NH3+])c2ccc(C(C)C)cc2)c1 ZINC000841038565 630399895 /nfs/dbraw/zinc/39/98/95/630399895.db2.gz YOWUJYRMVQTYRY-GOSISDBHSA-N 2 2 314.429 3.314 20 10 DGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+]C[C@@H]2C[C@H]2c2ccccc2)cc1 ZINC000841044427 630401453 /nfs/dbraw/zinc/40/14/53/630401453.db2.gz WPMKKFQICLDUQG-YSIASYRMSA-N 2 2 309.457 3.146 20 10 DGCDLP C[C@@H](Cc1ccc(F)cc1)[NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000841045778 630401992 /nfs/dbraw/zinc/40/19/92/630401992.db2.gz PTTBVVGXQIRPRI-LIRRHRJNSA-N 2 2 315.436 3.112 20 10 DGCDLP Oc1c(F)cc(Cl)cc1C[N@@H+]1CCCC[C@@H]1[C@@H]1CC[NH2+]C1 ZINC000841087479 630406056 /nfs/dbraw/zinc/40/60/56/630406056.db2.gz OGGTZBSZPCRDKU-IAQYHMDHSA-N 2 2 312.816 3.149 20 10 DGCDLP Oc1c(F)cc(Cl)cc1C[N@H+]1CCCC[C@@H]1[C@@H]1CC[NH2+]C1 ZINC000841087479 630406058 /nfs/dbraw/zinc/40/60/58/630406058.db2.gz OGGTZBSZPCRDKU-IAQYHMDHSA-N 2 2 312.816 3.149 20 10 DGCDLP Cc1cc(O)c(C[N@H+]2C[C@@H](c3ccccc3F)[C@H]([NH3+])C2)cc1C ZINC000841103020 630408725 /nfs/dbraw/zinc/40/87/25/630408725.db2.gz DAILMGHTEQEUMW-FUHWJXTLSA-N 2 2 314.404 3.075 20 10 DGCDLP Cc1cc(O)c(C[N@@H+]2C[C@@H](c3ccccc3F)[C@H]([NH3+])C2)cc1C ZINC000841103020 630408726 /nfs/dbraw/zinc/40/87/26/630408726.db2.gz DAILMGHTEQEUMW-FUHWJXTLSA-N 2 2 314.404 3.075 20 10 DGCDLP CC(=O)c1cc(Cl)cc(C[NH2+][C@H](C[NH3+])C2CCCCC2)c1O ZINC000842475787 630539571 /nfs/dbraw/zinc/53/95/71/630539571.db2.gz CMLKUYGDTOBPEQ-MRXNPFEDSA-N 2 2 324.852 3.245 20 10 DGCDLP Oc1c(F)cc(Cl)cc1C[NH+]1CCC([C@H]2CCC[NH2+]2)CC1 ZINC000843044713 630607491 /nfs/dbraw/zinc/60/74/91/630607491.db2.gz GDAGPYUWYFPJNK-OAHLLOKOSA-N 2 2 312.816 3.149 20 10 DGCDLP CN(C)c1ccc(/C=C\C[N@@H+]2CCCC[C@@H]2[C@H]2CCC[NH2+]2)cc1 ZINC000843048120 630608447 /nfs/dbraw/zinc/60/84/47/630608447.db2.gz OAFVERRODSYCKB-KJYWSYJISA-N 2 2 313.489 3.372 20 10 DGCDLP CN(C)c1ccc(/C=C\C[N@H+]2CCCC[C@@H]2[C@H]2CCC[NH2+]2)cc1 ZINC000843048120 630608450 /nfs/dbraw/zinc/60/84/50/630608450.db2.gz OAFVERRODSYCKB-KJYWSYJISA-N 2 2 313.489 3.372 20 10 DGCDLP COc1cccc([C@H](C)[NH2+][C@@H]2CCC[N@@H+]3CCCC[C@H]23)c1O ZINC000848568261 631697111 /nfs/dbraw/zinc/69/71/11/631697111.db2.gz CFTVSVIUGPYGNU-NUEKZKHPSA-N 2 2 304.434 3.068 20 10 DGCDLP COc1cccc([C@H](C)[NH2+][C@@H]2CCC[N@H+]3CCCC[C@H]23)c1O ZINC000848568261 631697113 /nfs/dbraw/zinc/69/71/13/631697113.db2.gz CFTVSVIUGPYGNU-NUEKZKHPSA-N 2 2 304.434 3.068 20 10 DGCDLP CCc1cccc(C[NH2+][C@@H](Cn2cc[nH+]c2)C(C)(C)C)c1O ZINC000848895099 631776420 /nfs/dbraw/zinc/77/64/20/631776420.db2.gz QQXYBHPHSRJRLA-INIZCTEOSA-N 2 2 301.434 3.356 20 10 DGCDLP C[C@H]([NH2+]CC1CC[NH+](CC2CC2)CC1)c1cc(F)cc(F)c1O ZINC000850580820 632201262 /nfs/dbraw/zinc/20/12/62/632201262.db2.gz BJVDWSQBVDSMTQ-LBPRGKRZSA-N 2 2 324.415 3.443 20 10 DGCDLP C[NH+]1CCN(c2ccc(C[NH2+]C3(C(F)F)CCCC3)cc2)CC1 ZINC000808451352 661090903 /nfs/dbraw/zinc/09/09/03/661090903.db2.gz JCOHRYYCOYAUNE-UHFFFAOYSA-N 2 2 323.431 3.106 20 10 DGCDLP C[C@H]([NH2+][C@@H](Cn1cc[nH+]c1)C(C)(C)C)c1cc(F)ccc1O ZINC000317536498 656629003 /nfs/dbraw/zinc/62/90/03/656629003.db2.gz KXOWZZOBFOXUKX-LRDDRELGSA-N 2 2 305.397 3.493 20 10 DGCDLP COc1ccc(O)c([C@@H](C)[NH2+][C@H](Cn2cc[nH+]c2)C(C)(C)C)c1 ZINC000319981727 657303992 /nfs/dbraw/zinc/30/39/92/657303992.db2.gz JRGMCEMQTDUTHG-CXAGYDPISA-N 2 2 317.433 3.363 20 10 DGCDLP Cc1cc(O)c(C[NH2+][C@@H]2C[NH2+]C[C@H]2c2ccccc2)cc1Cl ZINC001579638454 1191983658 /nfs/dbraw/zinc/98/36/58/1191983658.db2.gz XWESSPODWIJRPS-DOTOQJQBSA-N 2 2 316.832 3.199 20 10 DGCDLP Cc1cc(C[NH+]2CCC(c3c[nH+]cn3C)CC2)ccc1N(C)C ZINC001460967519 1182747521 /nfs/dbraw/zinc/74/75/21/1182747521.db2.gz XIGJSZQKIBXGOK-UHFFFAOYSA-N 2 2 312.461 3.174 20 10 DGCDLP CCN(CC)c1ccc(C[NH2+]CCCCn2cc[nH+]c2)cc1F ZINC001655396874 1195911784 /nfs/dbraw/zinc/91/17/84/1195911784.db2.gz IHHABKVHEJDQDM-UHFFFAOYSA-N 2 2 318.440 3.438 20 10 DGCDLP Oc1cc(F)c(F)cc1C[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC001657230457 1196120783 /nfs/dbraw/zinc/12/07/83/1196120783.db2.gz ZZDBQLOLUXCZOS-YVEFUNNKSA-N 2 2 322.399 3.119 20 10 DGCDLP Oc1cc(F)c(F)cc1C[N@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC001657230457 1196120784 /nfs/dbraw/zinc/12/07/84/1196120784.db2.gz ZZDBQLOLUXCZOS-YVEFUNNKSA-N 2 2 322.399 3.119 20 10 DGCDLP Oc1cc(F)c(F)cc1C[NH+]1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC001657230457 1196120786 /nfs/dbraw/zinc/12/07/86/1196120786.db2.gz ZZDBQLOLUXCZOS-YVEFUNNKSA-N 2 2 322.399 3.119 20 10 DGCDLP Oc1cc(F)c(F)cc1C[NH+]1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC001657230457 1196120787 /nfs/dbraw/zinc/12/07/87/1196120787.db2.gz ZZDBQLOLUXCZOS-YVEFUNNKSA-N 2 2 322.399 3.119 20 10 DGCDLP Cc1c(C[NH+]2CC3(C2)CC[N@H+](CC2CC2)C3)c2ccccc2n1C ZINC001138255734 1091126046 /nfs/dbraw/zinc/12/60/46/1091126046.db2.gz QRZDSRZPWAEYNN-UHFFFAOYSA-N 2 2 323.484 3.404 20 10 DGCDLP Cc1c(C[NH+]2CC3(C2)CC[N@@H+](CC2CC2)C3)c2ccccc2n1C ZINC001138255734 1091126049 /nfs/dbraw/zinc/12/60/49/1091126049.db2.gz QRZDSRZPWAEYNN-UHFFFAOYSA-N 2 2 323.484 3.404 20 10 DGCDLP CN1CCCc2cc(C[NH+]3CCC([N@H+](C)C4CC4)CC3)ccc21 ZINC001138356694 1091149780 /nfs/dbraw/zinc/14/97/80/1091149780.db2.gz VLYNEAUAMLTKLZ-UHFFFAOYSA-N 2 2 313.489 3.128 20 10 DGCDLP CN1CCCc2cc(C[NH+]3CCC([N@@H+](C)C4CC4)CC3)ccc21 ZINC001138356694 1091149783 /nfs/dbraw/zinc/14/97/83/1091149783.db2.gz VLYNEAUAMLTKLZ-UHFFFAOYSA-N 2 2 313.489 3.128 20 10 DGCDLP C[C@H]1CC[C@H](C[NH3+])[N@H+](Cc2ccc3c(c2O)C=CC(C)(C)O3)C1 ZINC001205853333 1091380232 /nfs/dbraw/zinc/38/02/32/1091380232.db2.gz IAJDBOPJTLHIHW-DZGCQCFKSA-N 2 2 316.445 3.136 20 10 DGCDLP C[C@H]1CC[C@H](C[NH3+])[N@@H+](Cc2ccc3c(c2O)C=CC(C)(C)O3)C1 ZINC001205853333 1091380241 /nfs/dbraw/zinc/38/02/41/1091380241.db2.gz IAJDBOPJTLHIHW-DZGCQCFKSA-N 2 2 316.445 3.136 20 10 DGCDLP C[C@@H]1[C@@H](C[NH3+])CCC[N@@H+]1Cc1c(O)ccc(Cl)c1Cl ZINC001205916171 1091411165 /nfs/dbraw/zinc/41/11/65/1091411165.db2.gz SGYMDEUOKFJRHH-NXEZZACHSA-N 2 2 303.233 3.258 20 10 DGCDLP C[C@@H]1[C@@H](C[NH3+])CCC[N@H+]1Cc1c(O)ccc(Cl)c1Cl ZINC001205916171 1091411176 /nfs/dbraw/zinc/41/11/76/1091411176.db2.gz SGYMDEUOKFJRHH-NXEZZACHSA-N 2 2 303.233 3.258 20 10 DGCDLP C[C@H](C[NH+](C)C)[C@H]1CCCC[N@@H+]1Cc1cc(F)c(F)cc1O ZINC001206800504 1091746147 /nfs/dbraw/zinc/74/61/47/1091746147.db2.gz KTYMWBSRYNNLJV-MLGOLLRUSA-N 2 2 312.404 3.223 20 10 DGCDLP C[C@H](C[NH+](C)C)[C@H]1CCCC[N@H+]1Cc1cc(F)c(F)cc1O ZINC001206800504 1091746150 /nfs/dbraw/zinc/74/61/50/1091746150.db2.gz KTYMWBSRYNNLJV-MLGOLLRUSA-N 2 2 312.404 3.223 20 10 DGCDLP COc1cc(O)c(C[N@@H+]2CCC[C@]3(CCC[NH2+]C3)C2)c(Cl)c1 ZINC001222277704 1095525157 /nfs/dbraw/zinc/52/51/57/1095525157.db2.gz QQGVRTJRMHWGDR-KRWDZBQOSA-N 2 2 324.852 3.020 20 10 DGCDLP COc1cc(O)c(C[N@H+]2CCC[C@]3(CCC[NH2+]C3)C2)c(Cl)c1 ZINC001222277704 1095525167 /nfs/dbraw/zinc/52/51/67/1095525167.db2.gz QQGVRTJRMHWGDR-KRWDZBQOSA-N 2 2 324.852 3.020 20 10 DGCDLP CC(C)(C)c1ccc(O)c(C[N@@H+]2CCC[C@]3(CCC[NH2+]3)C2)c1 ZINC001222355736 1095569400 /nfs/dbraw/zinc/56/94/00/1095569400.db2.gz UPRXZFYFQMNFEL-LJQANCHMSA-N 2 2 302.462 3.408 20 10 DGCDLP CC(C)(C)c1ccc(O)c(C[N@H+]2CCC[C@]3(CCC[NH2+]3)C2)c1 ZINC001222355736 1095569406 /nfs/dbraw/zinc/56/94/06/1095569406.db2.gz UPRXZFYFQMNFEL-LJQANCHMSA-N 2 2 302.462 3.408 20 10 DGCDLP CC(C)(C)c1ccc(O)c(C[N@@H+]2CC[C@]3(C2)CCCC[NH2+]3)c1 ZINC001222436468 1095614130 /nfs/dbraw/zinc/61/41/30/1095614130.db2.gz YNQWANWYOGRUJF-IBGZPJMESA-N 2 2 302.462 3.408 20 10 DGCDLP CC(C)(C)c1ccc(O)c(C[N@H+]2CC[C@]3(C2)CCCC[NH2+]3)c1 ZINC001222436468 1095614139 /nfs/dbraw/zinc/61/41/39/1095614139.db2.gz YNQWANWYOGRUJF-IBGZPJMESA-N 2 2 302.462 3.408 20 10 DGCDLP C[C@H]1C[NH2+]CC[N@H+](Cc2cc(Cl)c(C(C)(C)C)cc2O)C1 ZINC001206286779 1098445868 /nfs/dbraw/zinc/44/58/68/1098445868.db2.gz URMKUOKWVCWPCK-LBPRGKRZSA-N 2 2 310.869 3.384 20 10 DGCDLP C[C@H]1C[NH2+]CC[N@@H+](Cc2cc(Cl)c(C(C)(C)C)cc2O)C1 ZINC001206286779 1098445870 /nfs/dbraw/zinc/44/58/70/1098445870.db2.gz URMKUOKWVCWPCK-LBPRGKRZSA-N 2 2 310.869 3.384 20 10 DGCDLP CC(C)(C)c1ccc(C[N@@H+]2CCCC[C@@]23CC[NH2+]C3)c(O)c1 ZINC001235128592 1098825138 /nfs/dbraw/zinc/82/51/38/1098825138.db2.gz HNIOBRHWDOAXBQ-IBGZPJMESA-N 2 2 302.462 3.408 20 10 DGCDLP CC(C)(C)c1ccc(C[N@H+]2CCCC[C@@]23CC[NH2+]C3)c(O)c1 ZINC001235128592 1098825150 /nfs/dbraw/zinc/82/51/50/1098825150.db2.gz HNIOBRHWDOAXBQ-IBGZPJMESA-N 2 2 302.462 3.408 20 10 DGCDLP Oc1ccc(F)c(Cl)c1C[N@@H+]1CCCCC12CC[NH2+]CC2 ZINC001235190753 1098868604 /nfs/dbraw/zinc/86/86/04/1098868604.db2.gz KFBGKEUXXVORJV-UHFFFAOYSA-N 2 2 312.816 3.293 20 10 DGCDLP Oc1ccc(F)c(Cl)c1C[N@H+]1CCCCC12CC[NH2+]CC2 ZINC001235190753 1098868613 /nfs/dbraw/zinc/86/86/13/1098868613.db2.gz KFBGKEUXXVORJV-UHFFFAOYSA-N 2 2 312.816 3.293 20 10 DGCDLP C[N@@H+](Cc1cc(-c2ccc(F)cc2)ccc1O)C[C@@H]1CCC[NH2+]1 ZINC001236124528 1099412587 /nfs/dbraw/zinc/41/25/87/1099412587.db2.gz NRGKZUCAINFLCE-SFHVURJKSA-N 2 2 314.404 3.382 20 10 DGCDLP C[N@H+](Cc1cc(-c2ccc(F)cc2)ccc1O)C[C@@H]1CCC[NH2+]1 ZINC001236124528 1099412593 /nfs/dbraw/zinc/41/25/93/1099412593.db2.gz NRGKZUCAINFLCE-SFHVURJKSA-N 2 2 314.404 3.382 20 10 DGCDLP CC(C)(C)c1cccc(C[N@H+](C2CC2)[C@H]2CCC[NH2+]C2)c1O ZINC001236239743 1099493451 /nfs/dbraw/zinc/49/34/51/1099493451.db2.gz LNMGTTYFOHVSDB-INIZCTEOSA-N 2 2 302.462 3.406 20 10 DGCDLP CC(C)(C)c1cccc(C[N@@H+](C2CC2)[C@H]2CCC[NH2+]C2)c1O ZINC001236239743 1099493456 /nfs/dbraw/zinc/49/34/56/1099493456.db2.gz LNMGTTYFOHVSDB-INIZCTEOSA-N 2 2 302.462 3.406 20 10 DGCDLP CC(C)[N@H+](Cc1ccc(C(F)(F)F)cc1O)[C@@H]1CCC[NH2+]C1 ZINC001236471265 1099631637 /nfs/dbraw/zinc/63/16/37/1099631637.db2.gz ZNTDFRRYMBWAOS-CQSZACIVSA-N 2 2 316.367 3.373 20 10 DGCDLP CC(C)[N@@H+](Cc1ccc(C(F)(F)F)cc1O)[C@@H]1CCC[NH2+]C1 ZINC001236471265 1099631640 /nfs/dbraw/zinc/63/16/40/1099631640.db2.gz ZNTDFRRYMBWAOS-CQSZACIVSA-N 2 2 316.367 3.373 20 10 DGCDLP Oc1cc(O)c(C[N@H+]([C@H]2CC[NH2+]C2)C2CCCCC2)cc1Cl ZINC001236653712 1099724087 /nfs/dbraw/zinc/72/40/87/1099724087.db2.gz MIFHTIDSIRZPHH-AWEZNQCLSA-N 2 2 324.852 3.248 20 10 DGCDLP Oc1cc(O)c(C[N@@H+]([C@H]2CC[NH2+]C2)C2CCCCC2)cc1Cl ZINC001236653712 1099724094 /nfs/dbraw/zinc/72/40/94/1099724094.db2.gz MIFHTIDSIRZPHH-AWEZNQCLSA-N 2 2 324.852 3.248 20 10 DGCDLP CC[N@H+](CCC[NH+](C)C)Cc1c(O)cccc1OC(F)(F)F ZINC001237113845 1099978063 /nfs/dbraw/zinc/97/80/63/1099978063.db2.gz FFAPUXVWKGMRQA-UHFFFAOYSA-N 2 2 320.355 3.064 20 10 DGCDLP CC[N@@H+](CCC[NH+](C)C)Cc1c(O)cccc1OC(F)(F)F ZINC001237113845 1099978072 /nfs/dbraw/zinc/97/80/72/1099978072.db2.gz FFAPUXVWKGMRQA-UHFFFAOYSA-N 2 2 320.355 3.064 20 10 DGCDLP C[N@H+](CCC[NH+]1CCCC1)Cc1cc(F)c(Cl)cc1O ZINC001237937804 1100297751 /nfs/dbraw/zinc/29/77/51/1100297751.db2.gz VEQVSZVQKSLXPO-UHFFFAOYSA-N 2 2 300.805 3.102 20 10 DGCDLP C[N@@H+](CCC[NH+]1CCCC1)Cc1cc(F)c(Cl)cc1O ZINC001237937804 1100297761 /nfs/dbraw/zinc/29/77/61/1100297761.db2.gz VEQVSZVQKSLXPO-UHFFFAOYSA-N 2 2 300.805 3.102 20 10 DGCDLP Cc1cc(C)c(O)c2c1CC(C)(C)[C@H]2[NH2+][C@@H]1CC[C@H](C)[NH2+]C1 ZINC001246525853 1104578345 /nfs/dbraw/zinc/57/83/45/1104578345.db2.gz OJAFNCRIJAZNFW-IYOUNJFTSA-N 2 2 302.462 3.363 20 10 DGCDLP Cc1ccc(O)c(C[NH+]2CC3(C2)CC[N@@H+](C2CCCC2)C3)c1 ZINC001275311495 1104718364 /nfs/dbraw/zinc/71/83/64/1104718364.db2.gz AISTWZNXJDEDAB-UHFFFAOYSA-N 2 2 300.446 3.151 20 10 DGCDLP Cc1ccc(O)c(C[NH+]2CC3(C2)CC[N@H+](C2CCCC2)C3)c1 ZINC001275311495 1104718373 /nfs/dbraw/zinc/71/83/73/1104718373.db2.gz AISTWZNXJDEDAB-UHFFFAOYSA-N 2 2 300.446 3.151 20 10 DGCDLP COc1ccc(C[N@@H+]2CCCC[C@](C)(C[NH3+])C2)c(O)c1Cl ZINC001206574185 1105437598 /nfs/dbraw/zinc/43/75/98/1105437598.db2.gz QCAKBYWXLWNQOY-MRXNPFEDSA-N 2 2 312.841 3.005 20 10 DGCDLP COc1ccc(C[N@H+]2CCCC[C@](C)(C[NH3+])C2)c(O)c1Cl ZINC001206574185 1105437600 /nfs/dbraw/zinc/43/76/00/1105437600.db2.gz QCAKBYWXLWNQOY-MRXNPFEDSA-N 2 2 312.841 3.005 20 10 DGCDLP CCC[N@@H+]1CCC[C@H]1C[NH2+]C/C=C\c1ccc(N(C)C)cc1 ZINC001308399939 1111425271 /nfs/dbraw/zinc/42/52/71/1111425271.db2.gz SGGRQACXFONBSI-WPGJWXSHSA-N 2 2 301.478 3.230 20 10 DGCDLP CCC[N@H+]1CCC[C@H]1C[NH2+]C/C=C\c1ccc(N(C)C)cc1 ZINC001308399939 1111425274 /nfs/dbraw/zinc/42/52/74/1111425274.db2.gz SGGRQACXFONBSI-WPGJWXSHSA-N 2 2 301.478 3.230 20 10 DGCDLP Cn1c(CCC[NH2+]Cc2ccc3c(c2)CCO3)[nH+]c2ccccc21 ZINC000076900961 185052945 /nfs/dbraw/zinc/05/29/45/185052945.db2.gz VVSZZENRHFQOHF-UHFFFAOYSA-N 2 2 321.424 3.231 20 10 DGCDLP C[C@@H]([NH2+][C@@H](C)Cn1cc[nH+]c1)c1cc(Br)ccc1O ZINC000273372594 130112808 /nfs/dbraw/zinc/11/28/08/130112808.db2.gz GKCZNCZUYVNANL-WDEREUQCSA-N 2 2 324.222 3.091 20 10 DGCDLP COc1cc(Cl)cc(C[N@@H+]2CCC[C@H](c3[nH]cc[nH+]3)C2)c1O ZINC000273750126 130162021 /nfs/dbraw/zinc/16/20/21/130162021.db2.gz NJTUJRAGBHBAFT-NSHDSACASA-N 2 2 321.808 3.157 20 10 DGCDLP COc1cc(Cl)cc(C[N@H+]2CCC[C@H](c3[nH]cc[nH+]3)C2)c1O ZINC000273750126 130162022 /nfs/dbraw/zinc/16/20/22/130162022.db2.gz NJTUJRAGBHBAFT-NSHDSACASA-N 2 2 321.808 3.157 20 10 DGCDLP C[C@H]([NH2+]CCn1cc[nH+]c1)c1cc(Cl)c(Cl)cc1O ZINC000192604366 432391829 /nfs/dbraw/zinc/39/18/29/432391829.db2.gz BMGOPHQFFCUESA-VIFPVBQESA-N 2 2 300.189 3.246 20 10 DGCDLP Cn1cc[nH+]c1[C@H]1CCC[N@H+](Cc2c(O)ccc(Cl)c2F)C1 ZINC000373228798 433138021 /nfs/dbraw/zinc/13/80/21/433138021.db2.gz NDMJGQZWMGCKMN-NSHDSACASA-N 2 2 323.799 3.298 20 10 DGCDLP Cn1cc[nH+]c1[C@H]1CCC[N@@H+](Cc2c(O)ccc(Cl)c2F)C1 ZINC000373228798 433138030 /nfs/dbraw/zinc/13/80/30/433138030.db2.gz NDMJGQZWMGCKMN-NSHDSACASA-N 2 2 323.799 3.298 20 10 DGCDLP C[C@H]([NH2+]C[C@H]1CCC[N@@H+]1C)c1ccc(N2CCCCC2)cc1 ZINC000154507125 620682951 /nfs/dbraw/zinc/68/29/51/620682951.db2.gz UEEFAXXTFZTOBU-QFBILLFUSA-N 2 2 301.478 3.422 20 10 DGCDLP C[C@H]([NH2+]C[C@H]1CCC[N@H+]1C)c1ccc(N2CCCCC2)cc1 ZINC000154507125 620682953 /nfs/dbraw/zinc/68/29/53/620682953.db2.gz UEEFAXXTFZTOBU-QFBILLFUSA-N 2 2 301.478 3.422 20 10 DGCDLP C[C@@H]([NH2+]CC1([NH3+])CCCC1)c1cccc(C(F)(F)F)c1O ZINC000854222665 620785496 /nfs/dbraw/zinc/78/54/96/620785496.db2.gz JRMGZJQRBDPZRN-SNVBAGLBSA-N 2 2 302.340 3.333 20 10 DGCDLP CC[C@@H](c1ccc(C)cc1O)[N@@H+]1CCc2sc(C[NH3+])nc2C1 ZINC000925751132 618594919 /nfs/dbraw/zinc/59/49/19/618594919.db2.gz KHEQNGLVCKKUAI-AWEZNQCLSA-N 2 2 317.458 3.125 20 10 DGCDLP CC[C@@H](c1ccc(C)cc1O)[N@H+]1CCc2sc(C[NH3+])nc2C1 ZINC000925751132 618594921 /nfs/dbraw/zinc/59/49/21/618594921.db2.gz KHEQNGLVCKKUAI-AWEZNQCLSA-N 2 2 317.458 3.125 20 10 DGCDLP COc1cc(C)cc(C[NH2+]CCCCNc2cccc[nH+]2)c1O ZINC000894226012 618733951 /nfs/dbraw/zinc/73/39/51/618733951.db2.gz NIMDRYOFFMHTRF-UHFFFAOYSA-N 2 2 315.417 3.086 20 10 DGCDLP Cc1cc(O)c(C[NH+]2CCC(Nc3cccc[nH+]3)CC2)cc1C ZINC000896195861 618884220 /nfs/dbraw/zinc/88/42/20/618884220.db2.gz VDNBEFPMCASTTA-UHFFFAOYSA-N 2 2 311.429 3.481 20 10 DGCDLP Cc1ccc([C@H](C)[NH2+][C@@H](CC[NH+](C)C)c2cccnc2)c(O)c1 ZINC000903379401 619768370 /nfs/dbraw/zinc/76/83/70/619768370.db2.gz GLAKDISMNUEMAK-YJBOKZPZSA-N 2 2 313.445 3.439 20 10 DGCDLP C[C@@H]([NH2+][C@@H](CC[NH+](C)C)c1cccnc1)c1ccc(F)cc1O ZINC000903380776 619768861 /nfs/dbraw/zinc/76/88/61/619768861.db2.gz PHVRYSKDKFLXLE-DYVFJYSZSA-N 2 2 317.408 3.270 20 10 DGCDLP CCN(CC)c1ccc(C[NH2+]C[C@H](C)Cn2cc[nH+]c2)cc1F ZINC000152117018 620492883 /nfs/dbraw/zinc/49/28/83/620492883.db2.gz HKBHINADQORKID-HNNXBMFYSA-N 2 2 318.440 3.294 20 10 DGCDLP CN(C)c1ccc(C[NH2+]C[C@@H]2CC[N@@H+]2C2CCCCC2)cc1 ZINC000858221332 621165766 /nfs/dbraw/zinc/16/57/66/621165766.db2.gz GHDZAPBYEPRBKV-IBGZPJMESA-N 2 2 301.478 3.249 20 10 DGCDLP CN(C)c1ccc(C[NH2+]C[C@@H]2CC[N@H+]2C2CCCCC2)cc1 ZINC000858221332 621165769 /nfs/dbraw/zinc/16/57/69/621165769.db2.gz GHDZAPBYEPRBKV-IBGZPJMESA-N 2 2 301.478 3.249 20 10 DGCDLP C[C@@H]([NH2+]C[C@H]1CC[N@@H+]1C1CCCC1)c1ccc(N(C)C)cc1 ZINC000858532282 621202182 /nfs/dbraw/zinc/20/21/82/621202182.db2.gz IMPHVWVDEOOLFM-DNVCBOLYSA-N 2 2 301.478 3.420 20 10 DGCDLP C[C@@H]([NH2+]C[C@H]1CC[N@H+]1C1CCCC1)c1ccc(N(C)C)cc1 ZINC000858532282 621202185 /nfs/dbraw/zinc/20/21/85/621202185.db2.gz IMPHVWVDEOOLFM-DNVCBOLYSA-N 2 2 301.478 3.420 20 10 DGCDLP C[N@@H+]1CCCC[C@@H](C[NH2+]Cc2cc(Cl)cc(F)c2O)C1 ZINC000862483042 621594221 /nfs/dbraw/zinc/59/42/21/621594221.db2.gz NWPRVKASDNXRRB-NSHDSACASA-N 2 2 300.805 3.006 20 10 DGCDLP C[N@H+]1CCCC[C@@H](C[NH2+]Cc2cc(Cl)cc(F)c2O)C1 ZINC000862483042 621594224 /nfs/dbraw/zinc/59/42/24/621594224.db2.gz NWPRVKASDNXRRB-NSHDSACASA-N 2 2 300.805 3.006 20 10 DGCDLP C[C@@H]1C[C@@H]([NH2+]CCCCn2cc[nH+]c2)c2c1c(F)ccc2O ZINC000756458247 621639394 /nfs/dbraw/zinc/63/93/94/621639394.db2.gz KQTADRPKFDZNAU-TZMCWYRMSA-N 2 2 303.381 3.346 20 10 DGCDLP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@H](C)c1cc(F)cc(F)c1O ZINC000756534214 621645882 /nfs/dbraw/zinc/64/58/82/621645882.db2.gz LFNQTEYWQHQTOV-WDEREUQCSA-N 2 2 309.360 3.162 20 10 DGCDLP CCN(C)c1ccc([C@@H](C)[NH2+]C[C@]2([NH+](C)C)CCSC2)cc1 ZINC000766438403 622329502 /nfs/dbraw/zinc/32/95/02/622329502.db2.gz LEFNUDOJFFBEFW-CRAIPNDOSA-N 2 2 321.534 3.231 20 10 DGCDLP CC1([NH+]2CCCC2)CC[NH+](Cc2c(O)cccc2Cl)CC1 ZINC000877674089 623986808 /nfs/dbraw/zinc/98/68/08/623986808.db2.gz MPXSFBSSISDXPE-UHFFFAOYSA-N 2 2 308.853 3.496 20 10 DGCDLP C[C@@H]1CCC[N@H+](CCCC[NH2+]Cc2cc(F)cc(F)c2O)C1 ZINC000882892049 625848769 /nfs/dbraw/zinc/84/87/69/625848769.db2.gz LOMGWNCDFOTICL-CYBMUJFWSA-N 2 2 312.404 3.272 20 10 DGCDLP C[C@@H]1CCC[N@@H+](CCCC[NH2+]Cc2cc(F)cc(F)c2O)C1 ZINC000882892049 625848773 /nfs/dbraw/zinc/84/87/73/625848773.db2.gz LOMGWNCDFOTICL-CYBMUJFWSA-N 2 2 312.404 3.272 20 10 DGCDLP C[N@@H+]1CCC[C@@H]2C[NH+](Cc3cc(Cl)c(F)cc3O)CC[C@@H]21 ZINC000816521528 627801210 /nfs/dbraw/zinc/80/12/10/627801210.db2.gz ROVSMCVWMRVMPK-ABAIWWIYSA-N 2 2 312.816 3.101 20 10 DGCDLP C[N@H+]1CCC[C@@H]2C[NH+](Cc3cc(Cl)c(F)cc3O)CC[C@@H]21 ZINC000816521528 627801212 /nfs/dbraw/zinc/80/12/12/627801212.db2.gz ROVSMCVWMRVMPK-ABAIWWIYSA-N 2 2 312.816 3.101 20 10 DGCDLP C[N@@H+]1CCC[C@H]2C[NH+](Cc3cc(Cl)c(F)cc3O)CC[C@@H]21 ZINC000816521530 627801627 /nfs/dbraw/zinc/80/16/27/627801627.db2.gz ROVSMCVWMRVMPK-NHYWBVRUSA-N 2 2 312.816 3.101 20 10 DGCDLP C[N@H+]1CCC[C@H]2C[NH+](Cc3cc(Cl)c(F)cc3O)CC[C@@H]21 ZINC000816521530 627801629 /nfs/dbraw/zinc/80/16/29/627801629.db2.gz ROVSMCVWMRVMPK-NHYWBVRUSA-N 2 2 312.816 3.101 20 10 DGCDLP C[N@H+](CCC[NH+]1CCCC1)Cc1cc(Cl)c(F)cc1O ZINC000816598671 627813623 /nfs/dbraw/zinc/81/36/23/627813623.db2.gz LKGRJYGNFNALST-UHFFFAOYSA-N 2 2 300.805 3.102 20 10 DGCDLP C[N@@H+](CCC[NH+]1CCCC1)Cc1cc(Cl)c(F)cc1O ZINC000816598671 627813625 /nfs/dbraw/zinc/81/36/25/627813625.db2.gz LKGRJYGNFNALST-UHFFFAOYSA-N 2 2 300.805 3.102 20 10 DGCDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+][C@H]2CCCc3ccccc32)cc1 ZINC000817938529 627966661 /nfs/dbraw/zinc/96/66/61/627966661.db2.gz MMOZDKDCAJXQLR-PMACEKPBSA-N 2 2 309.457 3.420 20 10 DGCDLP Cc1cc([C@@H](C)[NH2+]C[C@@H]([NH3+])c2ccc(N(C)C)cc2)cs1 ZINC000817939997 627967427 /nfs/dbraw/zinc/96/74/27/627967427.db2.gz DSRDFWRRSXIWIV-CXAGYDPISA-N 2 2 303.475 3.473 20 10 DGCDLP C[C@H]([NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1)c1cccc(F)c1 ZINC000817938794 627967516 /nfs/dbraw/zinc/96/75/16/627967516.db2.gz SLMGXSZXBPVSCA-UGSOOPFHSA-N 2 2 301.409 3.242 20 10 DGCDLP Cc1ccc([C@@H](C)[NH2+]C[C@@H]([NH3+])c2ccc(N(C)C)cc2)c(O)c1 ZINC000817942255 627968499 /nfs/dbraw/zinc/96/84/99/627968499.db2.gz NNLIYVRTTPJBQP-RDTXWAMCSA-N 2 2 313.445 3.117 20 10 DGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+][C@H](Cc2ccccc2)C2CC2)cc1 ZINC000817941900 627968643 /nfs/dbraw/zinc/96/86/43/627968643.db2.gz LRISUMWKTLYADD-NHCUHLMSSA-N 2 2 323.484 3.363 20 10 DGCDLP Cc1ccc([C@H](C)[NH2+]C[C@H]([NH3+])c2ccc(N(C)C)cc2)c(C)n1 ZINC000817941147 627968788 /nfs/dbraw/zinc/96/87/88/627968788.db2.gz JDWNRLQWZKQWGG-LIRRHRJNSA-N 2 2 312.461 3.115 20 10 DGCDLP Cc1ccc([C@H](C)[NH2+]C[C@H]([NH3+])c2ccc(N(C)C)cc2)c(O)c1 ZINC000817942254 627968904 /nfs/dbraw/zinc/96/89/04/627968904.db2.gz NNLIYVRTTPJBQP-KSSFIOAISA-N 2 2 313.445 3.117 20 10 DGCDLP COc1ccsc1[C@@H](C)[NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000817943864 627969506 /nfs/dbraw/zinc/96/95/06/627969506.db2.gz WEHKLBRCWVTNDS-IUODEOHRSA-N 2 2 319.474 3.173 20 10 DGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+][C@H]2CCCNc3ccccc32)cc1 ZINC000817944337 627969628 /nfs/dbraw/zinc/96/96/28/627969628.db2.gz ZIAJYPZQWCDBEU-QUCCMNQESA-N 2 2 324.472 3.289 20 10 DGCDLP CC(C)[C@@H]([NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1)c1cccnc1 ZINC000817944146 627969967 /nfs/dbraw/zinc/96/99/67/627969967.db2.gz XOZWQGRAHZERDQ-RTBURBONSA-N 2 2 312.461 3.134 20 10 DGCDLP CC(C)C[C@H](C[NH3+])[NH2+][C@H](C)c1cccc(C(F)(F)F)c1O ZINC000817959887 627975992 /nfs/dbraw/zinc/97/59/92/627975992.db2.gz WHVKONDROZCXQH-GHMZBOCLSA-N 2 2 304.356 3.435 20 10 DGCDLP CCCC[C@@H](C[NH3+])[NH2+][C@@H](C)c1ccc(Br)cc1O ZINC000817963202 627977076 /nfs/dbraw/zinc/97/70/76/627977076.db2.gz SFQIRPQCWJIUTB-JQWIXIFHSA-N 2 2 315.255 3.323 20 10 DGCDLP CCO[C@@H](C[NH2+][C@@H](C)c1ccc2ccccc2c1O)C[NH+](C)C ZINC000926965054 627990617 /nfs/dbraw/zinc/99/06/17/627990617.db2.gz ZWEGWFBGTHJFBH-HOCLYGCPSA-N 2 2 316.445 3.163 20 10 DGCDLP CC(C)[NH2+]C1CC[NH+](C/C=C\c2ccc(N(C)C)cc2)CC1 ZINC000835027712 629828994 /nfs/dbraw/zinc/82/89/94/629828994.db2.gz NSDXYOKNXUZVFI-WAYWQWQTSA-N 2 2 301.478 3.228 20 10 DGCDLP C[C@@H](Cc1ccsc1)[NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000841044747 630401262 /nfs/dbraw/zinc/40/12/62/630401262.db2.gz FKMSMFDWWMHEBS-SUMWQHHRSA-N 2 2 303.475 3.035 20 10 DGCDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+]Cc2cccc3cnccc32)cc1 ZINC000841046097 630401705 /nfs/dbraw/zinc/40/17/05/630401705.db2.gz WBUCGOCXYRKEGI-FQEVSTJZSA-N 2 2 320.440 3.090 20 10 DGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+][C@@H]2CCC[C@H](C3CC3)C2)cc1 ZINC000841045808 630401976 /nfs/dbraw/zinc/40/19/76/630401976.db2.gz QOHAQUJQWVHQDV-YQVWRLOYSA-N 2 2 301.478 3.311 20 10 DGCDLP C[C@@H](Cc1ccc(F)cc1)[NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000841045776 630401996 /nfs/dbraw/zinc/40/19/96/630401996.db2.gz PTTBVVGXQIRPRI-IFXJQAMLSA-N 2 2 315.436 3.112 20 10 DGCDLP CC1=CCC[C@H](C)[C@@H]1C[NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1 ZINC001576556142 1191845138 /nfs/dbraw/zinc/84/51/38/1191845138.db2.gz NZHUESLFRHZUJD-KFKAGJAMSA-N 2 2 301.478 3.334 20 10 DGCDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+]Cc2ccc3[nH]ccc3c2)cc1 ZINC001578424776 1191942407 /nfs/dbraw/zinc/94/24/07/1191942407.db2.gz VGNTZLWHAZDCJK-SFHVURJKSA-N 2 2 308.429 3.024 20 10 DGCDLP C[NH+](C)c1ccc(NCc2ccc(N3CC[NH+](C)CC3)cc2)cc1 ZINC001620852610 1192456965 /nfs/dbraw/zinc/45/69/65/1192456965.db2.gz AFTBBNQFZGHTIO-UHFFFAOYSA-N 2 2 324.472 3.117 20 10 DGCDLP C[C@@H](C[NH+](C)C)[C@H]1CCCC[N@@H+]1Cc1cc(F)cc(F)c1O ZINC001462463387 1182956281 /nfs/dbraw/zinc/95/62/81/1182956281.db2.gz VBQKJLZCGOHQJM-BLLLJJGKSA-N 2 2 312.404 3.223 20 10 DGCDLP C[C@@H](C[NH+](C)C)[C@H]1CCCC[N@H+]1Cc1cc(F)cc(F)c1O ZINC001462463387 1182956285 /nfs/dbraw/zinc/95/62/85/1182956285.db2.gz VBQKJLZCGOHQJM-BLLLJJGKSA-N 2 2 312.404 3.223 20 10 DGCDLP CC(C)C[C@@H](C[NH+]1CCCC1)[NH2+]Cc1ccc2c(c1)CCO2 ZINC001474155740 1183874790 /nfs/dbraw/zinc/87/47/90/1183874790.db2.gz NVTNYQJHYPVEKJ-SFHVURJKSA-N 2 2 302.462 3.222 20 10 DGCDLP CC[N@@H+]1CCC[C@H](C[NH2+]Cc2cc(Cl)cc(F)c2O)C1 ZINC001657000128 1196091286 /nfs/dbraw/zinc/09/12/86/1196091286.db2.gz MJOJXZDLKMJHHB-LLVKDONJSA-N 2 2 300.805 3.006 20 10 DGCDLP CC[N@H+]1CCC[C@H](C[NH2+]Cc2cc(Cl)cc(F)c2O)C1 ZINC001657000128 1196091287 /nfs/dbraw/zinc/09/12/87/1196091287.db2.gz MJOJXZDLKMJHHB-LLVKDONJSA-N 2 2 300.805 3.006 20 10 DGCDLP CCOc1cccc(C[N@H+](C(C)C)C2CC[NH+](C)CC2)c1O ZINC001203617902 1090767160 /nfs/dbraw/zinc/76/71/60/1090767160.db2.gz XOKNSWAOMMTUER-UHFFFAOYSA-N 2 2 306.450 3.096 20 10 DGCDLP CCOc1cccc(C[N@@H+](C(C)C)C2CC[NH+](C)CC2)c1O ZINC001203617902 1090767165 /nfs/dbraw/zinc/76/71/65/1090767165.db2.gz XOKNSWAOMMTUER-UHFFFAOYSA-N 2 2 306.450 3.096 20 10 DGCDLP Cc1c[nH+]ccc1O[C@H]1CC[N@H+](Cc2cc(Cl)ccc2O)C1 ZINC001203665431 1090775397 /nfs/dbraw/zinc/77/53/97/1090775397.db2.gz JUDSMXOIPDYIMC-HNNXBMFYSA-N 2 2 318.804 3.402 20 10 DGCDLP Cc1c[nH+]ccc1O[C@H]1CC[N@@H+](Cc2cc(Cl)ccc2O)C1 ZINC001203665431 1090775403 /nfs/dbraw/zinc/77/54/03/1090775403.db2.gz JUDSMXOIPDYIMC-HNNXBMFYSA-N 2 2 318.804 3.402 20 10 DGCDLP C[C@@H]1CC[C@H](C[NH3+])C[N@@H+]1Cc1cc(Cl)c(Cl)cc1O ZINC001206811503 1091750516 /nfs/dbraw/zinc/75/05/16/1091750516.db2.gz VQZOMMZBCGPADD-NXEZZACHSA-N 2 2 303.233 3.258 20 10 DGCDLP C[C@@H]1CC[C@H](C[NH3+])C[N@H+]1Cc1cc(Cl)c(Cl)cc1O ZINC001206811503 1091750522 /nfs/dbraw/zinc/75/05/22/1091750522.db2.gz VQZOMMZBCGPADD-NXEZZACHSA-N 2 2 303.233 3.258 20 10 DGCDLP Cc1cc[nH+]c(N2CC[NH+](Cc3c(C)ccc(C)c3O)CC2)c1 ZINC001140181437 1091793466 /nfs/dbraw/zinc/79/34/66/1091793466.db2.gz BIGUPKAIPGANTC-UHFFFAOYSA-N 2 2 311.429 3.035 20 10 DGCDLP Oc1c(F)cc(Cl)cc1C[N@@H+]1CCC[C@]12CCC[NH2+]CC2 ZINC001222320762 1095550957 /nfs/dbraw/zinc/55/09/57/1095550957.db2.gz MSJNKVOGHHEIHG-INIZCTEOSA-N 2 2 312.816 3.293 20 10 DGCDLP Oc1c(F)cc(Cl)cc1C[N@H+]1CCC[C@]12CCC[NH2+]CC2 ZINC001222320762 1095550967 /nfs/dbraw/zinc/55/09/67/1095550967.db2.gz MSJNKVOGHHEIHG-INIZCTEOSA-N 2 2 312.816 3.293 20 10 DGCDLP Cc1cc(C[NH+]2CC3(C2)CCC[NH2+]C3)c(C)n1-c1ccccc1 ZINC001222335590 1095559042 /nfs/dbraw/zinc/55/90/42/1095559042.db2.gz WLYTZIIICNSXFS-UHFFFAOYSA-N 2 2 309.457 3.280 20 10 DGCDLP c1cc(N2CCCCC2)ccc1C[N@@H+]1CCC[C@]2(CCC[NH2+]2)C1 ZINC001222346833 1095566332 /nfs/dbraw/zinc/56/63/32/1095566332.db2.gz UGPPHSKBHMHMDK-HXUWFJFHSA-N 2 2 313.489 3.395 20 10 DGCDLP c1cc(N2CCCCC2)ccc1C[N@H+]1CCC[C@]2(CCC[NH2+]2)C1 ZINC001222346833 1095566348 /nfs/dbraw/zinc/56/63/48/1095566348.db2.gz UGPPHSKBHMHMDK-HXUWFJFHSA-N 2 2 313.489 3.395 20 10 DGCDLP Cc1ccc(C)n1-c1ccc(C[N@@H+]2CC[C@]3(CCC[NH2+]3)C2)cc1 ZINC001222470861 1095630765 /nfs/dbraw/zinc/63/07/65/1095630765.db2.gz JQIWBPKUYPICNB-HXUWFJFHSA-N 2 2 309.457 3.422 20 10 DGCDLP Cc1ccc(C)n1-c1ccc(C[N@H+]2CC[C@]3(CCC[NH2+]3)C2)cc1 ZINC001222470861 1095630771 /nfs/dbraw/zinc/63/07/71/1095630771.db2.gz JQIWBPKUYPICNB-HXUWFJFHSA-N 2 2 309.457 3.422 20 10 DGCDLP CN1CCCc2cc(C[N@@H+]3CCCC[C@]34CCC[NH2+]C4)ccc21 ZINC001235167247 1098848979 /nfs/dbraw/zinc/84/89/79/1098848979.db2.gz GQTVJVIMFTWTOV-HXUWFJFHSA-N 2 2 313.489 3.177 20 10 DGCDLP CN1CCCc2cc(C[N@H+]3CCCC[C@]34CCC[NH2+]C4)ccc21 ZINC001235167247 1098848990 /nfs/dbraw/zinc/84/89/90/1098848990.db2.gz GQTVJVIMFTWTOV-HXUWFJFHSA-N 2 2 313.489 3.177 20 10 DGCDLP CCN(CC)c1ccc(C[NH2+]C[C@H]2CC[N@@H+]2C(C)(C)C)cc1 ZINC001179142194 1099019370 /nfs/dbraw/zinc/01/93/70/1099019370.db2.gz BQTCWSPOEFLZKG-GOSISDBHSA-N 2 2 303.494 3.495 20 10 DGCDLP CCN(CC)c1ccc(C[NH2+]C[C@H]2CC[N@H+]2C(C)(C)C)cc1 ZINC001179142194 1099019381 /nfs/dbraw/zinc/01/93/81/1099019381.db2.gz BQTCWSPOEFLZKG-GOSISDBHSA-N 2 2 303.494 3.495 20 10 DGCDLP Oc1ccc(C(F)(F)F)cc1C[N@H+](C1CC1)[C@@H]1CCC[NH2+]C1 ZINC001236238919 1099491699 /nfs/dbraw/zinc/49/16/99/1099491699.db2.gz DPCRWCCHUXLSAV-CQSZACIVSA-N 2 2 314.351 3.127 20 10 DGCDLP Oc1ccc(C(F)(F)F)cc1C[N@@H+](C1CC1)[C@@H]1CCC[NH2+]C1 ZINC001236238919 1099491706 /nfs/dbraw/zinc/49/17/06/1099491706.db2.gz DPCRWCCHUXLSAV-CQSZACIVSA-N 2 2 314.351 3.127 20 10 DGCDLP CC(C)(C)c1ccc(O)c(C[N@H+](C2CC2)[C@H]2CCC[NH2+]C2)c1 ZINC001236240455 1099495271 /nfs/dbraw/zinc/49/52/71/1099495271.db2.gz MBDXIEXDRMSOPB-KRWDZBQOSA-N 2 2 302.462 3.406 20 10 DGCDLP CC(C)(C)c1ccc(O)c(C[N@@H+](C2CC2)[C@H]2CCC[NH2+]C2)c1 ZINC001236240455 1099495275 /nfs/dbraw/zinc/49/52/75/1099495275.db2.gz MBDXIEXDRMSOPB-KRWDZBQOSA-N 2 2 302.462 3.406 20 10 DGCDLP Oc1cc(F)c(F)cc1C[N@H+](C[C@H]1CCC[NH2+]C1)C1CCCC1 ZINC001236376966 1099564569 /nfs/dbraw/zinc/56/45/69/1099564569.db2.gz WUFOFZWJYDNZIS-ZDUSSCGKSA-N 2 2 324.415 3.415 20 10 DGCDLP Oc1cc(F)c(F)cc1C[N@@H+](C[C@H]1CCC[NH2+]C1)C1CCCC1 ZINC001236376966 1099564579 /nfs/dbraw/zinc/56/45/79/1099564579.db2.gz WUFOFZWJYDNZIS-ZDUSSCGKSA-N 2 2 324.415 3.415 20 10 DGCDLP COc1cc(O)c(C[N@H+](C(C)C)[C@@H]2CCC[NH2+]C2)cc1Cl ZINC001236470515 1099630262 /nfs/dbraw/zinc/63/02/62/1099630262.db2.gz JDJGZCUOKOPRHC-CYBMUJFWSA-N 2 2 312.841 3.017 20 10 DGCDLP COc1cc(O)c(C[N@@H+](C(C)C)[C@@H]2CCC[NH2+]C2)cc1Cl ZINC001236470515 1099630265 /nfs/dbraw/zinc/63/02/65/1099630265.db2.gz JDJGZCUOKOPRHC-CYBMUJFWSA-N 2 2 312.841 3.017 20 10 DGCDLP CC(C)(C)[N@@H+]1CC[C@H]1C[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001327578082 1103685828 /nfs/dbraw/zinc/68/58/28/1103685828.db2.gz RLKDENFXLKCSGE-SFHVURJKSA-N 2 2 301.478 3.249 20 10 DGCDLP CC(C)(C)[N@H+]1CC[C@H]1C[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001327578082 1103685839 /nfs/dbraw/zinc/68/58/39/1103685839.db2.gz RLKDENFXLKCSGE-SFHVURJKSA-N 2 2 301.478 3.249 20 10 DGCDLP CC(C)(C)[N@@H+]1CC[C@@H]1C[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001327578080 1103685949 /nfs/dbraw/zinc/68/59/49/1103685949.db2.gz RLKDENFXLKCSGE-GOSISDBHSA-N 2 2 301.478 3.249 20 10 DGCDLP CC(C)(C)[N@H+]1CC[C@@H]1C[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001327578080 1103685950 /nfs/dbraw/zinc/68/59/50/1103685950.db2.gz RLKDENFXLKCSGE-GOSISDBHSA-N 2 2 301.478 3.249 20 10 DGCDLP C[N@@H+]1CCC[C@@H]([NH2+]Cc2cc(Cl)c3cccnc3c2O)CC1 ZINC001254504330 1106085849 /nfs/dbraw/zinc/08/58/49/1106085849.db2.gz UEAUJQWPLJAQFV-CYBMUJFWSA-N 2 2 319.836 3.168 20 10 DGCDLP C[N@H+]1CCC[C@@H]([NH2+]Cc2cc(Cl)c3cccnc3c2O)CC1 ZINC001254504330 1106085852 /nfs/dbraw/zinc/08/58/52/1106085852.db2.gz UEAUJQWPLJAQFV-CYBMUJFWSA-N 2 2 319.836 3.168 20 10 DGCDLP C[C@H](CC[NH+](C)C)[NH2+][C@@H](C)c1ccc(Br)cc1O ZINC000273560499 130137654 /nfs/dbraw/zinc/13/76/54/130137654.db2.gz IARBIMPISYMTLC-MNOVXSKESA-N 2 2 315.255 3.146 20 10 DGCDLP Cn1cc[nH+]c1C[C@@H]1CCC[N@H+](Cc2cccc(Cl)c2O)C1 ZINC000182089929 228366310 /nfs/dbraw/zinc/36/63/10/228366310.db2.gz ZAUYFVSHZDNXQX-ZDUSSCGKSA-N 2 2 319.836 3.234 20 10 DGCDLP Cn1cc[nH+]c1C[C@@H]1CCC[N@@H+](Cc2cccc(Cl)c2O)C1 ZINC000182089929 228366314 /nfs/dbraw/zinc/36/63/14/228366314.db2.gz ZAUYFVSHZDNXQX-ZDUSSCGKSA-N 2 2 319.836 3.234 20 10 DGCDLP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@H](C)c2ccccc2O)cn1 ZINC000183433368 228373576 /nfs/dbraw/zinc/37/35/76/228373576.db2.gz AMLSAXMKJYXMCG-CYBMUJFWSA-N 2 2 308.385 3.132 20 10 DGCDLP C[C@@H](Cn1cc[nH+]c1)[NH2+][C@@H](C)c1ccc(Br)cc1O ZINC000273301163 432580644 /nfs/dbraw/zinc/58/06/44/432580644.db2.gz BNHIOTSIZWRLKU-QWRGUYRKSA-N 2 2 324.222 3.091 20 10 DGCDLP CCC[N@@H+](Cc1ccc(-n2cc[nH+]c2)nc1)Cc1ccccc1O ZINC000177097062 432584619 /nfs/dbraw/zinc/58/46/19/432584619.db2.gz DZLSXRWUXWWTFE-UHFFFAOYSA-N 2 2 322.412 3.385 20 10 DGCDLP Cc1cc(C[N@H+]2CC[C@H](C)[C@@H](n3cc[nH+]c3)C2)ccc1N(C)C ZINC000293815586 433878682 /nfs/dbraw/zinc/87/86/82/433878682.db2.gz ONVSRODZTSLWJH-KXBFYZLASA-N 2 2 312.461 3.341 20 10 DGCDLP Cc1cc(C[N@@H+]2CC[C@H](C)[C@@H](n3cc[nH+]c3)C2)ccc1N(C)C ZINC000293815586 433878692 /nfs/dbraw/zinc/87/86/92/433878692.db2.gz ONVSRODZTSLWJH-KXBFYZLASA-N 2 2 312.461 3.341 20 10 DGCDLP Cc1ccc(O)c([C@H](C)[NH2+]Cc2ccc(-n3cc[nH+]c3)nc2)c1 ZINC000363853942 434170570 /nfs/dbraw/zinc/17/05/70/434170570.db2.gz LFFDFASGSTXYKI-AWEZNQCLSA-N 2 2 308.385 3.132 20 10 DGCDLP Oc1cccc2c1[C@H]([NH2+]C1CC[NH+](Cc3ccccn3)CC1)CC2 ZINC000295925918 434444292 /nfs/dbraw/zinc/44/42/92/434444292.db2.gz JXXPINPJXLTBRL-GOSISDBHSA-N 2 2 323.440 3.029 20 10 DGCDLP Cc1[nH+]c2ccccc2n1CC[NH2+][C@H]1CCc2cccc(O)c21 ZINC000296126438 434515816 /nfs/dbraw/zinc/51/58/16/434515816.db2.gz VOXURFMGPSPXPE-INIZCTEOSA-N 2 2 307.397 3.327 20 10 DGCDLP Oc1ccc(Cl)c(F)c1C[N@@H+]1CC[C@@H](Oc2cc[nH+]cc2)C1 ZINC000369390930 434592841 /nfs/dbraw/zinc/59/28/41/434592841.db2.gz GSBAISDNPUKGIU-GFCCVEGCSA-N 2 2 322.767 3.233 20 10 DGCDLP Oc1ccc(Cl)c(F)c1C[N@H+]1CC[C@@H](Oc2cc[nH+]cc2)C1 ZINC000369390930 434592851 /nfs/dbraw/zinc/59/28/51/434592851.db2.gz GSBAISDNPUKGIU-GFCCVEGCSA-N 2 2 322.767 3.233 20 10 DGCDLP C[C@H]([NH2+]CCCn1cc[nH+]c1)c1cc(Br)ccc1O ZINC000181006832 525345982 /nfs/dbraw/zinc/34/59/82/525345982.db2.gz CEAJBCPEAFROMD-NSHDSACASA-N 2 2 324.222 3.092 20 10 DGCDLP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1)c1cc(F)cc(F)c1O ZINC000853242055 620681577 /nfs/dbraw/zinc/68/15/77/620681577.db2.gz ZUPRWVGLYZETHW-JSGCOSHPSA-N 2 2 324.415 3.443 20 10 DGCDLP C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1)c1cc(F)cc(F)c1O ZINC000853242055 620681579 /nfs/dbraw/zinc/68/15/79/620681579.db2.gz ZUPRWVGLYZETHW-JSGCOSHPSA-N 2 2 324.415 3.443 20 10 DGCDLP Oc1cccc2c1[C@@H]([NH2+][C@@H]1C[NH2+]CC[C@@H]1c1ccccc1)CC2 ZINC000854221939 620785781 /nfs/dbraw/zinc/78/57/81/620785781.db2.gz CCWNHRSHSBVMRG-FGTMMUONSA-N 2 2 308.425 3.115 20 10 DGCDLP Cc1ccc(CN(c2cccc[nH+]2)[C@H]2CC[C@H]([NH3+])CC2)c(O)c1 ZINC000895117157 618541613 /nfs/dbraw/zinc/54/16/13/618541613.db2.gz YGXBLLCFOHLRKS-QAQDUYKDSA-N 2 2 311.429 3.372 20 10 DGCDLP CCc1cccc(C[NH2+][C@@H](CC[NH+](C)C)c2cccnc2)c1O ZINC000896717930 618949869 /nfs/dbraw/zinc/94/98/69/618949869.db2.gz YIXVKCSTKDXNDT-SFHVURJKSA-N 2 2 313.445 3.132 20 10 DGCDLP C[C@@H]([NH2+][C@@H]1CC[C@@H](C)[NH2+]C1)c1ccc(N2CCCCC2)cc1 ZINC000863545395 621682480 /nfs/dbraw/zinc/68/24/80/621682480.db2.gz QRLUIVGEWXFPEZ-JFIYKMOQSA-N 2 2 301.478 3.468 20 10 DGCDLP C[C@H]([NH2+][C@@H]1CC[NH2+][C@H]1C)c1ccc(N2CCCCCC2)cc1 ZINC000863547263 621683054 /nfs/dbraw/zinc/68/30/54/621683054.db2.gz RBEAXJRGHPDLOS-TXPKVOOTSA-N 2 2 301.478 3.468 20 10 DGCDLP C[C@H]1CC[C@H]([NH2+]Cc2ccc(N(C)C)cc2C(F)(F)F)C[NH2+]1 ZINC000863649698 621693239 /nfs/dbraw/zinc/69/32/39/621693239.db2.gz GTTZKTFSJYQHEN-AAEUAGOBSA-N 2 2 315.383 3.002 20 10 DGCDLP C[C@H]([NH2+]CC1(C[NH+](C)C)CCCC1)c1cc(F)cc(F)c1O ZINC000760896554 621972492 /nfs/dbraw/zinc/97/24/92/621972492.db2.gz GSBWYFXPFWCQIF-LBPRGKRZSA-N 2 2 312.404 3.443 20 10 DGCDLP Cc1ccc(C[N@@H+](Cc2ccco2)C2CC[NH+](C)CC2)c(O)c1 ZINC000877531600 623927326 /nfs/dbraw/zinc/92/73/26/623927326.db2.gz RKNXMXIHOHPZCV-UHFFFAOYSA-N 2 2 314.429 3.390 20 10 DGCDLP Cc1ccc(C[N@H+](Cc2ccco2)C2CC[NH+](C)CC2)c(O)c1 ZINC000877531600 623927331 /nfs/dbraw/zinc/92/73/31/623927331.db2.gz RKNXMXIHOHPZCV-UHFFFAOYSA-N 2 2 314.429 3.390 20 10 DGCDLP CCC1([NH+](C)C)CC[NH+](Cc2ccc(N(C)C)c(F)c2)CC1 ZINC000877689629 623992944 /nfs/dbraw/zinc/99/29/44/623992944.db2.gz HPZBOEBLUXDEQC-UHFFFAOYSA-N 2 2 307.457 3.198 20 10 DGCDLP Oc1c(F)cc(F)cc1C[NH2+]C1CC[NH+](CC2CCCC2)CC1 ZINC000882941994 625867330 /nfs/dbraw/zinc/86/73/30/625867330.db2.gz IOJMBPHZBOZJTI-UHFFFAOYSA-N 2 2 324.415 3.415 20 10 DGCDLP C[N@H+](CC[C@H]1CCCC[NH+]1C)Cc1cc(Cl)c(F)cc1O ZINC000816514709 627800562 /nfs/dbraw/zinc/80/05/62/627800562.db2.gz FTKPBAINXSRUMO-CYBMUJFWSA-N 2 2 314.832 3.491 20 10 DGCDLP C[N@@H+](CC[C@H]1CCCC[NH+]1C)Cc1cc(Cl)c(F)cc1O ZINC000816514709 627800566 /nfs/dbraw/zinc/80/05/66/627800566.db2.gz FTKPBAINXSRUMO-CYBMUJFWSA-N 2 2 314.832 3.491 20 10 DGCDLP C[NH+](CC[C@H]1CCCC[N@@H+]1C)Cc1cc(Cl)c(F)cc1O ZINC000816514709 627800570 /nfs/dbraw/zinc/80/05/70/627800570.db2.gz FTKPBAINXSRUMO-CYBMUJFWSA-N 2 2 314.832 3.491 20 10 DGCDLP C[NH+](CC[C@H]1CCCC[N@H+]1C)Cc1cc(Cl)c(F)cc1O ZINC000816514709 627800574 /nfs/dbraw/zinc/80/05/74/627800574.db2.gz FTKPBAINXSRUMO-CYBMUJFWSA-N 2 2 314.832 3.491 20 10 DGCDLP CC1CC[NH+](CCC[NH2+]Cc2cc(Cl)c(F)cc2O)CC1 ZINC000816530677 627803230 /nfs/dbraw/zinc/80/32/30/627803230.db2.gz QIUZDZORUHWNES-UHFFFAOYSA-N 2 2 314.832 3.396 20 10 DGCDLP C[NH+](C)CC1CCC([NH2+]Cc2cc(Cl)c(F)cc2O)CC1 ZINC000816558075 627807538 /nfs/dbraw/zinc/80/75/38/627807538.db2.gz MCYHTJNAERBRMX-UHFFFAOYSA-N 2 2 314.832 3.395 20 10 DGCDLP Cc1ccc2c(c1)CC[C@H]2[NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000817938558 627966726 /nfs/dbraw/zinc/96/67/26/627966726.db2.gz MZMAICANSUOCOG-VQTJNVASSA-N 2 2 309.457 3.338 20 10 DGCDLP C[C@@H]([NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1)c1ccc(F)cc1 ZINC000817939096 627967621 /nfs/dbraw/zinc/96/76/21/627967621.db2.gz YVTNBBNCUWOFDW-ACJLOTCBSA-N 2 2 301.409 3.242 20 10 DGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+][C@@H]2CCc3cc(F)ccc32)cc1 ZINC000817938969 627967776 /nfs/dbraw/zinc/96/77/76/627967776.db2.gz WNRRDMUONLWSPB-RTBURBONSA-N 2 2 313.420 3.169 20 10 DGCDLP Cc1cc([C@@H](C)[NH2+]C[C@H]([NH3+])c2ccc(N(C)C)cc2)cs1 ZINC000817939999 627967783 /nfs/dbraw/zinc/96/77/83/627967783.db2.gz DSRDFWRRSXIWIV-DYVFJYSZSA-N 2 2 303.475 3.473 20 10 DGCDLP C[C@H](CSC(C)(C)C)[NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000817944048 627969543 /nfs/dbraw/zinc/96/95/43/627969543.db2.gz WZPYLNDFRNLWJP-CZUORRHYSA-N 2 2 309.523 3.262 20 10 DGCDLP CCC[C@@H]([NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1)c1ccccn1 ZINC000817944101 627969573 /nfs/dbraw/zinc/96/95/73/627969573.db2.gz XHEUYSWYRCETRA-ZWKOTPCHSA-N 2 2 312.461 3.278 20 10 DGCDLP CC(C)C[C@@H](C[NH3+])[NH2+][C@@H](C)c1ccc(Br)cc1O ZINC000817958980 627974745 /nfs/dbraw/zinc/97/47/45/627974745.db2.gz NXWHBGMXNOMAQD-JQWIXIFHSA-N 2 2 315.255 3.179 20 10 DGCDLP C[C@H]([NH2+][C@H]1C[NH2+]CC[C@@H]1C)c1ccc(N2CCCCC2)c(F)c1 ZINC000817967207 627977631 /nfs/dbraw/zinc/97/76/31/627977631.db2.gz FOCKMFTUGGSIET-MPGHIAIKSA-N 2 2 319.468 3.465 20 10 DGCDLP CN(C)c1ccc(/C=C/C[N@@H+]2CCC[C@H](c3[nH]cc[nH+]3)C2)cc1 ZINC000835025808 629827442 /nfs/dbraw/zinc/82/74/42/629827442.db2.gz NPLVQYMPIUPLEF-RCFWFJCLSA-N 2 2 310.445 3.369 20 10 DGCDLP CN(C)c1ccc(/C=C/C[N@H+]2CCC[C@H](c3[nH]cc[nH+]3)C2)cc1 ZINC000835025808 629827445 /nfs/dbraw/zinc/82/74/45/629827445.db2.gz NPLVQYMPIUPLEF-RCFWFJCLSA-N 2 2 310.445 3.369 20 10 DGCDLP CC[C@H](C[NH2+]C/C=C\c1ccc(N(C)C)cc1)[NH+]1CCCC1 ZINC000835035930 629830319 /nfs/dbraw/zinc/83/03/19/629830319.db2.gz LQGOQYRKMCJNLK-JTHGQSKGSA-N 2 2 301.478 3.230 20 10 DGCDLP Cc1ccccc1C[C@H](C)[NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000841041749 630400581 /nfs/dbraw/zinc/40/05/81/630400581.db2.gz BHCCLTBHSFSHTQ-JXFKEZNVSA-N 2 2 311.473 3.282 20 10 DGCDLP C[C@H](C[NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1)c1ccc(F)cc1 ZINC000841042738 630401287 /nfs/dbraw/zinc/40/12/87/630401287.db2.gz NCJUYZMWKSZEES-AUUYWEPGSA-N 2 2 315.436 3.285 20 10 DGCDLP C[C@H](CCC(F)(F)F)[NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000841044982 630401430 /nfs/dbraw/zinc/40/14/30/630401430.db2.gz HEKMDTAZKHJNJD-RISCZKNCSA-N 2 2 303.372 3.073 20 10 DGCDLP Oc1c(F)cc(Cl)cc1C[N@@H+]1CCC[C@H]([C@H]2CC[NH2+]C2)C1 ZINC000843124629 630616312 /nfs/dbraw/zinc/61/63/12/630616312.db2.gz DQDSIGPUJYVFNU-RYUDHWBXSA-N 2 2 312.816 3.006 20 10 DGCDLP Oc1c(F)cc(Cl)cc1C[N@H+]1CCC[C@H]([C@H]2CC[NH2+]C2)C1 ZINC000843124629 630616314 /nfs/dbraw/zinc/61/63/14/630616314.db2.gz DQDSIGPUJYVFNU-RYUDHWBXSA-N 2 2 312.816 3.006 20 10 DGCDLP Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1CCC[N@@H+]2CCCC[C@@H]12 ZINC000848927644 631790906 /nfs/dbraw/zinc/79/09/06/631790906.db2.gz JOKFUSKURGAJAO-MOPGFXCFSA-N 2 2 301.478 3.168 20 10 DGCDLP Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1CCC[N@H+]2CCCC[C@@H]12 ZINC000848927644 631790913 /nfs/dbraw/zinc/79/09/13/631790913.db2.gz JOKFUSKURGAJAO-MOPGFXCFSA-N 2 2 301.478 3.168 20 10 DGCDLP CC[C@H]([NH2+][C@@H]1CC[N@H+](CC2CC2)C1)c1ccc(N(C)C)cc1 ZINC000157714600 659094110 /nfs/dbraw/zinc/09/41/10/659094110.db2.gz XFGLFFUEDXRNIC-MJGOQNOKSA-N 2 2 301.478 3.278 20 10 DGCDLP CC[C@H]([NH2+][C@@H]1CC[N@@H+](CC2CC2)C1)c1ccc(N(C)C)cc1 ZINC000157714600 659094117 /nfs/dbraw/zinc/09/41/17/659094117.db2.gz XFGLFFUEDXRNIC-MJGOQNOKSA-N 2 2 301.478 3.278 20 10 DGCDLP Oc1ccccc1C[N@H+](CCCn1cc[nH+]c1)Cc1ccco1 ZINC000182897862 660088771 /nfs/dbraw/zinc/08/87/71/660088771.db2.gz SCWDSXIYEPUCRE-UHFFFAOYSA-N 2 2 311.385 3.274 20 10 DGCDLP Oc1ccccc1C[N@@H+](CCCn1cc[nH+]c1)Cc1ccco1 ZINC000182897862 660088775 /nfs/dbraw/zinc/08/87/75/660088775.db2.gz SCWDSXIYEPUCRE-UHFFFAOYSA-N 2 2 311.385 3.274 20 10 DGCDLP [NH3+]C[C@]12C[N@H+](Cc3c(O)ccc(Cl)c3F)C[C@@H]1CCCC2 ZINC001580256857 1192016646 /nfs/dbraw/zinc/01/66/46/1192016646.db2.gz YNHAUXUQZFHCCC-MEDUHNTESA-N 2 2 312.816 3.136 20 10 DGCDLP [NH3+]C[C@]12C[N@@H+](Cc3c(O)ccc(Cl)c3F)C[C@@H]1CCCC2 ZINC001580256857 1192016649 /nfs/dbraw/zinc/01/66/49/1192016649.db2.gz YNHAUXUQZFHCCC-MEDUHNTESA-N 2 2 312.816 3.136 20 10 DGCDLP CC(C)C[N@H+](C)CCC[NH2+]Cc1cc(Cl)c(F)cc1O ZINC001665160674 1197103197 /nfs/dbraw/zinc/10/31/97/1197103197.db2.gz UPTDWPWKDGJRCN-UHFFFAOYSA-N 2 2 302.821 3.252 20 10 DGCDLP C[C@H]([NH2+]Cc1cc(F)c(F)cc1O)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC001474435231 1183921712 /nfs/dbraw/zinc/92/17/12/1183921712.db2.gz BPTWHYDWBVUBFO-QWHCGFSZSA-N 2 2 324.415 3.413 20 10 DGCDLP C[C@H]([NH2+]Cc1cc(F)c(F)cc1O)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC001474435231 1183921714 /nfs/dbraw/zinc/92/17/14/1183921714.db2.gz BPTWHYDWBVUBFO-QWHCGFSZSA-N 2 2 324.415 3.413 20 10 DGCDLP CCN(CC)c1ccc(C[NH2+][C@@H](C)Cn2cc[nH+]c2)cc1F ZINC001648779956 1195331105 /nfs/dbraw/zinc/33/11/05/1195331105.db2.gz PDZLXPAMVJXHBV-AWEZNQCLSA-N 2 2 304.413 3.047 20 10 DGCDLP Cc1cccc(NC[C@H]2CCC[N@@H+]2Cc2cccc(F)c2O)[nH+]1 ZINC001651773723 1195508024 /nfs/dbraw/zinc/50/80/24/1195508024.db2.gz PEKFMCNGEUMKDX-OAHLLOKOSA-N 2 2 315.392 3.311 20 10 DGCDLP Cc1cccc(NC[C@H]2CCC[N@H+]2Cc2cccc(F)c2O)[nH+]1 ZINC001651773723 1195508027 /nfs/dbraw/zinc/50/80/27/1195508027.db2.gz PEKFMCNGEUMKDX-OAHLLOKOSA-N 2 2 315.392 3.311 20 10 DGCDLP Oc1ccc(F)cc1C[NH2+][C@@H](Cn1cc[nH+]c1)c1ccccc1 ZINC001660570910 1196498400 /nfs/dbraw/zinc/49/84/00/1196498400.db2.gz SITTUGYXQQKOFQ-KRWDZBQOSA-N 2 2 311.360 3.259 20 10 DGCDLP CN(C)c1ccc(C[NH+]2CCC([NH+]3CCC(F)CC3)CC2)cc1 ZINC001203937925 1090844216 /nfs/dbraw/zinc/84/42/16/1090844216.db2.gz ZXJHKAGTQQNGEV-UHFFFAOYSA-N 2 2 319.468 3.151 20 10 DGCDLP CN(C)c1ccc(C[N@@H+]2C[C@H]3CCC[NH+](C)[C@@H]3C2)c2ccccc21 ZINC001204240389 1090931445 /nfs/dbraw/zinc/93/14/45/1090931445.db2.gz QXKGVIARFUIZRR-DYESRHJHSA-N 2 2 323.484 3.432 20 10 DGCDLP CN(C)c1ccc(C[N@H+]2C[C@H]3CCC[NH+](C)[C@@H]3C2)c2ccccc21 ZINC001204240389 1090931451 /nfs/dbraw/zinc/93/14/51/1090931451.db2.gz QXKGVIARFUIZRR-DYESRHJHSA-N 2 2 323.484 3.432 20 10 DGCDLP CN(C)c1ccc(C[NH+]2C[C@H]3CCC[N@H+](C)[C@@H]3C2)c2ccccc21 ZINC001204240389 1090931455 /nfs/dbraw/zinc/93/14/55/1090931455.db2.gz QXKGVIARFUIZRR-DYESRHJHSA-N 2 2 323.484 3.432 20 10 DGCDLP CN(C)c1ccc(C[NH+]2C[C@H]3CCC[N@@H+](C)[C@@H]3C2)c2ccccc21 ZINC001204240389 1090931459 /nfs/dbraw/zinc/93/14/59/1090931459.db2.gz QXKGVIARFUIZRR-DYESRHJHSA-N 2 2 323.484 3.432 20 10 DGCDLP CCCCN(CCCC)c1ccc(C[N@H+](C)CC[NH3+])c(O)c1 ZINC001204700279 1091019285 /nfs/dbraw/zinc/01/92/85/1091019285.db2.gz ZXPGACJORPNAJV-UHFFFAOYSA-N 2 2 307.482 3.189 20 10 DGCDLP CCCCN(CCCC)c1ccc(C[N@@H+](C)CC[NH3+])c(O)c1 ZINC001204700279 1091019291 /nfs/dbraw/zinc/01/92/91/1091019291.db2.gz ZXPGACJORPNAJV-UHFFFAOYSA-N 2 2 307.482 3.189 20 10 DGCDLP C[C@@H]1CC[N@H+](Cc2cc(Cl)c(Cl)cc2O)C[C@@H]1C[NH3+] ZINC001205314550 1091179856 /nfs/dbraw/zinc/17/98/56/1091179856.db2.gz BRPWNWKAFLBRRZ-KOLCDFICSA-N 2 2 303.233 3.116 20 10 DGCDLP C[C@@H]1CC[N@@H+](Cc2cc(Cl)c(Cl)cc2O)C[C@@H]1C[NH3+] ZINC001205314550 1091179860 /nfs/dbraw/zinc/17/98/60/1091179860.db2.gz BRPWNWKAFLBRRZ-KOLCDFICSA-N 2 2 303.233 3.116 20 10 DGCDLP C[C@H]1[C@H](C[NH3+])CCC[N@@H+]1Cc1cc(Cl)c(Cl)cc1O ZINC001205912748 1091407401 /nfs/dbraw/zinc/40/74/01/1091407401.db2.gz BYDKIBXPMFETHV-UWVGGRQHSA-N 2 2 303.233 3.258 20 10 DGCDLP C[C@H]1[C@H](C[NH3+])CCC[N@H+]1Cc1cc(Cl)c(Cl)cc1O ZINC001205912748 1091407412 /nfs/dbraw/zinc/40/74/12/1091407412.db2.gz BYDKIBXPMFETHV-UWVGGRQHSA-N 2 2 303.233 3.258 20 10 DGCDLP C[C@H]1[C@@H](C[NH3+])CCC[N@@H+]1Cc1c(O)ccc(Cl)c1Cl ZINC001205916173 1091411398 /nfs/dbraw/zinc/41/13/98/1091411398.db2.gz SGYMDEUOKFJRHH-VHSXEESVSA-N 2 2 303.233 3.258 20 10 DGCDLP C[C@H]1[C@@H](C[NH3+])CCC[N@H+]1Cc1c(O)ccc(Cl)c1Cl ZINC001205916173 1091411401 /nfs/dbraw/zinc/41/14/01/1091411401.db2.gz SGYMDEUOKFJRHH-VHSXEESVSA-N 2 2 303.233 3.258 20 10 DGCDLP Cc1c[nH+]ccc1O[C@@H]1CC[N@H+](Cc2c(O)cccc2Cl)C1 ZINC001140342296 1091834935 /nfs/dbraw/zinc/83/49/35/1091834935.db2.gz CFDLDMQBUGJIEW-CYBMUJFWSA-N 2 2 318.804 3.402 20 10 DGCDLP Cc1c[nH+]ccc1O[C@@H]1CC[N@@H+](Cc2c(O)cccc2Cl)C1 ZINC001140342296 1091834941 /nfs/dbraw/zinc/83/49/41/1091834941.db2.gz CFDLDMQBUGJIEW-CYBMUJFWSA-N 2 2 318.804 3.402 20 10 DGCDLP C[NH+](C)[C@@H]1CC[C@@H]2C[N@H+](Cc3cccc(Cl)c3O)C[C@@H]2C1 ZINC001336889369 1094774856 /nfs/dbraw/zinc/77/48/56/1094774856.db2.gz SQBDVQVXOBIRCF-VHDGCEQUSA-N 2 2 308.853 3.208 20 10 DGCDLP C[NH+](C)[C@@H]1CC[C@@H]2C[N@@H+](Cc3cccc(Cl)c3O)C[C@@H]2C1 ZINC001336889369 1094774862 /nfs/dbraw/zinc/77/48/62/1094774862.db2.gz SQBDVQVXOBIRCF-VHDGCEQUSA-N 2 2 308.853 3.208 20 10 DGCDLP Cc1cc(C[N@H+]2CCc3[nH+]ccn3CC2)c(C)n1-c1ccccc1 ZINC001137859099 1095769077 /nfs/dbraw/zinc/76/90/77/1095769077.db2.gz IQHQCDUPGNFQOY-UHFFFAOYSA-N 2 2 320.440 3.349 20 10 DGCDLP Cc1cc(C[N@@H+]2CCc3[nH+]ccn3CC2)c(C)n1-c1ccccc1 ZINC001137859099 1095769085 /nfs/dbraw/zinc/76/90/85/1095769085.db2.gz IQHQCDUPGNFQOY-UHFFFAOYSA-N 2 2 320.440 3.349 20 10 DGCDLP CN(C)c1ccc(C[N@@H+]2CC[C@@H]3CC[NH2+][C@@H]3C2)c2ccccc21 ZINC001235017816 1098752535 /nfs/dbraw/zinc/75/25/35/1098752535.db2.gz PKWQOBSPQLETGN-HNAYVOBHSA-N 2 2 309.457 3.090 20 10 DGCDLP CN(C)c1ccc(C[N@H+]2CC[C@@H]3CC[NH2+][C@@H]3C2)c2ccccc21 ZINC001235017816 1098752541 /nfs/dbraw/zinc/75/25/41/1098752541.db2.gz PKWQOBSPQLETGN-HNAYVOBHSA-N 2 2 309.457 3.090 20 10 DGCDLP Oc1cc(F)cc(F)c1C[NH+]1CCC([C@H]2CCCC[NH2+]2)CC1 ZINC001235226760 1098900223 /nfs/dbraw/zinc/90/02/23/1098900223.db2.gz FGRYNABBOBKFCJ-MRXNPFEDSA-N 2 2 310.388 3.025 20 10 DGCDLP CC[N@H+](CC[NH2+]C)Cc1cc(-c2ccc(F)cc2)ccc1O ZINC001236146303 1099431367 /nfs/dbraw/zinc/43/13/67/1099431367.db2.gz YNHMSDPIYUJCDI-UHFFFAOYSA-N 2 2 302.393 3.240 20 10 DGCDLP CC[N@@H+](CC[NH2+]C)Cc1cc(-c2ccc(F)cc2)ccc1O ZINC001236146303 1099431369 /nfs/dbraw/zinc/43/13/69/1099431369.db2.gz YNHMSDPIYUJCDI-UHFFFAOYSA-N 2 2 302.393 3.240 20 10 DGCDLP C[N@H+](Cc1cccc(C(F)(F)F)c1O)[C@H]1CCCC[C@@H]1[NH3+] ZINC001236214083 1099469735 /nfs/dbraw/zinc/46/97/35/1099469735.db2.gz DXIFZAYVWGMKOW-STQMWFEESA-N 2 2 302.340 3.113 20 10 DGCDLP C[N@@H+](Cc1cccc(C(F)(F)F)c1O)[C@H]1CCCC[C@@H]1[NH3+] ZINC001236214083 1099469744 /nfs/dbraw/zinc/46/97/44/1099469744.db2.gz DXIFZAYVWGMKOW-STQMWFEESA-N 2 2 302.340 3.113 20 10 DGCDLP C[C@]1(C[NH3+])CCC[N@H+](Cc2cc(Cl)c(Cl)cc2O)C1 ZINC001237083218 1099961883 /nfs/dbraw/zinc/96/18/83/1099961883.db2.gz XPLAJQZDROACPE-CQSZACIVSA-N 2 2 303.233 3.260 20 10 DGCDLP C[C@]1(C[NH3+])CCC[N@@H+](Cc2cc(Cl)c(Cl)cc2O)C1 ZINC001237083218 1099961894 /nfs/dbraw/zinc/96/18/94/1099961894.db2.gz XPLAJQZDROACPE-CQSZACIVSA-N 2 2 303.233 3.260 20 10 DGCDLP COc1cc(O)c(C[N@H+](C2CCC2)[C@@H]2CCC[NH2+]C2)cc1Cl ZINC001237155679 1100005098 /nfs/dbraw/zinc/00/50/98/1100005098.db2.gz KIYMXHCOUZTZMX-CQSZACIVSA-N 2 2 324.852 3.161 20 10 DGCDLP COc1cc(O)c(C[N@@H+](C2CCC2)[C@@H]2CCC[NH2+]C2)cc1Cl ZINC001237155679 1100005108 /nfs/dbraw/zinc/00/51/08/1100005108.db2.gz KIYMXHCOUZTZMX-CQSZACIVSA-N 2 2 324.852 3.161 20 10 DGCDLP COc1cc(Cl)cc(C[N@H+](C2CCC2)[C@@H]2CCC[NH2+]C2)c1O ZINC001237156573 1100006063 /nfs/dbraw/zinc/00/60/63/1100006063.db2.gz ONRRAGQOMMXSFE-OAHLLOKOSA-N 2 2 324.852 3.161 20 10 DGCDLP COc1cc(Cl)cc(C[N@@H+](C2CCC2)[C@@H]2CCC[NH2+]C2)c1O ZINC001237156573 1100006079 /nfs/dbraw/zinc/00/60/79/1100006079.db2.gz ONRRAGQOMMXSFE-OAHLLOKOSA-N 2 2 324.852 3.161 20 10 DGCDLP Oc1cc(Cl)c(F)cc1C[N@H+](C1CCC1)[C@@H]1CCC[NH2+]C1 ZINC001237159282 1100006903 /nfs/dbraw/zinc/00/69/03/1100006903.db2.gz ABEYPOYPHWBHCN-CYBMUJFWSA-N 2 2 312.816 3.291 20 10 DGCDLP Oc1cc(Cl)c(F)cc1C[N@@H+](C1CCC1)[C@@H]1CCC[NH2+]C1 ZINC001237159282 1100006910 /nfs/dbraw/zinc/00/69/10/1100006910.db2.gz ABEYPOYPHWBHCN-CYBMUJFWSA-N 2 2 312.816 3.291 20 10 DGCDLP CN(C)c1ccc(C[N@@H+]2Cc3ccccc3C23CC[NH2+]CC3)cc1 ZINC001237305196 1100070431 /nfs/dbraw/zinc/07/04/31/1100070431.db2.gz TVMJGBROIPOUKF-UHFFFAOYSA-N 2 2 321.468 3.347 20 10 DGCDLP CN(C)c1ccc(C[N@H+]2Cc3ccccc3C23CC[NH2+]CC3)cc1 ZINC001237305196 1100070441 /nfs/dbraw/zinc/07/04/41/1100070441.db2.gz TVMJGBROIPOUKF-UHFFFAOYSA-N 2 2 321.468 3.347 20 10 DGCDLP CN(C)c1ccc(C[N@@H+]2CCC[C@]3(CC[NH+](C)C3)C2)c(Cl)c1 ZINC001276156036 1105032986 /nfs/dbraw/zinc/03/29/86/1105032986.db2.gz MLCJFBKRVPMWII-GOSISDBHSA-N 2 2 321.896 3.324 20 10 DGCDLP CN(C)c1ccc(C[N@H+]2CCC[C@]3(CC[NH+](C)C3)C2)c(Cl)c1 ZINC001276156036 1105032993 /nfs/dbraw/zinc/03/29/93/1105032993.db2.gz MLCJFBKRVPMWII-GOSISDBHSA-N 2 2 321.896 3.324 20 10 DGCDLP CN(C)c1ccc(C[NH+]2CCC[C@]3(CC[N@H+](C)C3)C2)c(Cl)c1 ZINC001276156036 1105033000 /nfs/dbraw/zinc/03/30/00/1105033000.db2.gz MLCJFBKRVPMWII-GOSISDBHSA-N 2 2 321.896 3.324 20 10 DGCDLP CN(C)c1ccc(C[NH+]2CCC[C@]3(CC[N@@H+](C)C3)C2)c(Cl)c1 ZINC001276156036 1105033007 /nfs/dbraw/zinc/03/30/07/1105033007.db2.gz MLCJFBKRVPMWII-GOSISDBHSA-N 2 2 321.896 3.324 20 10 DGCDLP C[N@H+](Cc1ccc2c(c1O)C=CC(C)(C)O2)C1CC[NH+](C)CC1 ZINC001249224384 1105249682 /nfs/dbraw/zinc/24/96/82/1105249682.db2.gz YDMOKLLJVALBDF-UHFFFAOYSA-N 2 2 316.445 3.102 20 10 DGCDLP C[N@@H+](Cc1ccc2c(c1O)C=CC(C)(C)O2)C1CC[NH+](C)CC1 ZINC001249224384 1105249685 /nfs/dbraw/zinc/24/96/85/1105249685.db2.gz YDMOKLLJVALBDF-UHFFFAOYSA-N 2 2 316.445 3.102 20 10 DGCDLP CCN(C)c1ccc(C[NH+]2CCC([NH+](CC)CC)CC2)cc1 ZINC001322106586 1107514321 /nfs/dbraw/zinc/51/43/21/1107514321.db2.gz HDJBESIUELOZDY-UHFFFAOYSA-N 2 2 303.494 3.449 20 10 DGCDLP C[C@@H]([NH2+][C@@H](C)Cn1cc[nH+]c1)c1ccc(Br)cc1O ZINC000273301164 130105052 /nfs/dbraw/zinc/10/50/52/130105052.db2.gz BNHIOTSIZWRLKU-WDEREUQCSA-N 2 2 324.222 3.091 20 10 DGCDLP Cn1cc[nH+]c1C[C@H]1CCC[N@H+](Cc2cccc(Cl)c2O)C1 ZINC000182089946 228366145 /nfs/dbraw/zinc/36/61/45/228366145.db2.gz ZAUYFVSHZDNXQX-CYBMUJFWSA-N 2 2 319.836 3.234 20 10 DGCDLP Cn1cc[nH+]c1C[C@H]1CCC[N@@H+](Cc2cccc(Cl)c2O)C1 ZINC000182089946 228366148 /nfs/dbraw/zinc/36/61/48/228366148.db2.gz ZAUYFVSHZDNXQX-CYBMUJFWSA-N 2 2 319.836 3.234 20 10 DGCDLP C[C@@H]1CC[N@H+](Cc2cc(Cl)ccc2O)C[C@@H]1n1cc[nH+]c1 ZINC000091960336 431906102 /nfs/dbraw/zinc/90/61/02/431906102.db2.gz PZHIOQPXSALXDU-DOMZBBRYSA-N 2 2 305.809 3.325 20 10 DGCDLP C[C@@H]1CC[N@@H+](Cc2cc(Cl)ccc2O)C[C@@H]1n1cc[nH+]c1 ZINC000091960336 431906104 /nfs/dbraw/zinc/90/61/04/431906104.db2.gz PZHIOQPXSALXDU-DOMZBBRYSA-N 2 2 305.809 3.325 20 10 DGCDLP C[C@@H]1CC[N@H+](Cc2c(O)ccc(Cl)c2F)C[C@H]1n1cc[nH+]c1 ZINC000248892526 432326845 /nfs/dbraw/zinc/32/68/45/432326845.db2.gz SJPKRNAHUGEQES-BXUZGUMPSA-N 2 2 323.799 3.464 20 10 DGCDLP C[C@@H]1CC[N@@H+](Cc2c(O)ccc(Cl)c2F)C[C@H]1n1cc[nH+]c1 ZINC000248892526 432326849 /nfs/dbraw/zinc/32/68/49/432326849.db2.gz SJPKRNAHUGEQES-BXUZGUMPSA-N 2 2 323.799 3.464 20 10 DGCDLP COc1ccc(O)c([C@H](C)[NH2+]CCCCNc2cccc[nH+]2)c1 ZINC000185325488 432490939 /nfs/dbraw/zinc/49/09/39/432490939.db2.gz LTVJHIRORBUFGF-AWEZNQCLSA-N 2 2 315.417 3.339 20 10 DGCDLP C[C@@H](CC[NH+](C)C)[NH2+][C@@H](C)c1cc(Br)ccc1O ZINC000273466074 432603166 /nfs/dbraw/zinc/60/31/66/432603166.db2.gz DSVSUGPATZEJIS-QWRGUYRKSA-N 2 2 315.255 3.146 20 10 DGCDLP CC[C@@H]([NH2+]Cc1c[nH+]c2n1CCCC2)c1ccc(F)cc1O ZINC000375800454 433572060 /nfs/dbraw/zinc/57/20/60/433572060.db2.gz AQWCZNDXIJJFSY-OAHLLOKOSA-N 2 2 303.381 3.305 20 10 DGCDLP CCN(CC)c1ccc(C[NH2+]Cc2c[nH+]c3n2CCCC3)cc1 ZINC000376729129 433805031 /nfs/dbraw/zinc/80/50/31/433805031.db2.gz OHDLMZHPSVDEJC-UHFFFAOYSA-N 2 2 312.461 3.355 20 10 DGCDLP CC[C@@H]([NH2+]CCC[N@@H+]1CCCO[C@@H](C)C1)c1ccc(F)cc1O ZINC000287534718 434387138 /nfs/dbraw/zinc/38/71/38/434387138.db2.gz PCOKPDIZORSUQK-WMLDXEAASA-N 2 2 324.440 3.073 20 10 DGCDLP C[C@H]([NH2+]CCC(C)(C)[NH3+])c1cc(Br)c(F)cc1O ZINC000925738274 618591271 /nfs/dbraw/zinc/59/12/71/618591271.db2.gz PSFAWKYVZGQQLW-QMMMGPOBSA-N 2 2 319.218 3.072 20 10 DGCDLP CC[C@@H]([NH2+][C@@H]1C[C@H]2CC[C@@H]1[NH2+]2)c1ccc(C(F)(F)F)cc1O ZINC000902466827 619641972 /nfs/dbraw/zinc/64/19/72/619641972.db2.gz NJAWUNYXBFZARU-RUZUBIRVSA-N 2 2 314.351 3.345 20 10 DGCDLP C[C@@H]1CC[C@H]([NH2+]Cc2ccc(N(C)C)cc2C(F)(F)F)C[NH2+]1 ZINC000863649701 621693205 /nfs/dbraw/zinc/69/32/05/621693205.db2.gz GTTZKTFSJYQHEN-YPMHNXCESA-N 2 2 315.383 3.002 20 10 DGCDLP [NH3+]C[C@H]1C[N@H+](Cc2cccc(Cl)c2O)CC[C@H]1C(F)(F)F ZINC000863645980 621693430 /nfs/dbraw/zinc/69/34/30/621693430.db2.gz OZHJDYCLPVBECJ-WDEREUQCSA-N 2 2 322.758 3.005 20 10 DGCDLP [NH3+]C[C@H]1C[N@@H+](Cc2cccc(Cl)c2O)CC[C@H]1C(F)(F)F ZINC000863645980 621693432 /nfs/dbraw/zinc/69/34/32/621693432.db2.gz OZHJDYCLPVBECJ-WDEREUQCSA-N 2 2 322.758 3.005 20 10 DGCDLP CC(C)(C)[C@@]1(C[NH3+])CC[N@H+](Cc2cc(Cl)cc(F)c2O)C1 ZINC000873224216 623081190 /nfs/dbraw/zinc/08/11/90/623081190.db2.gz XPNYHIIOEZVVGW-MRXNPFEDSA-N 2 2 314.832 3.382 20 10 DGCDLP CC(C)(C)[C@@]1(C[NH3+])CC[N@@H+](Cc2cc(Cl)cc(F)c2O)C1 ZINC000873224216 623081194 /nfs/dbraw/zinc/08/11/94/623081194.db2.gz XPNYHIIOEZVVGW-MRXNPFEDSA-N 2 2 314.832 3.382 20 10 DGCDLP C[C@@H]([NH2+][C@@H]1CCn2cc[nH+]c2C1)c1ccc2ccccc2c1O ZINC000779061703 623725916 /nfs/dbraw/zinc/72/59/16/623725916.db2.gz MKQKFBRFEWURGK-UKRRQHHQSA-N 2 2 307.397 3.408 20 10 DGCDLP CC(C)C[N@@H+]1CCC[C@@H](C[NH2+]Cc2cc(F)cc(F)c2O)C1 ZINC000883073514 625917048 /nfs/dbraw/zinc/91/70/48/625917048.db2.gz SAGIVFQELOCCJN-ZDUSSCGKSA-N 2 2 312.404 3.128 20 10 DGCDLP CC(C)C[N@H+]1CCC[C@@H](C[NH2+]Cc2cc(F)cc(F)c2O)C1 ZINC000883073514 625917050 /nfs/dbraw/zinc/91/70/50/625917050.db2.gz SAGIVFQELOCCJN-ZDUSSCGKSA-N 2 2 312.404 3.128 20 10 DGCDLP CN(C)c1ccc(C[N@@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)cc1F ZINC000131157318 625952683 /nfs/dbraw/zinc/95/26/83/625952683.db2.gz GAPCUKCASZRROJ-KRWDZBQOSA-N 2 2 319.468 3.200 20 10 DGCDLP CN(C)c1ccc(C[N@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)cc1F ZINC000131157318 625952685 /nfs/dbraw/zinc/95/26/85/625952685.db2.gz GAPCUKCASZRROJ-KRWDZBQOSA-N 2 2 319.468 3.200 20 10 DGCDLP Cc1cc(Cl)cc([C@H](C)[NH2+][C@H]2CCc3[nH+]c[nH]c3C2)c1O ZINC000810252775 626993098 /nfs/dbraw/zinc/99/30/98/626993098.db2.gz JAGDGZACBXOBJP-JQWIXIFHSA-N 2 2 305.809 3.285 20 10 DGCDLP Cc1[nH+]ccn1C[C@H](C)C[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000816532621 627803637 /nfs/dbraw/zinc/80/36/37/627803637.db2.gz OXWQZKCTNLJVHP-SNVBAGLBSA-N 2 2 311.788 3.116 20 10 DGCDLP Cc1ccc([C@H](C)[NH2+]C[C@H]([NH3+])c2ccc(N(C)C)cc2)s1 ZINC000817939116 627967392 /nfs/dbraw/zinc/96/73/92/627967392.db2.gz ZEZGXRIWUUKZNH-BBRMVZONSA-N 2 2 303.475 3.473 20 10 DGCDLP C[C@H]([NH2+][C@@H]1CCC[NH2+]C1)c1ccc(N2CCCCCC2)cc1 ZINC000817940074 627967401 /nfs/dbraw/zinc/96/74/01/627967401.db2.gz DDSGCTXGUGVHHZ-FUHWJXTLSA-N 2 2 301.478 3.470 20 10 DGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+][C@H]2CCC[C@@H]2CCCF)cc1 ZINC000817939545 627967557 /nfs/dbraw/zinc/96/75/57/627967557.db2.gz CKPXRDZNOFFDJY-NXHRZFHOSA-N 2 2 307.457 3.260 20 10 DGCDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+][C@H]2CCc3cc(F)ccc32)cc1 ZINC000817938967 627967662 /nfs/dbraw/zinc/96/76/62/627967662.db2.gz WNRRDMUONLWSPB-OALUTQOASA-N 2 2 313.420 3.169 20 10 DGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+][C@@H]2CCC[C@H]2CCCF)cc1 ZINC000817939538 627967749 /nfs/dbraw/zinc/96/77/49/627967749.db2.gz CKPXRDZNOFFDJY-CGTJXYLNSA-N 2 2 307.457 3.260 20 10 DGCDLP Cc1ccc([C@H](C)[NH2+]C[C@@H]([NH3+])c2ccc(N(C)C)cc2)s1 ZINC000817939119 627967933 /nfs/dbraw/zinc/96/79/33/627967933.db2.gz ZEZGXRIWUUKZNH-XJKSGUPXSA-N 2 2 303.475 3.473 20 10 DGCDLP CC[C@@H]([NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1)c1ccccc1O ZINC000817942303 627968631 /nfs/dbraw/zinc/96/86/31/627968631.db2.gz NZNYXLPMOJJQBB-QZTJIDSGSA-N 2 2 313.445 3.199 20 10 DGCDLP CC[C@H]([NH2+][C@@H]1CCC[NH2+]C1)c1ccc(C(F)(F)F)cc1O ZINC000817941896 627968768 /nfs/dbraw/zinc/96/87/68/627968768.db2.gz SVYIAVYWXXFMHL-YPMHNXCESA-N 2 2 302.340 3.204 20 10 DGCDLP C[C@@H]([NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1)c1ccc(Cl)nc1 ZINC000817944301 627970074 /nfs/dbraw/zinc/97/00/74/627970074.db2.gz ZASUBBGCJZSUED-MLGOLLRUSA-N 2 2 318.852 3.152 20 10 DGCDLP C[C@H]([NH2+]C[C@@H]1CCC[NH2+]1)c1ccc(N2CCCCC2)c(F)c1 ZINC000817952802 627972719 /nfs/dbraw/zinc/97/27/19/627972719.db2.gz SUHLOQFKPPKBLB-HOCLYGCPSA-N 2 2 305.441 3.219 20 10 DGCDLP C[C@H]([NH2+]C[C@H]1CCC[NH2+]1)c1ccc(N2CCCCC2)c(F)c1 ZINC000817952801 627972823 /nfs/dbraw/zinc/97/28/23/627972823.db2.gz SUHLOQFKPPKBLB-GOEBONIOSA-N 2 2 305.441 3.219 20 10 DGCDLP CC(C)C[C@@H](C[NH3+])[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O ZINC000817959890 627975964 /nfs/dbraw/zinc/97/59/64/627975964.db2.gz WHVKONDROZCXQH-QWRGUYRKSA-N 2 2 304.356 3.435 20 10 DGCDLP C[C@@H]([NH2+][C@H]1CCCC[NH2+]C1)c1ccc(N2CCCCC2)cc1 ZINC000817983507 627983627 /nfs/dbraw/zinc/98/36/27/627983627.db2.gz FPJVKDWWVBFBLY-AEFFLSMTSA-N 2 2 301.478 3.470 20 10 DGCDLP Cc1cc(O)c(C[NH2+]CCCNc2cccc[nH+]2)cc1Cl ZINC000825430100 628760250 /nfs/dbraw/zinc/76/02/50/628760250.db2.gz SKKUOPNZGMVCBQ-UHFFFAOYSA-N 2 2 305.809 3.341 20 10 DGCDLP CC(C)[NH2+]C1CC[NH+](C/C=C/c2ccc(N(C)C)cc2)CC1 ZINC000835027710 629828981 /nfs/dbraw/zinc/82/89/81/629828981.db2.gz NSDXYOKNXUZVFI-AATRIKPKSA-N 2 2 301.478 3.228 20 10 DGCDLP Cc1cc(N(C)C)ccc1C[NH2+][C@@H](Cn1cc[nH+]c1)C(C)(C)C ZINC000840929926 630379493 /nfs/dbraw/zinc/37/94/93/630379493.db2.gz QOZNPPSKSIQWKB-SFHVURJKSA-N 2 2 314.477 3.462 20 10 DGCDLP COc1ccc(O)c(C[NH2+]C[C@H]([NH3+])c2ccc(C(C)C)cc2)c1 ZINC000841038566 630399947 /nfs/dbraw/zinc/39/99/47/630399947.db2.gz YOWUJYRMVQTYRY-SFHVURJKSA-N 2 2 314.429 3.314 20 10 DGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+]Cc2ccccc2C2CC2)cc1 ZINC000841044661 630400948 /nfs/dbraw/zinc/40/09/48/630400948.db2.gz DZOWQIYQHKNBHW-HXUWFJFHSA-N 2 2 309.457 3.420 20 10 DGCDLP C[C@@H](CCC(F)(F)F)[NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000841044983 630401010 /nfs/dbraw/zinc/40/10/10/630401010.db2.gz HEKMDTAZKHJNJD-SMDDNHRTSA-N 2 2 303.372 3.073 20 10 DGCDLP Cc1cc(C[NH2+]C[C@@H]([NH3+])c2ccc(N(C)C)cc2)c(C)s1 ZINC000841044919 630401237 /nfs/dbraw/zinc/40/12/37/630401237.db2.gz FYBDQAIPSWXVDM-QGZVFWFLSA-N 2 2 303.475 3.221 20 10 DGCDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+]CC(C)(C)c2ccccc2)cc1 ZINC000841044970 630401463 /nfs/dbraw/zinc/40/14/63/630401463.db2.gz HCAZYGAUFCDAIL-IBGZPJMESA-N 2 2 311.473 3.320 20 10 DGCDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+]Cc2coc3ccccc23)cc1 ZINC000841045681 630401913 /nfs/dbraw/zinc/40/19/13/630401913.db2.gz ODXFQXLGTRRPHH-SFHVURJKSA-N 2 2 309.413 3.288 20 10 DGCDLP C[C@H](Cc1ccc(F)cc1)[NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000841045775 630401983 /nfs/dbraw/zinc/40/19/83/630401983.db2.gz PTTBVVGXQIRPRI-AUUYWEPGSA-N 2 2 315.436 3.112 20 10 DGCDLP Cc1cc(O)c(C[NH+]2CCC([NH2+]CC3CC3)CC2)c(Cl)c1 ZINC000843054602 630609362 /nfs/dbraw/zinc/60/93/62/630609362.db2.gz WBJACSURPFFTKZ-UHFFFAOYSA-N 2 2 308.853 3.318 20 10 DGCDLP Oc1c(F)cc(Cl)cc1C[N@@H+]1CCC[C@@H]([C@@H]2CC[NH2+]C2)C1 ZINC000843124631 630616336 /nfs/dbraw/zinc/61/63/36/630616336.db2.gz DQDSIGPUJYVFNU-VXGBXAGGSA-N 2 2 312.816 3.006 20 10 DGCDLP Oc1c(F)cc(Cl)cc1C[N@H+]1CCC[C@@H]([C@@H]2CC[NH2+]C2)C1 ZINC000843124631 630616338 /nfs/dbraw/zinc/61/63/38/630616338.db2.gz DQDSIGPUJYVFNU-VXGBXAGGSA-N 2 2 312.816 3.006 20 10 DGCDLP COc1cccc([C@H](C)[NH2+]CCCCNc2cccc[nH+]2)c1O ZINC000846143763 631211915 /nfs/dbraw/zinc/21/19/15/631211915.db2.gz HHFTVXWREBXZBR-AWEZNQCLSA-N 2 2 315.417 3.339 20 10 DGCDLP COc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCC[N@@H+]3CCCC[C@H]23)c1 ZINC000848568355 631697047 /nfs/dbraw/zinc/69/70/47/631697047.db2.gz GORKFSLGNMHBTB-IAOVAPTHSA-N 2 2 304.434 3.068 20 10 DGCDLP COc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCC[N@H+]3CCCC[C@H]23)c1 ZINC000848568355 631697050 /nfs/dbraw/zinc/69/70/50/631697050.db2.gz GORKFSLGNMHBTB-IAOVAPTHSA-N 2 2 304.434 3.068 20 10 DGCDLP COc1cc(C[NH2+]CCCn2cc[nH+]c2)c(O)c(C(C)(C)C)c1 ZINC000850006252 632026993 /nfs/dbraw/zinc/02/69/93/632026993.db2.gz QHZQXTCBLMKGPK-UHFFFAOYSA-N 2 2 317.433 3.075 20 10 DGCDLP CCC[NH+](CCC)CCC[NH2+]Cc1cc(F)cc(F)c1O ZINC001473909299 1183825698 /nfs/dbraw/zinc/82/56/98/1183825698.db2.gz XLMWRLNTNHOXDU-UHFFFAOYSA-N 2 2 300.393 3.272 20 10 DGCDLP Cc1cc(N(C)C)ccc1C[NH2+]C[C@H]1CCCC[N@@H+]1C1CC1 ZINC001621310151 1193828996 /nfs/dbraw/zinc/82/89/96/1193828996.db2.gz HBKHLSLLNASKBF-LJQANCHMSA-N 2 2 301.478 3.168 20 10 DGCDLP Cc1cc(N(C)C)ccc1C[NH2+]C[C@H]1CCCC[N@H+]1C1CC1 ZINC001621310151 1193828997 /nfs/dbraw/zinc/82/89/97/1193828997.db2.gz HBKHLSLLNASKBF-LJQANCHMSA-N 2 2 301.478 3.168 20 10 DGCDLP Cc1cc(N(C)C)ccc1C[NH2+]C[C@@H]1CCCC[N@@H+]1C1CC1 ZINC001621310150 1193829603 /nfs/dbraw/zinc/82/96/03/1193829603.db2.gz HBKHLSLLNASKBF-IBGZPJMESA-N 2 2 301.478 3.168 20 10 DGCDLP Cc1cc(N(C)C)ccc1C[NH2+]C[C@@H]1CCCC[N@H+]1C1CC1 ZINC001621310150 1193829605 /nfs/dbraw/zinc/82/96/05/1193829605.db2.gz HBKHLSLLNASKBF-IBGZPJMESA-N 2 2 301.478 3.168 20 10 DGCDLP CC[NH+](CC)CC[C@@H](C)[NH2+]Cc1c(O)ccc(Cl)c1F ZINC001651705781 1195498839 /nfs/dbraw/zinc/49/88/39/1195498839.db2.gz BXUIFSPDBWGAII-LLVKDONJSA-N 2 2 302.821 3.395 20 10 DGCDLP CCC[N@H+]1C[C@@H]2C[NH+](Cc3ccc(N(C)C)cc3Cl)C[C@@H]2C1 ZINC001140926544 1092067617 /nfs/dbraw/zinc/06/76/17/1092067617.db2.gz NHKQKNODJCUIKB-IYBDPMFKSA-N 2 2 321.896 3.180 20 10 DGCDLP CCC[N@@H+]1C[C@@H]2C[NH+](Cc3ccc(N(C)C)cc3Cl)C[C@@H]2C1 ZINC001140926544 1092067625 /nfs/dbraw/zinc/06/76/25/1092067625.db2.gz NHKQKNODJCUIKB-IYBDPMFKSA-N 2 2 321.896 3.180 20 10 DGCDLP CCC[NH+]1C[C@@H]2C[N@@H+](Cc3ccc(N(C)C)cc3Cl)C[C@@H]2C1 ZINC001140926544 1092067632 /nfs/dbraw/zinc/06/76/32/1092067632.db2.gz NHKQKNODJCUIKB-IYBDPMFKSA-N 2 2 321.896 3.180 20 10 DGCDLP CCC[NH+]1C[C@@H]2C[N@H+](Cc3ccc(N(C)C)cc3Cl)C[C@@H]2C1 ZINC001140926544 1092067641 /nfs/dbraw/zinc/06/76/41/1092067641.db2.gz NHKQKNODJCUIKB-IYBDPMFKSA-N 2 2 321.896 3.180 20 10 DGCDLP CC[N@H+](CCn1cc[nH+]c1)Cc1cccc(C(C)(C)C)c1O ZINC001143116784 1092618209 /nfs/dbraw/zinc/61/82/09/1092618209.db2.gz KWTHGNQGJJLADR-UHFFFAOYSA-N 2 2 301.434 3.408 20 10 DGCDLP CC[N@@H+](CCn1cc[nH+]c1)Cc1cccc(C(C)(C)C)c1O ZINC001143116784 1092618215 /nfs/dbraw/zinc/61/82/15/1092618215.db2.gz KWTHGNQGJJLADR-UHFFFAOYSA-N 2 2 301.434 3.408 20 10 DGCDLP CN(C)c1ccc(C[N@@H+]2CC[C@@]23CCC[NH2+]C3)c2ccccc21 ZINC001222191626 1095484616 /nfs/dbraw/zinc/48/46/16/1095484616.db2.gz NYXLSJPRCGPQPP-HXUWFJFHSA-N 2 2 309.457 3.234 20 10 DGCDLP CN(C)c1ccc(C[N@H+]2CC[C@@]23CCC[NH2+]C3)c2ccccc21 ZINC001222191626 1095484625 /nfs/dbraw/zinc/48/46/25/1095484625.db2.gz NYXLSJPRCGPQPP-HXUWFJFHSA-N 2 2 309.457 3.234 20 10 DGCDLP Oc1cc(Cl)c(F)cc1C[N@@H+]1CCC[C@@]12CCC[NH2+]CC2 ZINC001222320355 1095549899 /nfs/dbraw/zinc/54/98/99/1095549899.db2.gz HDLBVQWEDRJQTA-MRXNPFEDSA-N 2 2 312.816 3.293 20 10 DGCDLP Oc1cc(Cl)c(F)cc1C[N@H+]1CCC[C@@]12CCC[NH2+]CC2 ZINC001222320355 1095549907 /nfs/dbraw/zinc/54/99/07/1095549907.db2.gz HDLBVQWEDRJQTA-MRXNPFEDSA-N 2 2 312.816 3.293 20 10 DGCDLP Oc1c(F)cc(Cl)cc1C[N@@H+]1CCC[C@@]12CCC[NH2+]CC2 ZINC001222320763 1095550356 /nfs/dbraw/zinc/55/03/56/1095550356.db2.gz MSJNKVOGHHEIHG-MRXNPFEDSA-N 2 2 312.816 3.293 20 10 DGCDLP Oc1c(F)cc(Cl)cc1C[N@H+]1CCC[C@@]12CCC[NH2+]CC2 ZINC001222320763 1095550366 /nfs/dbraw/zinc/55/03/66/1095550366.db2.gz MSJNKVOGHHEIHG-MRXNPFEDSA-N 2 2 312.816 3.293 20 10 DGCDLP CN(C)c1ccc(C[N@@H+]2CC[C@]3(CCC[NH2+]3)C2)c2ccccc21 ZINC001222471781 1095632226 /nfs/dbraw/zinc/63/22/26/1095632226.db2.gz XWXFISQGCKQSPZ-HXUWFJFHSA-N 2 2 309.457 3.234 20 10 DGCDLP CN(C)c1ccc(C[N@H+]2CC[C@]3(CCC[NH2+]3)C2)c2ccccc21 ZINC001222471781 1095632229 /nfs/dbraw/zinc/63/22/29/1095632229.db2.gz XWXFISQGCKQSPZ-HXUWFJFHSA-N 2 2 309.457 3.234 20 10 DGCDLP Cc1cc(C)c(C[N@@H+]2CC[C@@H](Oc3cc[nH+]cc3C)C2)c(O)c1 ZINC001231850448 1097863266 /nfs/dbraw/zinc/86/32/66/1097863266.db2.gz PUILUCKBQRCBFP-MRXNPFEDSA-N 2 2 312.413 3.366 20 10 DGCDLP Cc1cc(C)c(C[N@H+]2CC[C@@H](Oc3cc[nH+]cc3C)C2)c(O)c1 ZINC001231850448 1097863274 /nfs/dbraw/zinc/86/32/74/1097863274.db2.gz PUILUCKBQRCBFP-MRXNPFEDSA-N 2 2 312.413 3.366 20 10 DGCDLP Oc1c(F)cc(Cl)cc1C[NH+]1CCC2(CC[NH2+]CC2)CC1 ZINC001235132244 1098827617 /nfs/dbraw/zinc/82/76/17/1098827617.db2.gz HYKMMEKLKYHXNY-UHFFFAOYSA-N 2 2 312.816 3.150 20 10 DGCDLP CC(C)[N@H+](CC[NH3+])Cc1cc(-c2ccc(F)cc2)ccc1O ZINC001235948129 1099281671 /nfs/dbraw/zinc/28/16/71/1099281671.db2.gz UPIFPWAMPJQVNE-UHFFFAOYSA-N 2 2 302.393 3.367 20 10 DGCDLP CC(C)[N@@H+](CC[NH3+])Cc1cc(-c2ccc(F)cc2)ccc1O ZINC001235948129 1099281675 /nfs/dbraw/zinc/28/16/75/1099281675.db2.gz UPIFPWAMPJQVNE-UHFFFAOYSA-N 2 2 302.393 3.367 20 10 DGCDLP Oc1ccc(C(F)(F)F)cc1C[N@H+](C1CC1)[C@H]1CCC[NH2+]C1 ZINC001236238918 1099491759 /nfs/dbraw/zinc/49/17/59/1099491759.db2.gz DPCRWCCHUXLSAV-AWEZNQCLSA-N 2 2 314.351 3.127 20 10 DGCDLP Oc1ccc(C(F)(F)F)cc1C[N@@H+](C1CC1)[C@H]1CCC[NH2+]C1 ZINC001236238918 1099491764 /nfs/dbraw/zinc/49/17/64/1099491764.db2.gz DPCRWCCHUXLSAV-AWEZNQCLSA-N 2 2 314.351 3.127 20 10 DGCDLP Oc1cc(F)c(F)cc1C[N@H+](C[C@@H]1CCC[NH2+]C1)C1CCCC1 ZINC001236376965 1099562944 /nfs/dbraw/zinc/56/29/44/1099562944.db2.gz WUFOFZWJYDNZIS-CYBMUJFWSA-N 2 2 324.415 3.415 20 10 DGCDLP Oc1cc(F)c(F)cc1C[N@@H+](C[C@@H]1CCC[NH2+]C1)C1CCCC1 ZINC001236376965 1099562953 /nfs/dbraw/zinc/56/29/53/1099562953.db2.gz WUFOFZWJYDNZIS-CYBMUJFWSA-N 2 2 324.415 3.415 20 10 DGCDLP COc1cc(C)c(C[N@@H+](C(C)C)C2CC[NH+](C)CC2)c(O)c1 ZINC001236815758 1099802751 /nfs/dbraw/zinc/80/27/51/1099802751.db2.gz NYJUOSGXCGMLBJ-UHFFFAOYSA-N 2 2 306.450 3.014 20 10 DGCDLP CCOc1ccc(C[N@H+](C(C)C)C2CC[NH+](C)CC2)c(O)c1 ZINC001237046464 1099941506 /nfs/dbraw/zinc/94/15/06/1099941506.db2.gz CHSRJVKBUINIEY-UHFFFAOYSA-N 2 2 306.450 3.096 20 10 DGCDLP CCOc1ccc(C[N@@H+](C(C)C)C2CC[NH+](C)CC2)c(O)c1 ZINC001237046464 1099941513 /nfs/dbraw/zinc/94/15/13/1099941513.db2.gz CHSRJVKBUINIEY-UHFFFAOYSA-N 2 2 306.450 3.096 20 10 DGCDLP C[NH+]1CCC2(CC[N@H+](Cc3cc(F)cc(Cl)c3O)C2)CC1 ZINC001237804916 1100251730 /nfs/dbraw/zinc/25/17/30/1100251730.db2.gz HXLDLAKFTKAKRL-UHFFFAOYSA-N 2 2 312.816 3.102 20 10 DGCDLP C[NH+]1CCC2(CC[N@@H+](Cc3cc(F)cc(Cl)c3O)C2)CC1 ZINC001237804916 1100251736 /nfs/dbraw/zinc/25/17/36/1100251736.db2.gz HXLDLAKFTKAKRL-UHFFFAOYSA-N 2 2 312.816 3.102 20 10 DGCDLP C[NH+](C)C1CC[NH+](Cc2ccc3c(c2O)C=CC(C)(C)O3)CC1 ZINC001249223642 1105249467 /nfs/dbraw/zinc/24/94/67/1105249467.db2.gz KTMVZOQBIQOCBP-UHFFFAOYSA-N 2 2 316.445 3.102 20 10 DGCDLP Oc1ccc(Cl)cc1C[N@@H+]1CC[C@@H](Oc2cc[nH+]cc2)C1 ZINC000093865935 400258528 /nfs/dbraw/zinc/25/85/28/400258528.db2.gz VNHMHHVJBQAFQB-OAHLLOKOSA-N 2 2 304.777 3.094 20 10 DGCDLP Oc1ccc(Cl)cc1C[N@H+]1CC[C@@H](Oc2cc[nH+]cc2)C1 ZINC000093865935 400258533 /nfs/dbraw/zinc/25/85/33/400258533.db2.gz VNHMHHVJBQAFQB-OAHLLOKOSA-N 2 2 304.777 3.094 20 10 DGCDLP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@@H](C)c2ccccc2O)cn1 ZINC000183433354 228374100 /nfs/dbraw/zinc/37/41/00/228374100.db2.gz AMLSAXMKJYXMCG-ZDUSSCGKSA-N 2 2 308.385 3.132 20 10 DGCDLP Cc1cc(C[N@H+]2CC[C@@H](C)[C@@H](n3cc[nH+]c3)C2)ccc1N(C)C ZINC000293815575 433878250 /nfs/dbraw/zinc/87/82/50/433878250.db2.gz ONVSRODZTSLWJH-BEFAXECRSA-N 2 2 312.461 3.341 20 10 DGCDLP Cc1cc(C[N@@H+]2CC[C@@H](C)[C@@H](n3cc[nH+]c3)C2)ccc1N(C)C ZINC000293815575 433878258 /nfs/dbraw/zinc/87/82/58/433878258.db2.gz ONVSRODZTSLWJH-BEFAXECRSA-N 2 2 312.461 3.341 20 10 DGCDLP Cn1cc[nH+]c1[C@H]1CC[N@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000377891012 434029417 /nfs/dbraw/zinc/02/94/17/434029417.db2.gz ZTDZMPWYAPZYIL-SFHVURJKSA-N 2 2 324.472 3.400 20 10 DGCDLP Cn1cc[nH+]c1[C@H]1CC[N@@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000377891012 434029421 /nfs/dbraw/zinc/02/94/21/434029421.db2.gz ZTDZMPWYAPZYIL-SFHVURJKSA-N 2 2 324.472 3.400 20 10 DGCDLP Oc1cccc2c1[C@@H]([NH2+]CCCc1[nH]c3ccccc3[nH+]1)CC2 ZINC000296161354 434529628 /nfs/dbraw/zinc/52/96/28/434529628.db2.gz XHYOWXBUHPZOQT-INIZCTEOSA-N 2 2 307.397 3.478 20 10 DGCDLP Cc1ccc([C@H](C)[NH2+]CCc2cn3c([nH+]2)CCCC3)c(O)c1C ZINC000368477327 434574932 /nfs/dbraw/zinc/57/49/32/434574932.db2.gz FQFKSRLZPMPEOX-HNNXBMFYSA-N 2 2 313.445 3.435 20 10 DGCDLP C[C@@H](C[NH2+]Cc1cc(Cl)cc(Cl)c1O)Cn1cc[nH+]c1 ZINC000237355897 524740677 /nfs/dbraw/zinc/74/06/77/524740677.db2.gz DKAKBZKBGUAUEN-JTQLQIEISA-N 2 2 314.216 3.321 20 10 DGCDLP Oc1c(Cl)cccc1C[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000180766104 526326761 /nfs/dbraw/zinc/32/67/61/526326761.db2.gz FFESWHLGOBAHRX-DYVFJYSZSA-N 2 2 320.864 3.494 20 10 DGCDLP Oc1c(Cl)cccc1C[N@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000180766104 526326768 /nfs/dbraw/zinc/32/67/68/526326768.db2.gz FFESWHLGOBAHRX-DYVFJYSZSA-N 2 2 320.864 3.494 20 10 DGCDLP Oc1c(Cl)cccc1C[NH+]1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000180766104 526326773 /nfs/dbraw/zinc/32/67/73/526326773.db2.gz FFESWHLGOBAHRX-DYVFJYSZSA-N 2 2 320.864 3.494 20 10 DGCDLP Oc1c(Cl)cccc1C[NH+]1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000180766104 526326776 /nfs/dbraw/zinc/32/67/76/526326776.db2.gz FFESWHLGOBAHRX-DYVFJYSZSA-N 2 2 320.864 3.494 20 10 DGCDLP CC[N@H+](C)C[C@@H]1CC[NH+](Cc2cc(Cl)cc(C(C)=O)c2O)C1 ZINC000177356056 527816889 /nfs/dbraw/zinc/81/68/89/527816889.db2.gz NSHRFKJBSAKXAX-ZDUSSCGKSA-N 2 2 324.852 3.022 20 10 DGCDLP CC[N@@H+](C)C[C@@H]1CC[NH+](Cc2cc(Cl)cc(C(C)=O)c2O)C1 ZINC000177356056 527816893 /nfs/dbraw/zinc/81/68/93/527816893.db2.gz NSHRFKJBSAKXAX-ZDUSSCGKSA-N 2 2 324.852 3.022 20 10 DGCDLP CC[NH+](C)C[C@@H]1CC[N@H+](Cc2cc(Cl)cc(C(C)=O)c2O)C1 ZINC000177356056 527816897 /nfs/dbraw/zinc/81/68/97/527816897.db2.gz NSHRFKJBSAKXAX-ZDUSSCGKSA-N 2 2 324.852 3.022 20 10 DGCDLP CC[NH+](C)C[C@@H]1CC[N@@H+](Cc2cc(Cl)cc(C(C)=O)c2O)C1 ZINC000177356056 527816900 /nfs/dbraw/zinc/81/69/00/527816900.db2.gz NSHRFKJBSAKXAX-ZDUSSCGKSA-N 2 2 324.852 3.022 20 10 DGCDLP CC[C@@H]([NH2+]C[C@@H](C)Cn1cc[nH+]c1C)c1ccc(F)cc1O ZINC000286277443 535804464 /nfs/dbraw/zinc/80/44/64/535804464.db2.gz VPBYOVMTPDWHKJ-MLGOLLRUSA-N 2 2 305.397 3.413 20 10 DGCDLP CCN(CC)c1ccc(C[NH2+]C[C@@H]2CCC[N@@H+]2CC)cc1F ZINC000740001989 574917861 /nfs/dbraw/zinc/91/78/61/574917861.db2.gz KUQMBTJKDGXBEV-INIZCTEOSA-N 2 2 307.457 3.246 20 10 DGCDLP CCN(CC)c1ccc(C[NH2+]C[C@@H]2CCC[N@H+]2CC)cc1F ZINC000740001989 574917862 /nfs/dbraw/zinc/91/78/62/574917862.db2.gz KUQMBTJKDGXBEV-INIZCTEOSA-N 2 2 307.457 3.246 20 10 DGCDLP CN(C)c1ccc(/C=C/C[NH+]2CCC(C)([NH+]3CCC3)CC2)cc1 ZINC000895670269 618815786 /nfs/dbraw/zinc/81/57/86/618815786.db2.gz DMTFXYPSNAYFAK-GQCTYLIASA-N 2 2 313.489 3.326 20 10 DGCDLP CCOCc1cc(C[NH2+]C[C@@H]([NH3+])c2ccccc2)ccc1OC ZINC000841035564 619172834 /nfs/dbraw/zinc/17/28/34/619172834.db2.gz IFRNCYPVVSBNGM-GOSISDBHSA-N 2 2 314.429 3.021 20 10 DGCDLP CCO[C@H](C[NH2+][C@@H](CC)c1cc(Cl)ccc1O)C[NH+](C)C ZINC000926959542 619252614 /nfs/dbraw/zinc/25/26/14/619252614.db2.gz JRQQXARSCDCGCF-HIFRSBDPSA-N 2 2 314.857 3.053 20 10 DGCDLP Cc1ccc([C@@H](C)[NH2+][C@H](CC[NH+](C)C)c2cccnc2)c(O)c1 ZINC000903379398 619768119 /nfs/dbraw/zinc/76/81/19/619768119.db2.gz GLAKDISMNUEMAK-CRAIPNDOSA-N 2 2 313.445 3.439 20 10 DGCDLP CN(C)c1cc(F)c(C[N@H+](C)C2C[C@H]3CC[C@@H](C2)[NH+]3C)cc1F ZINC000862364998 621578819 /nfs/dbraw/zinc/57/88/19/621578819.db2.gz JRGCPWVZLYGESD-YIONKMFJSA-N 2 2 323.431 3.088 20 10 DGCDLP CN(C)c1cc(F)c(C[N@@H+](C)C2C[C@H]3CC[C@@H](C2)[NH+]3C)cc1F ZINC000862364998 621578822 /nfs/dbraw/zinc/57/88/22/621578822.db2.gz JRGCPWVZLYGESD-YIONKMFJSA-N 2 2 323.431 3.088 20 10 DGCDLP CN(C)c1cc(F)c(C[NH+](C)C2C[C@H]3CC[C@@H](C2)[N@H+]3C)cc1F ZINC000862364998 621578824 /nfs/dbraw/zinc/57/88/24/621578824.db2.gz JRGCPWVZLYGESD-YIONKMFJSA-N 2 2 323.431 3.088 20 10 DGCDLP CN(C)c1cc(F)c(C[NH+](C)C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1F ZINC000862364998 621578827 /nfs/dbraw/zinc/57/88/27/621578827.db2.gz JRGCPWVZLYGESD-YIONKMFJSA-N 2 2 323.431 3.088 20 10 DGCDLP C[N@@H+]1CCCC[C@H](C[NH2+]Cc2cc(Cl)cc(F)c2O)C1 ZINC000862483040 621594349 /nfs/dbraw/zinc/59/43/49/621594349.db2.gz NWPRVKASDNXRRB-LLVKDONJSA-N 2 2 300.805 3.006 20 10 DGCDLP C[N@H+]1CCCC[C@H](C[NH2+]Cc2cc(Cl)cc(F)c2O)C1 ZINC000862483040 621594350 /nfs/dbraw/zinc/59/43/50/621594350.db2.gz NWPRVKASDNXRRB-LLVKDONJSA-N 2 2 300.805 3.006 20 10 DGCDLP C[C@H]([NH2+]CC[C@H]([NH3+])Cc1ccccc1)c1cc(F)cc(F)c1O ZINC000873235261 623086220 /nfs/dbraw/zinc/08/62/20/623086220.db2.gz MXXLIQPANHCAPB-WFASDCNBSA-N 2 2 320.383 3.281 20 10 DGCDLP Oc1ccc(-c2ccccc2)cc1C[NH2+][C@@H]1CCn2cc[nH+]c2C1 ZINC000778188743 623622254 /nfs/dbraw/zinc/62/22/54/623622254.db2.gz INGMDFADSUHGQH-GOSISDBHSA-N 2 2 319.408 3.360 20 10 DGCDLP C[C@@H]([NH2+][C@H]1CCn2cc[nH+]c2C1)c1ccc2ccccc2c1O ZINC000779061702 623725891 /nfs/dbraw/zinc/72/58/91/623725891.db2.gz MKQKFBRFEWURGK-HIFRSBDPSA-N 2 2 307.397 3.408 20 10 DGCDLP C[C@@H]([NH2+]Cc1cc(F)cc(F)c1O)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000883085167 625921983 /nfs/dbraw/zinc/92/19/83/625921983.db2.gz KGOKKKSHFVCPSP-OLZOCXBDSA-N 2 2 324.415 3.413 20 10 DGCDLP C[C@@H]([NH2+]Cc1cc(F)cc(F)c1O)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000883085167 625921988 /nfs/dbraw/zinc/92/19/88/625921988.db2.gz KGOKKKSHFVCPSP-OLZOCXBDSA-N 2 2 324.415 3.413 20 10 DGCDLP C[N@H+](CC[C@@H]1CCCC[NH+]1C)Cc1cc(Cl)c(F)cc1O ZINC000816514710 627800605 /nfs/dbraw/zinc/80/06/05/627800605.db2.gz FTKPBAINXSRUMO-ZDUSSCGKSA-N 2 2 314.832 3.491 20 10 DGCDLP C[N@@H+](CC[C@@H]1CCCC[NH+]1C)Cc1cc(Cl)c(F)cc1O ZINC000816514710 627800609 /nfs/dbraw/zinc/80/06/09/627800609.db2.gz FTKPBAINXSRUMO-ZDUSSCGKSA-N 2 2 314.832 3.491 20 10 DGCDLP C[NH+](CC[C@@H]1CCCC[N@@H+]1C)Cc1cc(Cl)c(F)cc1O ZINC000816514710 627800612 /nfs/dbraw/zinc/80/06/12/627800612.db2.gz FTKPBAINXSRUMO-ZDUSSCGKSA-N 2 2 314.832 3.491 20 10 DGCDLP C[NH+](CC[C@@H]1CCCC[N@H+]1C)Cc1cc(Cl)c(F)cc1O ZINC000816514710 627800616 /nfs/dbraw/zinc/80/06/16/627800616.db2.gz FTKPBAINXSRUMO-ZDUSSCGKSA-N 2 2 314.832 3.491 20 10 DGCDLP Oc1cc(F)c(Cl)cc1C[NH2+]CCC[NH+]1CCCCC1 ZINC000816530669 627803552 /nfs/dbraw/zinc/80/35/52/627803552.db2.gz QBZSVMYAMSWLCM-UHFFFAOYSA-N 2 2 300.805 3.150 20 10 DGCDLP C[C@@H](C[NH2+]Cc1cc(Cl)c(F)cc1O)C[NH+]1CCCC1 ZINC000816536444 627804161 /nfs/dbraw/zinc/80/41/61/627804161.db2.gz XVXXOJLKGWSXMW-NSHDSACASA-N 2 2 300.805 3.006 20 10 DGCDLP C[NH+]1CCC2(CCC[N@H+]2Cc2cc(Cl)c(F)cc2O)CC1 ZINC000816583478 627811444 /nfs/dbraw/zinc/81/14/44/627811444.db2.gz LRNUEVAJNGIHII-UHFFFAOYSA-N 2 2 312.816 3.245 20 10 DGCDLP C[C@@H]([NH2+]Cc1ccc(N2CCC(C)CC2)cc1)[C@@H]1CCC[NH2+]1 ZINC000817902524 627956893 /nfs/dbraw/zinc/95/68/93/627956893.db2.gz SKKMUDPIIZVUAM-APWZRJJASA-N 2 2 301.478 3.153 20 10 DGCDLP Cc1cccc2c1CC[C@@H]2[NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000817938382 627966400 /nfs/dbraw/zinc/96/64/00/627966400.db2.gz JQZDRKURRBBHRH-UXHICEINSA-N 2 2 309.457 3.338 20 10 DGCDLP Cc1ccc2c(c1)[C@H]([NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1)CC2 ZINC000817938030 627966480 /nfs/dbraw/zinc/96/64/80/627966480.db2.gz BRQWZFFBYHFRBP-VQTJNVASSA-N 2 2 309.457 3.338 20 10 DGCDLP COc1ccc([C@H](C)[NH2+]C[C@@H]([NH3+])c2ccc(N(C)C)cc2)cc1 ZINC000817938360 627966652 /nfs/dbraw/zinc/96/66/52/627966652.db2.gz JKJVGUQYRRGWMK-IFXJQAMLSA-N 2 2 313.445 3.112 20 10 DGCDLP C[C@H]([NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1)c1ccnc(Cl)c1 ZINC000817939890 627967355 /nfs/dbraw/zinc/96/73/55/627967355.db2.gz CZZLFMAMADQPMA-BLLLJJGKSA-N 2 2 318.852 3.152 20 10 DGCDLP Cc1ccsc1[C@H](C)[NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000817938952 627967529 /nfs/dbraw/zinc/96/75/29/627967529.db2.gz WFFPNQSMCIZVLV-BBRMVZONSA-N 2 2 303.475 3.473 20 10 DGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+]C2CCC(C(F)F)CC2)cc1 ZINC000817939864 627967799 /nfs/dbraw/zinc/96/77/99/627967799.db2.gz CTEOXDREYURWGN-ZBCRRDGASA-N 2 2 311.420 3.166 20 10 DGCDLP C[C@H]([NH2+]CCC[NH2+]Cc1cccnc1)c1cc(Cl)ccc1O ZINC000817941311 627968517 /nfs/dbraw/zinc/96/85/17/627968517.db2.gz RZPURIDVKJTJFP-ZDUSSCGKSA-N 2 2 319.836 3.271 20 10 DGCDLP C[C@H](CSC(C)(C)C)[NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000817944047 627969662 /nfs/dbraw/zinc/96/96/62/627969662.db2.gz WZPYLNDFRNLWJP-CJNGLKHVSA-N 2 2 309.523 3.262 20 10 DGCDLP CCC[C@@H]([NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1)c1cccnc1 ZINC000817942912 627969677 /nfs/dbraw/zinc/96/96/77/627969677.db2.gz RMZKZJRKYOUDFF-RTBURBONSA-N 2 2 312.461 3.278 20 10 DGCDLP CC[C@H]([NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1)c1ccccc1O ZINC000817942304 627969873 /nfs/dbraw/zinc/96/98/73/627969873.db2.gz NZNYXLPMOJJQBB-ROUUACIJSA-N 2 2 313.445 3.199 20 10 DGCDLP C[C@H]([NH2+]C[C@@H]1CCC[NH2+]1)c1ccc(N2CCCCCC2)cc1 ZINC000817951231 627972828 /nfs/dbraw/zinc/97/28/28/627972828.db2.gz CBMNVYOILCSFQR-WMZOPIPTSA-N 2 2 301.478 3.470 20 10 DGCDLP CC[C@H]([NH2+][C@H]1C[NH2+]CC[C@@H]1C)c1ccc(C(F)(F)F)cc1O ZINC000817969518 627978368 /nfs/dbraw/zinc/97/83/68/627978368.db2.gz VWDJPONNEHHOJN-BPNCWPANSA-N 2 2 316.367 3.450 20 10 DGCDLP C[C@H]([NH2+][C@@H]1C[NH2+]CC[C@H]1C)c1ccc(N2CCCCC2)cc1 ZINC000817968060 627978743 /nfs/dbraw/zinc/97/87/43/627978743.db2.gz NXOALRWHXLIBRV-JTDSTZFVSA-N 2 2 301.478 3.326 20 10 DGCDLP C[C@H]([NH2+]CCC[NH2+]C1CC1)c1cc(Cl)c(Cl)cc1O ZINC000817984425 627983798 /nfs/dbraw/zinc/98/37/98/627983798.db2.gz SLBKMVSDDADFRI-VIFPVBQESA-N 2 2 303.233 3.492 20 10 DGCDLP CC[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1)c1cccc(Cl)c1O ZINC000817987344 627984286 /nfs/dbraw/zinc/98/42/86/627984286.db2.gz SUUWCANCBHPJEL-JXFSHQFZSA-N 2 2 308.853 3.474 20 10 DGCDLP CN(C)c1ccc(/C=C/C[NH2+]C(C)(C)C[NH+]2CCCC2)cc1 ZINC000835054883 629838874 /nfs/dbraw/zinc/83/88/74/629838874.db2.gz MQOYRMLTKRFXGQ-BQYQJAHWSA-N 2 2 301.478 3.230 20 10 DGCDLP [NH3+][C@@H](C[NH2+]Cc1ccc(N2CCCCC2)cc1)c1ccccc1 ZINC000841038094 630399911 /nfs/dbraw/zinc/39/99/11/630399911.db2.gz UGYVVHJCNVJNAH-FQEVSTJZSA-N 2 2 309.457 3.467 20 10 DGCDLP CC(C)c1ncc(C[NH2+]C[C@H]([NH3+])c2ccc(N(C)C)cc2)s1 ZINC000841042112 630400754 /nfs/dbraw/zinc/40/07/54/630400754.db2.gz HWNORQVSCXFPGS-INIZCTEOSA-N 2 2 318.490 3.122 20 10 DGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+][C@@H]2CCCC[C@H]2C2CC2)cc1 ZINC000841045301 630401202 /nfs/dbraw/zinc/40/12/02/630401202.db2.gz JRVQKYCZJGECGW-IPMKNSEASA-N 2 2 301.478 3.311 20 10 DGCDLP CC[C@@H](Cc1ccccc1)[NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000841046146 630401963 /nfs/dbraw/zinc/40/19/63/630401963.db2.gz WZKXDEPBCVRUFZ-AZUAARDMSA-N 2 2 311.473 3.363 20 10 DGCDLP Cc1ccc(O)c(C[N@H+](Cc2ccccc2)[C@@H]2CCC[NH2+]C2)c1 ZINC000843052925 630609082 /nfs/dbraw/zinc/60/90/82/630609082.db2.gz OYMKUZRKUDRVIO-LJQANCHMSA-N 2 2 310.441 3.455 20 10 DGCDLP Cc1ccc(O)c(C[N@@H+](Cc2ccccc2)[C@@H]2CCC[NH2+]C2)c1 ZINC000843052925 630609085 /nfs/dbraw/zinc/60/90/85/630609085.db2.gz OYMKUZRKUDRVIO-LJQANCHMSA-N 2 2 310.441 3.455 20 10 DGCDLP C[NH2+]Cc1ccccc1C[NH2+]Cc1cc(Cl)cc(F)c1O ZINC000844904408 630972962 /nfs/dbraw/zinc/97/29/62/630972962.db2.gz LBBKZNWHCFZGHO-UHFFFAOYSA-N 2 2 308.784 3.194 20 10 DGCDLP c1cc(N2CCCC2)ccc1C[NH2+][C@H]1CCC[N@@H+]2CCCC[C@@H]12 ZINC000848575879 631701731 /nfs/dbraw/zinc/70/17/31/631701731.db2.gz XMVZTKJLJUCHBS-PMACEKPBSA-N 2 2 313.489 3.393 20 10 DGCDLP c1cc(N2CCCC2)ccc1C[NH2+][C@H]1CCC[N@H+]2CCCC[C@@H]12 ZINC000848575879 631701737 /nfs/dbraw/zinc/70/17/37/631701737.db2.gz XMVZTKJLJUCHBS-PMACEKPBSA-N 2 2 313.489 3.393 20 10 DGCDLP CCc1cccc(C[NH2+]C2CCN(c3cccc[nH+]3)CC2)c1O ZINC000848892792 631775961 /nfs/dbraw/zinc/77/59/61/631775961.db2.gz HBZZNWFJZNKUIF-UHFFFAOYSA-N 2 2 311.429 3.108 20 10 DGCDLP Cc1cc(N(C)C)ccc1C[NH2+][C@H]1CCC[N@@H+]2CCCC[C@H]12 ZINC000848927646 631791042 /nfs/dbraw/zinc/79/10/42/631791042.db2.gz JOKFUSKURGAJAO-RBUKOAKNSA-N 2 2 301.478 3.168 20 10 DGCDLP Cc1cc(N(C)C)ccc1C[NH2+][C@H]1CCC[N@H+]2CCCC[C@H]12 ZINC000848927646 631791045 /nfs/dbraw/zinc/79/10/45/631791045.db2.gz JOKFUSKURGAJAO-RBUKOAKNSA-N 2 2 301.478 3.168 20 10 DGCDLP CC[NH+](CC)CCOc1ccccc1NCc1[nH]c(C)c(C)[nH+]1 ZINC000850203594 632078415 /nfs/dbraw/zinc/07/84/15/632078415.db2.gz FVQZSEZYVIHMOF-UHFFFAOYSA-N 2 2 316.449 3.359 20 10 DGCDLP CN(C)c1ccc(/C=C/C[NH2+]C[C@H]2CC[N@@H+]2C(C)(C)C)cc1 ZINC000850341805 632117923 /nfs/dbraw/zinc/11/79/23/632117923.db2.gz ATBVTELVDHCNJW-IPLHWJFFSA-N 2 2 301.478 3.228 20 10 DGCDLP CN(C)c1ccc(/C=C/C[NH2+]C[C@H]2CC[N@H+]2C(C)(C)C)cc1 ZINC000850341805 632117925 /nfs/dbraw/zinc/11/79/25/632117925.db2.gz ATBVTELVDHCNJW-IPLHWJFFSA-N 2 2 301.478 3.228 20 10 DGCDLP CC1(C)C[NH2+]CC[C@H]([NH2+]Cc2cc(Cl)c(F)cc2O)C1 ZINC001576480751 1191827848 /nfs/dbraw/zinc/82/78/48/1191827848.db2.gz NZXSTEONNHEHST-NSHDSACASA-N 2 2 300.805 3.053 20 10 DGCDLP C[NH+](C)[C@H]1CCC[C@@H]([NH2+]Cc2cc(Cl)cc(F)c2O)C1 ZINC001647040761 1195243053 /nfs/dbraw/zinc/24/30/53/1195243053.db2.gz WVMARBMLLVYZSB-OLZOCXBDSA-N 2 2 300.805 3.147 20 10 DGCDLP C[NH+]1CCC(CC[NH2+]Cc2cc(Cl)cc(F)c2O)CC1 ZINC001657146792 1196110394 /nfs/dbraw/zinc/11/03/94/1196110394.db2.gz JAQYFMYJJBZGIB-UHFFFAOYSA-N 2 2 300.805 3.006 20 10 DGCDLP C[NH+](C)CC[C@H]([NH2+]Cc1ccc(Cl)cc1O)c1cccnc1 ZINC001660741969 1196517927 /nfs/dbraw/zinc/51/79/27/1196517927.db2.gz FXSSQZKJUKDCTO-INIZCTEOSA-N 2 2 319.836 3.223 20 10 DGCDLP Cc1c2ccccc2n(C)c1C[NH2+]CCCNc1cccc[nH+]1 ZINC001661643285 1196627323 /nfs/dbraw/zinc/62/73/23/1196627323.db2.gz ZSSURWTVZWVSPS-UHFFFAOYSA-N 2 2 308.429 3.474 20 10 DGCDLP Cc1c[nH+]cc(NCc2ccc(N3CC[NH+](C)CC3)cc2)c1C ZINC001167434542 1082114144 /nfs/dbraw/zinc/11/41/44/1082114144.db2.gz PGFJOYUKXMAUIJ-UHFFFAOYSA-N 2 2 310.445 3.062 20 10 DGCDLP Cc1cc[nH+]c(C)c1NCc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001167434706 1082114320 /nfs/dbraw/zinc/11/43/20/1082114320.db2.gz TUOPUSIHHUPGJG-UHFFFAOYSA-N 2 2 310.445 3.062 20 10 DGCDLP Cc1c[nH+]ccc1O[C@H]1CC[N@@H+](Cc2ccc(N(C)C)cc2)C1 ZINC001203936806 1090844196 /nfs/dbraw/zinc/84/41/96/1090844196.db2.gz NUVMQOHTJRSMPI-SFHVURJKSA-N 2 2 311.429 3.109 20 10 DGCDLP Cc1c[nH+]ccc1O[C@H]1CC[N@H+](Cc2ccc(N(C)C)cc2)C1 ZINC001203936806 1090844201 /nfs/dbraw/zinc/84/42/01/1090844201.db2.gz NUVMQOHTJRSMPI-SFHVURJKSA-N 2 2 311.429 3.109 20 10 DGCDLP Oc1cccc2c1C[N@H+](Cc1ccc(-n3cc[nH+]c3)cc1)CC2 ZINC001139361780 1091535597 /nfs/dbraw/zinc/53/55/97/1091535597.db2.gz YDSKIVYYNNFWCW-UHFFFAOYSA-N 2 2 305.381 3.136 20 10 DGCDLP Oc1cccc2c1C[N@@H+](Cc1ccc(-n3cc[nH+]c3)cc1)CC2 ZINC001139361780 1091535601 /nfs/dbraw/zinc/53/56/01/1091535601.db2.gz YDSKIVYYNNFWCW-UHFFFAOYSA-N 2 2 305.381 3.136 20 10 DGCDLP C[C@@H](C[NH+](C)C)[C@H]1CCCC[N@@H+]1Cc1cc(F)c(F)cc1O ZINC001206800502 1091746602 /nfs/dbraw/zinc/74/66/02/1091746602.db2.gz KTYMWBSRYNNLJV-BLLLJJGKSA-N 2 2 312.404 3.223 20 10 DGCDLP C[C@@H](C[NH+](C)C)[C@H]1CCCC[N@H+]1Cc1cc(F)c(F)cc1O ZINC001206800502 1091746611 /nfs/dbraw/zinc/74/66/11/1091746611.db2.gz KTYMWBSRYNNLJV-BLLLJJGKSA-N 2 2 312.404 3.223 20 10 DGCDLP C[C@@H]1CC[C@@H](C[NH3+])C[N@H+]1Cc1c(O)ccc(Cl)c1Cl ZINC001206810560 1091749315 /nfs/dbraw/zinc/74/93/15/1091749315.db2.gz NYFFQMSYQRGLKF-ZJUUUORDSA-N 2 2 303.233 3.258 20 10 DGCDLP C[NH+]1CCC([N@H+](Cc2cc(F)ccc2O)C2CCCC2)CC1 ZINC001140056096 1091752988 /nfs/dbraw/zinc/75/29/88/1091752988.db2.gz HWFKFJPKBWSWGQ-UHFFFAOYSA-N 2 2 306.425 3.370 20 10 DGCDLP C[NH+]1CCC([N@@H+](Cc2cc(F)ccc2O)C2CCCC2)CC1 ZINC001140056096 1091752994 /nfs/dbraw/zinc/75/29/94/1091752994.db2.gz HWFKFJPKBWSWGQ-UHFFFAOYSA-N 2 2 306.425 3.370 20 10 DGCDLP Cc1c[nH+]ccc1O[C@@H]1CC[N@H+](Cc2ccc(Cl)cc2O)C1 ZINC001140468337 1091878402 /nfs/dbraw/zinc/87/84/02/1091878402.db2.gz GOYYBTJGWFXHMN-OAHLLOKOSA-N 2 2 318.804 3.402 20 10 DGCDLP Cc1c[nH+]ccc1O[C@@H]1CC[N@@H+](Cc2ccc(Cl)cc2O)C1 ZINC001140468337 1091878408 /nfs/dbraw/zinc/87/84/08/1091878408.db2.gz GOYYBTJGWFXHMN-OAHLLOKOSA-N 2 2 318.804 3.402 20 10 DGCDLP Oc1cc(Cl)c(F)cc1C[N@@H+]1CCC[C@]2(CCC[NH2+]C2)C1 ZINC001222277828 1095525051 /nfs/dbraw/zinc/52/50/51/1095525051.db2.gz SUVASBFVWSLESD-INIZCTEOSA-N 2 2 312.816 3.150 20 10 DGCDLP Oc1cc(Cl)c(F)cc1C[N@H+]1CCC[C@]2(CCC[NH2+]C2)C1 ZINC001222277828 1095525060 /nfs/dbraw/zinc/52/50/60/1095525060.db2.gz SUVASBFVWSLESD-INIZCTEOSA-N 2 2 312.816 3.150 20 10 DGCDLP CCN(CC)c1ccc(C[N@@H+]2CCC[C@@]3(CCC[NH2+]3)C2)cc1 ZINC001222345066 1095564076 /nfs/dbraw/zinc/56/40/76/1095564076.db2.gz HUSHRUXGBJLJNK-IBGZPJMESA-N 2 2 301.478 3.251 20 10 DGCDLP CCN(CC)c1ccc(C[N@H+]2CCC[C@@]3(CCC[NH2+]3)C2)cc1 ZINC001222345066 1095564086 /nfs/dbraw/zinc/56/40/86/1095564086.db2.gz HUSHRUXGBJLJNK-IBGZPJMESA-N 2 2 301.478 3.251 20 10 DGCDLP COc1cc(N(C)C)ccc1C[N@H+](C(C)C)C1CC[NH+](C)CC1 ZINC001231857645 1097866196 /nfs/dbraw/zinc/86/61/96/1097866196.db2.gz MAIZGXMRHHTYIX-UHFFFAOYSA-N 2 2 319.493 3.066 20 10 DGCDLP COc1cc(N(C)C)ccc1C[N@@H+](C(C)C)C1CC[NH+](C)CC1 ZINC001231857645 1097866202 /nfs/dbraw/zinc/86/62/02/1097866202.db2.gz MAIZGXMRHHTYIX-UHFFFAOYSA-N 2 2 319.493 3.066 20 10 DGCDLP C[N@@H+]1CCC[C@@H]2C[NH+](Cc3cc(C(C)(C)C)ccc3O)C[C@H]21 ZINC001233286815 1098275669 /nfs/dbraw/zinc/27/56/69/1098275669.db2.gz JQNRKSVYDMCPAE-RHSMWYFYSA-N 2 2 302.462 3.216 20 10 DGCDLP C[N@H+]1CCC[C@@H]2C[NH+](Cc3cc(C(C)(C)C)ccc3O)C[C@H]21 ZINC001233286815 1098275674 /nfs/dbraw/zinc/27/56/74/1098275674.db2.gz JQNRKSVYDMCPAE-RHSMWYFYSA-N 2 2 302.462 3.216 20 10 DGCDLP C[NH+]1CCC[C@@H]2C[N@H+](Cc3cc(C(C)(C)C)ccc3O)C[C@H]21 ZINC001233286815 1098275679 /nfs/dbraw/zinc/27/56/79/1098275679.db2.gz JQNRKSVYDMCPAE-RHSMWYFYSA-N 2 2 302.462 3.216 20 10 DGCDLP C[NH+]1CCC[C@@H]2C[N@@H+](Cc3cc(C(C)(C)C)ccc3O)C[C@H]21 ZINC001233286815 1098275685 /nfs/dbraw/zinc/27/56/85/1098275685.db2.gz JQNRKSVYDMCPAE-RHSMWYFYSA-N 2 2 302.462 3.216 20 10 DGCDLP COc1cc(C[N@H+](C)Cc2ccccc2O)ccc1-n1cc[nH+]c1 ZINC001234076376 1098491313 /nfs/dbraw/zinc/49/13/13/1098491313.db2.gz VOYREHKEPOSZGN-UHFFFAOYSA-N 2 2 323.396 3.219 20 10 DGCDLP COc1cc(C[N@@H+](C)Cc2ccccc2O)ccc1-n1cc[nH+]c1 ZINC001234076376 1098491315 /nfs/dbraw/zinc/49/13/15/1098491315.db2.gz VOYREHKEPOSZGN-UHFFFAOYSA-N 2 2 323.396 3.219 20 10 DGCDLP Oc1cc(Cl)c(F)cc1C[N@@H+]1CCC[C@@]2(CCC[NH2+]2)CC1 ZINC001235038901 1098765392 /nfs/dbraw/zinc/76/53/92/1098765392.db2.gz LAQXVGVSCHPFIR-INIZCTEOSA-N 2 2 312.816 3.293 20 10 DGCDLP Oc1cc(Cl)c(F)cc1C[N@H+]1CCC[C@@]2(CCC[NH2+]2)CC1 ZINC001235038901 1098765399 /nfs/dbraw/zinc/76/53/99/1098765399.db2.gz LAQXVGVSCHPFIR-INIZCTEOSA-N 2 2 312.816 3.293 20 10 DGCDLP Cc1ccc(C)n1-c1ccc(C[N@@H+]2CCC[C@]23CC[NH2+]C3)cc1 ZINC001235111143 1098810909 /nfs/dbraw/zinc/81/09/09/1098810909.db2.gz PAOMQKVIXKWLDP-HXUWFJFHSA-N 2 2 309.457 3.422 20 10 DGCDLP Cc1ccc(C)n1-c1ccc(C[N@H+]2CCC[C@]23CC[NH2+]C3)cc1 ZINC001235111143 1098810916 /nfs/dbraw/zinc/81/09/16/1098810916.db2.gz PAOMQKVIXKWLDP-HXUWFJFHSA-N 2 2 309.457 3.422 20 10 DGCDLP Oc1c(Cl)cccc1C[N@@H+]1CCCC[C@H]1C1CC[NH2+]CC1 ZINC001235160722 1098847443 /nfs/dbraw/zinc/84/74/43/1098847443.db2.gz QKVGLJBVHSILAW-INIZCTEOSA-N 2 2 308.853 3.400 20 10 DGCDLP Oc1c(Cl)cccc1C[N@H+]1CCCC[C@H]1C1CC[NH2+]CC1 ZINC001235160722 1098847448 /nfs/dbraw/zinc/84/74/48/1098847448.db2.gz QKVGLJBVHSILAW-INIZCTEOSA-N 2 2 308.853 3.400 20 10 DGCDLP [NH3+]C[C@]1(F)CCCC[N@H+](Cc2ccc(C(F)(F)F)cc2O)C1 ZINC001206369421 1099021337 /nfs/dbraw/zinc/02/13/37/1099021337.db2.gz DRFIDIRUCRGMJO-CQSZACIVSA-N 2 2 320.330 3.064 20 10 DGCDLP [NH3+]C[C@]1(F)CCCC[N@@H+](Cc2ccc(C(F)(F)F)cc2O)C1 ZINC001206369421 1099021349 /nfs/dbraw/zinc/02/13/49/1099021349.db2.gz DRFIDIRUCRGMJO-CQSZACIVSA-N 2 2 320.330 3.064 20 10 DGCDLP CCCCN(CCCC)c1ccc(C[N@@H+]2CC[C@@H]([NH3+])C2)c(O)c1 ZINC001236172794 1099445673 /nfs/dbraw/zinc/44/56/73/1099445673.db2.gz GAESUKCTTJGYDP-QGZVFWFLSA-N 2 2 319.493 3.332 20 10 DGCDLP CCCCN(CCCC)c1ccc(C[N@H+]2CC[C@@H]([NH3+])C2)c(O)c1 ZINC001236172794 1099445679 /nfs/dbraw/zinc/44/56/79/1099445679.db2.gz GAESUKCTTJGYDP-QGZVFWFLSA-N 2 2 319.493 3.332 20 10 DGCDLP C[N@@H+](Cc1cc(Cl)c(Cl)cc1O)C1(C)CC[NH2+]CC1 ZINC001236226144 1099484270 /nfs/dbraw/zinc/48/42/70/1099484270.db2.gz KIAMTXWXQPJURB-UHFFFAOYSA-N 2 2 303.233 3.273 20 10 DGCDLP C[N@H+](Cc1cc(Cl)c(Cl)cc1O)C1(C)CC[NH2+]CC1 ZINC001236226144 1099484266 /nfs/dbraw/zinc/48/42/66/1099484266.db2.gz KIAMTXWXQPJURB-UHFFFAOYSA-N 2 2 303.233 3.273 20 10 DGCDLP c1cc(N2CCCCC2)ccc1C[N@H+](C1CC1)[C@H]1CCC[NH2+]C1 ZINC001236242034 1099497645 /nfs/dbraw/zinc/49/76/45/1099497645.db2.gz VYVDFQDORQNRCF-FQEVSTJZSA-N 2 2 313.489 3.393 20 10 DGCDLP c1cc(N2CCCCC2)ccc1C[N@@H+](C1CC1)[C@H]1CCC[NH2+]C1 ZINC001236242034 1099497652 /nfs/dbraw/zinc/49/76/52/1099497652.db2.gz VYVDFQDORQNRCF-FQEVSTJZSA-N 2 2 313.489 3.393 20 10 DGCDLP COc1cc(Cl)cc(C[N@H+](C(C)C)[C@@H]2CCC[NH2+]C2)c1O ZINC001236471158 1099631561 /nfs/dbraw/zinc/63/15/61/1099631561.db2.gz WPPCLCVBYDSVOT-CQSZACIVSA-N 2 2 312.841 3.017 20 10 DGCDLP COc1cc(Cl)cc(C[N@@H+](C(C)C)[C@@H]2CCC[NH2+]C2)c1O ZINC001236471158 1099631565 /nfs/dbraw/zinc/63/15/65/1099631565.db2.gz WPPCLCVBYDSVOT-CQSZACIVSA-N 2 2 312.841 3.017 20 10 DGCDLP CCC[N@@H+](Cc1cccc(C(F)(F)F)c1O)C[C@H]1CC[NH2+]C1 ZINC001236844525 1099830296 /nfs/dbraw/zinc/83/02/96/1099830296.db2.gz VOUSRUAVHPHMAX-LBPRGKRZSA-N 2 2 316.367 3.233 20 10 DGCDLP CCC[N@H+](Cc1cccc(C(F)(F)F)c1O)C[C@H]1CC[NH2+]C1 ZINC001236844525 1099830308 /nfs/dbraw/zinc/83/03/08/1099830308.db2.gz VOUSRUAVHPHMAX-LBPRGKRZSA-N 2 2 316.367 3.233 20 10 DGCDLP C[NH+]1CCC2(CC[N@H+](Cc3cc(Cl)cc(F)c3O)C2)CC1 ZINC001237622111 1100191619 /nfs/dbraw/zinc/19/16/19/1100191619.db2.gz MSBPZNFRRGDUTB-UHFFFAOYSA-N 2 2 312.816 3.102 20 10 DGCDLP C[NH+]1CCC2(CC[N@@H+](Cc3cc(Cl)cc(F)c3O)C2)CC1 ZINC001237622111 1100191622 /nfs/dbraw/zinc/19/16/22/1100191622.db2.gz MSBPZNFRRGDUTB-UHFFFAOYSA-N 2 2 312.816 3.102 20 10 DGCDLP C[C@@H](CC[NH+](C)C)[NH2+][C@@H](C)c1ccc(Br)cc1O ZINC000273560501 130137497 /nfs/dbraw/zinc/13/74/97/130137497.db2.gz IARBIMPISYMTLC-QWRGUYRKSA-N 2 2 315.255 3.146 20 10 DGCDLP Oc1c(Cl)cc(Cl)cc1C[NH2+]C1CC[NH+](C2CC2)CC1 ZINC000037141010 431844266 /nfs/dbraw/zinc/84/42/66/431844266.db2.gz XMMIOWCEVJPYMD-UHFFFAOYSA-N 2 2 315.244 3.415 20 10 DGCDLP CC[N@@H+]1CC[C@H](C[NH2+]Cc2cc(Cl)cc(Cl)c2O)C1 ZINC000037644073 431848386 /nfs/dbraw/zinc/84/83/86/431848386.db2.gz XJYGRUUNUPDMPC-SNVBAGLBSA-N 2 2 303.233 3.130 20 10 DGCDLP CC[N@H+]1CC[C@H](C[NH2+]Cc2cc(Cl)cc(Cl)c2O)C1 ZINC000037644073 431848387 /nfs/dbraw/zinc/84/83/87/431848387.db2.gz XJYGRUUNUPDMPC-SNVBAGLBSA-N 2 2 303.233 3.130 20 10 DGCDLP C[C@H]1CC[N@H+](Cc2cc(Cl)ccc2O)C[C@@H]1n1cc[nH+]c1 ZINC000091960337 431906742 /nfs/dbraw/zinc/90/67/42/431906742.db2.gz PZHIOQPXSALXDU-WFASDCNBSA-N 2 2 305.809 3.325 20 10 DGCDLP C[C@H]1CC[N@@H+](Cc2cc(Cl)ccc2O)C[C@@H]1n1cc[nH+]c1 ZINC000091960337 431906744 /nfs/dbraw/zinc/90/67/44/431906744.db2.gz PZHIOQPXSALXDU-WFASDCNBSA-N 2 2 305.809 3.325 20 10 DGCDLP CC(C)[N@H+](CCCn1cc[nH+]c1)Cc1ccc(N(C)C)cc1 ZINC000272026114 432433470 /nfs/dbraw/zinc/43/34/70/432433470.db2.gz VUUHOKOQKFVQKS-UHFFFAOYSA-N 2 2 300.450 3.250 20 10 DGCDLP CC(C)[N@@H+](CCCn1cc[nH+]c1)Cc1ccc(N(C)C)cc1 ZINC000272026114 432433475 /nfs/dbraw/zinc/43/34/75/432433475.db2.gz VUUHOKOQKFVQKS-UHFFFAOYSA-N 2 2 300.450 3.250 20 10 DGCDLP COc1ccc(O)c([C@@H](C)[NH2+]CCCCNc2cccc[nH+]2)c1 ZINC000185325506 432490810 /nfs/dbraw/zinc/49/08/10/432490810.db2.gz LTVJHIRORBUFGF-CQSZACIVSA-N 2 2 315.417 3.339 20 10 DGCDLP Cn1cc[nH+]c1[C@H]1CCC[N@H+](Cc2cc(Cl)ccc2O)C1 ZINC000373230618 433138485 /nfs/dbraw/zinc/13/84/85/433138485.db2.gz NQUGLRLGNCMCIM-LBPRGKRZSA-N 2 2 305.809 3.159 20 10 DGCDLP Cn1cc[nH+]c1[C@H]1CCC[N@@H+](Cc2cc(Cl)ccc2O)C1 ZINC000373230618 433138494 /nfs/dbraw/zinc/13/84/94/433138494.db2.gz NQUGLRLGNCMCIM-LBPRGKRZSA-N 2 2 305.809 3.159 20 10 DGCDLP CC(C)[NH+]1CCC([NH2+]Cc2cc(Cl)c(F)cc2O)CC1 ZINC000293794924 433871082 /nfs/dbraw/zinc/87/10/82/433871082.db2.gz BNIUYUOJBMTVOO-UHFFFAOYSA-N 2 2 300.805 3.147 20 10 DGCDLP Oc1cc(F)c(Cl)cc1C[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000294852023 434149601 /nfs/dbraw/zinc/14/96/01/434149601.db2.gz ZYWAKCPNJJXDBP-UHFFFAOYSA-N 2 2 312.816 3.149 20 10 DGCDLP Oc1cc(F)c(Cl)cc1C[NH+]1CCC(n2cc[nH+]c2)CC1 ZINC000295451310 434368242 /nfs/dbraw/zinc/36/82/42/434368242.db2.gz VFRRGUDLBONPHN-UHFFFAOYSA-N 2 2 309.772 3.218 20 10 DGCDLP C[C@H]1C[N@H+](Cc2cccc(Cl)c2O)CCN1c1cc[nH+]cc1 ZINC000895558289 618799158 /nfs/dbraw/zinc/79/91/58/618799158.db2.gz VDDJBKHPDIVMLA-ZDUSSCGKSA-N 2 2 317.820 3.151 20 10 DGCDLP C[C@H]1C[N@@H+](Cc2cccc(Cl)c2O)CCN1c1cc[nH+]cc1 ZINC000895558289 618799161 /nfs/dbraw/zinc/79/91/61/618799161.db2.gz VDDJBKHPDIVMLA-ZDUSSCGKSA-N 2 2 317.820 3.151 20 10 DGCDLP Oc1ccc(F)cc1C[NH+]1CCC(Nc2cccc[nH+]2)CC1 ZINC000896194588 618885422 /nfs/dbraw/zinc/88/54/22/618885422.db2.gz DSGGUTLCRUMCOM-UHFFFAOYSA-N 2 2 301.365 3.003 20 10 DGCDLP Cc1cc(O)c(C[NH+]2CCC([NH2+]C3CCC3)CC2)c(Cl)c1 ZINC000897982474 619202986 /nfs/dbraw/zinc/20/29/86/619202986.db2.gz LGXRSHSVBXZCGA-UHFFFAOYSA-N 2 2 308.853 3.461 20 10 DGCDLP CC[C@H]([NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2)c1ccc(C(F)(F)F)cc1O ZINC000902468996 619641906 /nfs/dbraw/zinc/64/19/06/619641906.db2.gz NJAWUNYXBFZARU-SCUASFONSA-N 2 2 314.351 3.345 20 10 DGCDLP CC1([NH+]2CCC2)CCC([NH2+]Cc2cc(F)cc(F)c2O)CC1 ZINC000922847211 621108079 /nfs/dbraw/zinc/10/80/79/621108079.db2.gz WVZVRZFFJJRMHR-UHFFFAOYSA-N 2 2 310.388 3.167 20 10 DGCDLP CC[N@@H+]1CCC[C@@H]1C[NH2+][C@@H](C)c1cc2c(cc1O)CCCC2 ZINC000756356367 621630575 /nfs/dbraw/zinc/63/05/75/621630575.db2.gz AKJRDKCWBPVHNR-WMLDXEAASA-N 2 2 302.462 3.406 20 10 DGCDLP CC[N@H+]1CCC[C@@H]1C[NH2+][C@@H](C)c1cc2c(cc1O)CCCC2 ZINC000756356367 621630577 /nfs/dbraw/zinc/63/05/77/621630577.db2.gz AKJRDKCWBPVHNR-WMLDXEAASA-N 2 2 302.462 3.406 20 10 DGCDLP CC[C@@H]1[NH2+]CC[C@H]1[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000863543649 621682266 /nfs/dbraw/zinc/68/22/66/621682266.db2.gz UGWMNGGRNZCEER-ZYSHUDEJSA-N 2 2 301.478 3.468 20 10 DGCDLP C[N@H+](CC1CC1)C[C@@H]1CC[NH+](Cc2cccc(Cl)c2O)C1 ZINC000775725981 623319490 /nfs/dbraw/zinc/31/94/90/623319490.db2.gz NOGIVDPSFGBICA-AWEZNQCLSA-N 2 2 308.853 3.209 20 10 DGCDLP C[N@@H+](CC1CC1)C[C@@H]1CC[NH+](Cc2cccc(Cl)c2O)C1 ZINC000775725981 623319493 /nfs/dbraw/zinc/31/94/93/623319493.db2.gz NOGIVDPSFGBICA-AWEZNQCLSA-N 2 2 308.853 3.209 20 10 DGCDLP C[NH+](CC1CC1)C[C@@H]1CC[N@H+](Cc2cccc(Cl)c2O)C1 ZINC000775725981 623319498 /nfs/dbraw/zinc/31/94/98/623319498.db2.gz NOGIVDPSFGBICA-AWEZNQCLSA-N 2 2 308.853 3.209 20 10 DGCDLP C[NH+](CC1CC1)C[C@@H]1CC[N@@H+](Cc2cccc(Cl)c2O)C1 ZINC000775725981 623319503 /nfs/dbraw/zinc/31/95/03/623319503.db2.gz NOGIVDPSFGBICA-AWEZNQCLSA-N 2 2 308.853 3.209 20 10 DGCDLP CN(C)c1ccc(C[NH2+][C@@H](Cn2cc[nH+]c2)c2ccccc2)cc1 ZINC000880568857 624979451 /nfs/dbraw/zinc/97/94/51/624979451.db2.gz FJEWIJNGPSBWIB-FQEVSTJZSA-N 2 2 320.440 3.480 20 10 DGCDLP CCC[N@H+](CCC[NH+](C)C)Cc1cc(Cl)cc(OC)c1O ZINC000809754888 626947220 /nfs/dbraw/zinc/94/72/20/626947220.db2.gz FOKZUWWJMKGRCR-UHFFFAOYSA-N 2 2 314.857 3.218 20 10 DGCDLP CCC[N@@H+](CCC[NH+](C)C)Cc1cc(Cl)cc(OC)c1O ZINC000809754888 626947222 /nfs/dbraw/zinc/94/72/22/626947222.db2.gz FOKZUWWJMKGRCR-UHFFFAOYSA-N 2 2 314.857 3.218 20 10 DGCDLP C[C@@H]([NH2+]CCC(C)(C)[NH3+])c1cc(Br)cc(F)c1O ZINC000925736773 627785235 /nfs/dbraw/zinc/78/52/35/627785235.db2.gz BZOUPTDBTDPWSF-MRVPVSSYSA-N 2 2 319.218 3.072 20 10 DGCDLP CC[N@@H+]1CC[C@H]([NH+](C)Cc2cc(Cl)c(F)cc2O)C[C@@H]1C ZINC000816515144 627800397 /nfs/dbraw/zinc/80/03/97/627800397.db2.gz QTDQMNAASIYZEI-AAEUAGOBSA-N 2 2 314.832 3.489 20 10 DGCDLP CC[N@H+]1CC[C@H]([NH+](C)Cc2cc(Cl)c(F)cc2O)C[C@@H]1C ZINC000816515144 627800399 /nfs/dbraw/zinc/80/03/99/627800399.db2.gz QTDQMNAASIYZEI-AAEUAGOBSA-N 2 2 314.832 3.489 20 10 DGCDLP CC[NH+]1CC[C@H]([N@H+](C)Cc2cc(Cl)c(F)cc2O)C[C@@H]1C ZINC000816515144 627800401 /nfs/dbraw/zinc/80/04/01/627800401.db2.gz QTDQMNAASIYZEI-AAEUAGOBSA-N 2 2 314.832 3.489 20 10 DGCDLP CC[NH+]1CC[C@H]([N@@H+](C)Cc2cc(Cl)c(F)cc2O)C[C@@H]1C ZINC000816515144 627800403 /nfs/dbraw/zinc/80/04/03/627800403.db2.gz QTDQMNAASIYZEI-AAEUAGOBSA-N 2 2 314.832 3.489 20 10 DGCDLP C[N@@H+]1CCC[C@H]2C[NH+](Cc3cc(Cl)c(F)cc3O)CC[C@H]21 ZINC000816521531 627801983 /nfs/dbraw/zinc/80/19/83/627801983.db2.gz ROVSMCVWMRVMPK-XHDPSFHLSA-N 2 2 312.816 3.101 20 10 DGCDLP C[N@H+]1CCC[C@H]2C[NH+](Cc3cc(Cl)c(F)cc3O)CC[C@H]21 ZINC000816521531 627801984 /nfs/dbraw/zinc/80/19/84/627801984.db2.gz ROVSMCVWMRVMPK-XHDPSFHLSA-N 2 2 312.816 3.101 20 10 DGCDLP C[NH+]1CC[C@H]2[C@@H](CCC[N@@H+]2Cc2cc(Cl)c(F)cc2O)C1 ZINC000816611920 627814242 /nfs/dbraw/zinc/81/42/42/627814242.db2.gz AJFHRZIIZQOHTK-NHYWBVRUSA-N 2 2 312.816 3.101 20 10 DGCDLP C[NH+]1CC[C@H]2[C@@H](CCC[N@H+]2Cc2cc(Cl)c(F)cc2O)C1 ZINC000816611920 627814244 /nfs/dbraw/zinc/81/42/44/627814244.db2.gz AJFHRZIIZQOHTK-NHYWBVRUSA-N 2 2 312.816 3.101 20 10 DGCDLP C[NH+]1CC[C@@H]2[C@H](CCC[N@@H+]2Cc2cc(Cl)c(F)cc2O)C1 ZINC000816611919 627814999 /nfs/dbraw/zinc/81/49/99/627814999.db2.gz AJFHRZIIZQOHTK-IAQYHMDHSA-N 2 2 312.816 3.101 20 10 DGCDLP C[NH+]1CC[C@@H]2[C@H](CCC[N@H+]2Cc2cc(Cl)c(F)cc2O)C1 ZINC000816611919 627815001 /nfs/dbraw/zinc/81/50/01/627815001.db2.gz AJFHRZIIZQOHTK-IAQYHMDHSA-N 2 2 312.816 3.101 20 10 DGCDLP CC1CCN(c2ccc(C[NH2+][C@H]3C[NH2+]CC[C@@H]3C)cc2)CC1 ZINC000817902781 627957433 /nfs/dbraw/zinc/95/74/33/627957433.db2.gz YEEROIXBQJRKQY-LPHOPBHVSA-N 2 2 301.478 3.011 20 10 DGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+][C@H]2CCCc3sccc32)cc1 ZINC000817938751 627967191 /nfs/dbraw/zinc/96/71/91/627967191.db2.gz RHCNELAYAHIGIU-SJORKVTESA-N 2 2 315.486 3.481 20 10 DGCDLP Cc1cc([C@H](C)[NH2+]C[C@@H]([NH3+])c2ccc(N(C)C)cc2)c(C)o1 ZINC000817939215 627967267 /nfs/dbraw/zinc/96/72/67/627967267.db2.gz AMMIEAOHFFGXKI-SCLBCKFNSA-N 2 2 301.434 3.313 20 10 DGCDLP C[C@H]([NH2+][C@@H]1CCC[NH2+]C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000817940099 627967918 /nfs/dbraw/zinc/96/79/18/627967918.db2.gz DWVDMLQDCUKJJZ-GOEBONIOSA-N 2 2 305.441 3.219 20 10 DGCDLP C[C@@H]([NH2+][C@H]1CCC[NH2+]C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000817940101 627968705 /nfs/dbraw/zinc/96/87/05/627968705.db2.gz DWVDMLQDCUKJJZ-ZBFHGGJFSA-N 2 2 305.441 3.219 20 10 DGCDLP Cc1ccc([C@@H](C)[NH2+]C[C@H]([NH3+])c2ccc(N(C)C)cc2)c(O)c1 ZINC000817942253 627968808 /nfs/dbraw/zinc/96/88/08/627968808.db2.gz NNLIYVRTTPJBQP-KDOFPFPSSA-N 2 2 313.445 3.117 20 10 DGCDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+][C@H]2CCCC23CCCC3)cc1 ZINC000817943311 627969495 /nfs/dbraw/zinc/96/94/95/627969495.db2.gz UGXQBZACARFFNA-ROUUACIJSA-N 2 2 301.478 3.455 20 10 DGCDLP CCC[C@H]([NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1)c1cccnc1 ZINC000817942909 627970000 /nfs/dbraw/zinc/97/00/00/627970000.db2.gz RMZKZJRKYOUDFF-MOPGFXCFSA-N 2 2 312.461 3.278 20 10 DGCDLP CC[C@@H]([NH2+]CC[NH2+]C1CC1)c1ccc(C(F)(F)F)cc1O ZINC000817953559 627973367 /nfs/dbraw/zinc/97/33/67/627973367.db2.gz OFRPSKMLVVZLMT-CYBMUJFWSA-N 2 2 302.340 3.204 20 10 DGCDLP C[C@H](CCC[NH3+])[NH2+][C@@H](C)c1cc(Br)cc(F)c1O ZINC000817977954 627981376 /nfs/dbraw/zinc/98/13/76/627981376.db2.gz RZECQHZIVXWATG-BDAKNGLRSA-N 2 2 319.218 3.072 20 10 DGCDLP C[C@@H](CCC[NH3+])[NH2+][C@@H](C)c1cc(Br)c(F)cc1O ZINC000817977932 627981882 /nfs/dbraw/zinc/98/18/82/627981882.db2.gz RSJUTCAHTCRBAE-IUCAKERBSA-N 2 2 319.218 3.072 20 10 DGCDLP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@H]2CCc3cccc(O)c32)cn1 ZINC000834523463 629720165 /nfs/dbraw/zinc/72/01/65/629720165.db2.gz UQKCVOUYCXXSTE-INIZCTEOSA-N 2 2 320.396 3.058 20 10 DGCDLP C[C@H](Cc1ccccc1F)[NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000841044065 630401303 /nfs/dbraw/zinc/40/13/03/630401303.db2.gz USOXDEZPXIABLY-AUUYWEPGSA-N 2 2 315.436 3.112 20 10 DGCDLP C[C@@H](Cc1ccccc1F)[NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000841044066 630401340 /nfs/dbraw/zinc/40/13/40/630401340.db2.gz USOXDEZPXIABLY-IFXJQAMLSA-N 2 2 315.436 3.112 20 10 DGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+]C/C=C\c2ccc(F)cc2)cc1 ZINC000841046056 630401968 /nfs/dbraw/zinc/40/19/68/630401968.db2.gz VJYDAJFRUILBEW-ZRHASKPBSA-N 2 2 313.420 3.195 20 10 DGCDLP Oc1c(F)cc(Cl)cc1C[NH+]1CCC([C@@H]2CCC[NH2+]2)CC1 ZINC000843044712 630607864 /nfs/dbraw/zinc/60/78/64/630607864.db2.gz GDAGPYUWYFPJNK-HNNXBMFYSA-N 2 2 312.816 3.149 20 10 DGCDLP CN(C)c1ccc(/C=C/C[NH2+][C@@H]2CCC[N@@H+]3CCCC[C@@H]23)cc1 ZINC000848574129 631699874 /nfs/dbraw/zinc/69/98/74/631699874.db2.gz AAJHLSQTOZKVGQ-RSECOTNCSA-N 2 2 313.489 3.372 20 10 DGCDLP CN(C)c1ccc(/C=C/C[NH2+][C@@H]2CCC[N@H+]3CCCC[C@@H]23)cc1 ZINC000848574129 631699877 /nfs/dbraw/zinc/69/98/77/631699877.db2.gz AAJHLSQTOZKVGQ-RSECOTNCSA-N 2 2 313.489 3.372 20 10 DGCDLP CCc1cccc(C[NH2+]Cc2ccccc2Cn2cc[nH+]c2)c1O ZINC000848893005 631775810 /nfs/dbraw/zinc/77/58/10/631775810.db2.gz MVJQFOCCEXZWIO-UHFFFAOYSA-N 2 2 321.424 3.489 20 10 DGCDLP Cc1ccc(O)c(C[NH2+][C@@H]2C[NH2+]CC[C@@H]2c2cccc(F)c2)c1 ZINC000849349834 631900419 /nfs/dbraw/zinc/90/04/19/631900419.db2.gz KNXCJVORFWHJIW-QZTJIDSGSA-N 2 2 314.404 3.075 20 10 DGCDLP Cc1cc[nH+]c(N2CC[NH+](Cc3cc(C)cc(C)c3O)CC2)c1 ZINC000164520974 655979006 /nfs/dbraw/zinc/97/90/06/655979006.db2.gz CMIHECIMGPAXGH-UHFFFAOYSA-N 2 2 311.429 3.035 20 10 DGCDLP CCN(CC)c1ccc(C[NH2+]C[C@@H](C)Cn2cc[nH+]c2)cc1 ZINC000067500719 657586533 /nfs/dbraw/zinc/58/65/33/657586533.db2.gz BOPMCXGCIFKKLT-MRXNPFEDSA-N 2 2 300.450 3.155 20 10 DGCDLP C[C@H]1CCC[N@@H+]1CC[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC001620821759 1192173733 /nfs/dbraw/zinc/17/37/33/1192173733.db2.gz IPQAURPXMJDOFI-KRWDZBQOSA-N 2 2 301.478 3.251 20 10 DGCDLP C[C@H]1CCC[N@H+]1CC[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC001620821759 1192173736 /nfs/dbraw/zinc/17/37/36/1192173736.db2.gz IPQAURPXMJDOFI-KRWDZBQOSA-N 2 2 301.478 3.251 20 10 DGCDLP Oc1cc(Cl)ccc1C[N@@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC001474313872 1183902624 /nfs/dbraw/zinc/90/26/24/1183902624.db2.gz GNSSRVJJPLZXSI-AWEZNQCLSA-N 2 2 308.853 3.353 20 10 DGCDLP Oc1cc(Cl)ccc1C[N@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC001474313872 1183902625 /nfs/dbraw/zinc/90/26/25/1183902625.db2.gz GNSSRVJJPLZXSI-AWEZNQCLSA-N 2 2 308.853 3.353 20 10 DGCDLP CCCOc1ccc(C[NH2+]C[C@@H](C)Cn2cc[nH+]c2)cc1C ZINC001655526200 1195927953 /nfs/dbraw/zinc/92/79/53/1195927953.db2.gz DZFOUCLEYSYDPG-OAHLLOKOSA-N 2 2 301.434 3.406 20 10 DGCDLP C[NH+](C)CC(C)(C)C[N@H+](C)Cc1cc(Cl)c(F)cc1O ZINC001659048589 1196337382 /nfs/dbraw/zinc/33/73/82/1196337382.db2.gz WJTDFWOSQXIGGN-UHFFFAOYSA-N 2 2 302.821 3.204 20 10 DGCDLP C[NH+](C)CC(C)(C)C[N@@H+](C)Cc1cc(Cl)c(F)cc1O ZINC001659048589 1196337385 /nfs/dbraw/zinc/33/73/85/1196337385.db2.gz WJTDFWOSQXIGGN-UHFFFAOYSA-N 2 2 302.821 3.204 20 10 DGCDLP CN(C)c1ccc(C[NH+]2CCC(Oc3cc[nH+]cc3)CC2)cc1 ZINC001203931194 1090843353 /nfs/dbraw/zinc/84/33/53/1090843353.db2.gz ODBSAEKKEMYYGQ-UHFFFAOYSA-N 2 2 311.429 3.191 20 10 DGCDLP C[C@H]1CC[N@@H+](Cc2c(O)ccc(Cl)c2Cl)C[C@@H]1C[NH3+] ZINC001205317339 1091181785 /nfs/dbraw/zinc/18/17/85/1091181785.db2.gz OCKDREFKXYTYBG-UWVGGRQHSA-N 2 2 303.233 3.116 20 10 DGCDLP C[C@H]1CC[N@H+](Cc2c(O)ccc(Cl)c2Cl)C[C@@H]1C[NH3+] ZINC001205317339 1091181781 /nfs/dbraw/zinc/18/17/81/1091181781.db2.gz OCKDREFKXYTYBG-UWVGGRQHSA-N 2 2 303.233 3.116 20 10 DGCDLP Oc1ccc(F)c(F)c1C[N@@H+]1CCCC[C@]2(CCCC[NH2+]C2)C1 ZINC001222171414 1095475441 /nfs/dbraw/zinc/47/54/41/1095475441.db2.gz BJJNKZJTYJDEGE-SFHVURJKSA-N 2 2 324.415 3.416 20 10 DGCDLP Oc1ccc(F)c(F)c1C[N@H+]1CCCC[C@]2(CCCC[NH2+]C2)C1 ZINC001222171414 1095475450 /nfs/dbraw/zinc/47/54/50/1095475450.db2.gz BJJNKZJTYJDEGE-SFHVURJKSA-N 2 2 324.415 3.416 20 10 DGCDLP CN1CCCc2cc(C[N@@H+]3CCC[C@@]4(CCCC[NH2+]4)C3)ccc21 ZINC001222389655 1095587930 /nfs/dbraw/zinc/58/79/30/1095587930.db2.gz DYFKMVAGRNUTGL-FQEVSTJZSA-N 2 2 313.489 3.177 20 10 DGCDLP CN1CCCc2cc(C[N@H+]3CCC[C@@]4(CCCC[NH2+]4)C3)ccc21 ZINC001222389655 1095587937 /nfs/dbraw/zinc/58/79/37/1095587937.db2.gz DYFKMVAGRNUTGL-FQEVSTJZSA-N 2 2 313.489 3.177 20 10 DGCDLP CN(C)c1ccc(C[N@@H+]2CC[C@@]3(CCC[NH2+]3)C2)c2ccccc21 ZINC001222471780 1095632560 /nfs/dbraw/zinc/63/25/60/1095632560.db2.gz XWXFISQGCKQSPZ-FQEVSTJZSA-N 2 2 309.457 3.234 20 10 DGCDLP CN(C)c1ccc(C[N@H+]2CC[C@@]3(CCC[NH2+]3)C2)c2ccccc21 ZINC001222471780 1095632567 /nfs/dbraw/zinc/63/25/67/1095632567.db2.gz XWXFISQGCKQSPZ-FQEVSTJZSA-N 2 2 309.457 3.234 20 10 DGCDLP C[N@@H+]1CCC[C@H]2C[NH+](Cc3cc(C(C)(C)C)ccc3O)C[C@@H]21 ZINC001233286817 1098276192 /nfs/dbraw/zinc/27/61/92/1098276192.db2.gz JQNRKSVYDMCPAE-YOEHRIQHSA-N 2 2 302.462 3.216 20 10 DGCDLP C[N@H+]1CCC[C@H]2C[NH+](Cc3cc(C(C)(C)C)ccc3O)C[C@@H]21 ZINC001233286817 1098276194 /nfs/dbraw/zinc/27/61/94/1098276194.db2.gz JQNRKSVYDMCPAE-YOEHRIQHSA-N 2 2 302.462 3.216 20 10 DGCDLP C[NH+]1CCC[C@H]2C[N@H+](Cc3cc(C(C)(C)C)ccc3O)C[C@@H]21 ZINC001233286817 1098276199 /nfs/dbraw/zinc/27/61/99/1098276199.db2.gz JQNRKSVYDMCPAE-YOEHRIQHSA-N 2 2 302.462 3.216 20 10 DGCDLP C[NH+]1CCC[C@H]2C[N@@H+](Cc3cc(C(C)(C)C)ccc3O)C[C@@H]21 ZINC001233286817 1098276204 /nfs/dbraw/zinc/27/62/04/1098276204.db2.gz JQNRKSVYDMCPAE-YOEHRIQHSA-N 2 2 302.462 3.216 20 10 DGCDLP Oc1c(C[N@H+]2CC[C@@H]3CC[NH2+][C@@H]3C2)cccc1-c1ccccc1 ZINC001235021988 1098755054 /nfs/dbraw/zinc/75/50/54/1098755054.db2.gz UNFCUTTXAHMIQS-QFBILLFUSA-N 2 2 308.425 3.243 20 10 DGCDLP CC(C)(C)c1cc(O)c(C[N@H+]2CCC3(C[NH2+]C3)C2)cc1Cl ZINC001235025541 1098756658 /nfs/dbraw/zinc/75/66/58/1098756658.db2.gz FCEHMKPASPQZAR-UHFFFAOYSA-N 2 2 308.853 3.138 20 10 DGCDLP CC(C)(C)c1cc(O)c(C[N@@H+]2CCC3(C[NH2+]C3)C2)cc1Cl ZINC001235025541 1098756650 /nfs/dbraw/zinc/75/66/50/1098756650.db2.gz FCEHMKPASPQZAR-UHFFFAOYSA-N 2 2 308.853 3.138 20 10 DGCDLP CC[N@H+](Cc1cc(-c2ccc(F)cc2)ccc1O)[C@@H]1CC[NH2+]C1 ZINC001235973618 1099300693 /nfs/dbraw/zinc/30/06/93/1099300693.db2.gz DTCKRTPROAWGKG-GOSISDBHSA-N 2 2 314.404 3.382 20 10 DGCDLP CC[N@@H+](Cc1cc(-c2ccc(F)cc2)ccc1O)[C@@H]1CC[NH2+]C1 ZINC001235973618 1099300706 /nfs/dbraw/zinc/30/07/06/1099300706.db2.gz DTCKRTPROAWGKG-GOSISDBHSA-N 2 2 314.404 3.382 20 10 DGCDLP CC[N@H+](Cc1ccc(N2CCCCC2)cc1)[C@@H]1CCC[NH2+]C1 ZINC001236003953 1099324882 /nfs/dbraw/zinc/32/48/82/1099324882.db2.gz BXVSENIBZOUBSS-LJQANCHMSA-N 2 2 301.478 3.251 20 10 DGCDLP CC[N@@H+](Cc1ccc(N2CCCCC2)cc1)[C@@H]1CCC[NH2+]C1 ZINC001236003953 1099324893 /nfs/dbraw/zinc/32/48/93/1099324893.db2.gz BXVSENIBZOUBSS-LJQANCHMSA-N 2 2 301.478 3.251 20 10 DGCDLP Oc1cc(C(F)(F)F)ccc1C[N@H+](C1CC1)[C@@H]1CCC[NH2+]C1 ZINC001236238950 1099491669 /nfs/dbraw/zinc/49/16/69/1099491669.db2.gz FLFKSCWSLCJZCN-CQSZACIVSA-N 2 2 314.351 3.127 20 10 DGCDLP Oc1cc(C(F)(F)F)ccc1C[N@@H+](C1CC1)[C@@H]1CCC[NH2+]C1 ZINC001236238950 1099491675 /nfs/dbraw/zinc/49/16/75/1099491675.db2.gz FLFKSCWSLCJZCN-CQSZACIVSA-N 2 2 314.351 3.127 20 10 DGCDLP CC[N@@H+]1CC[C@H]2CC[C@@H](C1)[NH+]2Cc1ccc(N2CCCC2)cc1 ZINC001254039865 1106012190 /nfs/dbraw/zinc/01/21/90/1106012190.db2.gz IWPAWDPNBOSHJR-UXHICEINSA-N 2 2 313.489 3.345 20 10 DGCDLP CC[N@H+]1CC[C@H]2CC[C@@H](C1)[NH+]2Cc1ccc(N2CCCC2)cc1 ZINC001254039865 1106012193 /nfs/dbraw/zinc/01/21/93/1106012193.db2.gz IWPAWDPNBOSHJR-UXHICEINSA-N 2 2 313.489 3.345 20 10 DGCDLP CC[NH+]1CC[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccc(N2CCCC2)cc1 ZINC001254039865 1106012199 /nfs/dbraw/zinc/01/21/99/1106012199.db2.gz IWPAWDPNBOSHJR-UXHICEINSA-N 2 2 313.489 3.345 20 10 DGCDLP CC[NH+]1CC[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccc(N2CCCC2)cc1 ZINC001254039865 1106012203 /nfs/dbraw/zinc/01/22/03/1106012203.db2.gz IWPAWDPNBOSHJR-UXHICEINSA-N 2 2 313.489 3.345 20 10 DGCDLP c1cc(N2CCCCC2)ccc1C[NH2+][C@H]1CC2CC[NH+](CC2)C1 ZINC001254837184 1106145854 /nfs/dbraw/zinc/14/58/54/1106145854.db2.gz SHKVRQCXYLADOY-IBGZPJMESA-N 2 2 313.489 3.251 20 10 DGCDLP Oc1cccc2c1C[N@@H+](C1CC[NH+](Cc3ccccc3)CC1)CC2 ZINC001256608599 1106453034 /nfs/dbraw/zinc/45/30/34/1106453034.db2.gz FLACVJOXRBVENZ-UHFFFAOYSA-N 2 2 322.452 3.415 20 10 DGCDLP Oc1cccc2c1C[N@H+](C1CC[NH+](Cc3ccccc3)CC1)CC2 ZINC001256608599 1106453037 /nfs/dbraw/zinc/45/30/37/1106453037.db2.gz FLACVJOXRBVENZ-UHFFFAOYSA-N 2 2 322.452 3.415 20 10 DGCDLP c1cn(-c2csc(C[NH2+]Cc3ccc4c(c3)CCO4)c2)c[nH+]1 ZINC001308236070 1111402440 /nfs/dbraw/zinc/40/24/40/1111402440.db2.gz USJKPKUZDJJOQG-UHFFFAOYSA-N 2 2 311.410 3.159 20 10 DGCDLP CC[C@@H]([NH2+]C[C@H](C)Cn1cc[nH+]c1C)c1ccc(F)cc1O ZINC000286277436 131227991 /nfs/dbraw/zinc/22/79/91/131227991.db2.gz VPBYOVMTPDWHKJ-BLLLJJGKSA-N 2 2 305.397 3.413 20 10 DGCDLP CC[C@H]([NH2+]CCC[N@H+](C)CCOC)c1cccc(Cl)c1O ZINC000287899363 131305376 /nfs/dbraw/zinc/30/53/76/131305376.db2.gz ZMPVTFBDSGDCPZ-HNNXBMFYSA-N 2 2 314.857 3.055 20 10 DGCDLP CC[C@H]([NH2+]CCC[N@@H+](C)CCOC)c1cccc(Cl)c1O ZINC000287899363 131305377 /nfs/dbraw/zinc/30/53/77/131305377.db2.gz ZMPVTFBDSGDCPZ-HNNXBMFYSA-N 2 2 314.857 3.055 20 10 DGCDLP C[C@@H]1CC[N@H+](Cc2cc(Cl)ccc2O)C[C@H]1n1cc[nH+]c1 ZINC000246773554 432165433 /nfs/dbraw/zinc/16/54/33/432165433.db2.gz PZHIOQPXSALXDU-IUODEOHRSA-N 2 2 305.809 3.325 20 10 DGCDLP C[C@@H]1CC[N@@H+](Cc2cc(Cl)ccc2O)C[C@H]1n1cc[nH+]c1 ZINC000246773554 432165438 /nfs/dbraw/zinc/16/54/38/432165438.db2.gz PZHIOQPXSALXDU-IUODEOHRSA-N 2 2 305.809 3.325 20 10 DGCDLP Cc1cc(O)c(C[N@H+]2CCC[C@@H](Cc3[nH+]ccn3C)C2)cc1C ZINC000182093761 228365862 /nfs/dbraw/zinc/36/58/62/228365862.db2.gz CLMPTIMPKHINCH-INIZCTEOSA-N 2 2 313.445 3.197 20 10 DGCDLP Cc1cc(O)c(C[N@@H+]2CCC[C@@H](Cc3[nH+]ccn3C)C2)cc1C ZINC000182093761 228365866 /nfs/dbraw/zinc/36/58/66/228365866.db2.gz CLMPTIMPKHINCH-INIZCTEOSA-N 2 2 313.445 3.197 20 10 DGCDLP Oc1ccc(Cl)c(F)c1C[N@@H+]1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000191389786 432261021 /nfs/dbraw/zinc/26/10/21/432261021.db2.gz IRKKYLMLLRCUKV-LBPRGKRZSA-N 2 2 312.816 3.102 20 10 DGCDLP Oc1ccc(Cl)c(F)c1C[N@H+]1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000191389786 432261025 /nfs/dbraw/zinc/26/10/25/432261025.db2.gz IRKKYLMLLRCUKV-LBPRGKRZSA-N 2 2 312.816 3.102 20 10 DGCDLP CCOc1cccc(C[NH2+]C[C@H](c2ccccc2)[NH+](C)C)c1O ZINC000074334549 431416401 /nfs/dbraw/zinc/41/64/01/431416401.db2.gz CRLPXBLWUJNVAY-QGZVFWFLSA-N 2 2 314.429 3.183 20 10 DGCDLP C[C@@H]([NH2+]CCn1cc[nH+]c1)c1ccc(N2CCCCC2)c(F)c1 ZINC000155647071 432565723 /nfs/dbraw/zinc/56/57/23/432565723.db2.gz RIMIJVPHAMWWCC-OAHLLOKOSA-N 2 2 316.424 3.363 20 10 DGCDLP C[C@H]([NH2+]C1CC[NH+](Cc2ccccn2)CC1)c1ccccc1O ZINC000183427866 525295177 /nfs/dbraw/zinc/29/51/77/525295177.db2.gz FGGOPNFHKAEDTG-HNNXBMFYSA-N 2 2 311.429 3.102 20 10 DGCDLP CC[C@H]([NH2+]C1CC[NH+](CC2CC2)CC1)c1ccc(F)cc1O ZINC000286342025 535895245 /nfs/dbraw/zinc/89/52/45/535895245.db2.gz YIYFAZODUJSCAP-KRWDZBQOSA-N 2 2 306.425 3.446 20 10 DGCDLP C[C@H](Cn1cc[nH+]c1)[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000725847038 575929019 /nfs/dbraw/zinc/92/90/19/575929019.db2.gz BGLXTMRFFXWTJA-OAHLLOKOSA-N 2 2 307.397 3.434 20 10 DGCDLP c1ccc(NCCCC[NH2+]Cc2ccc3c(c2)CCCO3)[nH+]c1 ZINC000921667252 620929983 /nfs/dbraw/zinc/92/99/83/620929983.db2.gz NODYJVQXHBASNJ-UHFFFAOYSA-N 2 2 311.429 3.389 20 10 DGCDLP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@H](C)c2cc(F)cc(F)c2O)C1 ZINC000756545725 621646548 /nfs/dbraw/zinc/64/65/48/621646548.db2.gz OWFDCATVSIKMCA-CHWSQXEVSA-N 2 2 312.404 3.441 20 10 DGCDLP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@H](C)c2cc(F)cc(F)c2O)C1 ZINC000756545725 621646549 /nfs/dbraw/zinc/64/65/49/621646549.db2.gz OWFDCATVSIKMCA-CHWSQXEVSA-N 2 2 312.404 3.441 20 10 DGCDLP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@H](C)c2cc(F)cc(F)c2O)C1 ZINC000756545728 621646567 /nfs/dbraw/zinc/64/65/67/621646567.db2.gz OWFDCATVSIKMCA-OLZOCXBDSA-N 2 2 312.404 3.441 20 10 DGCDLP CC(C)[N@H+]1CCC[C@@H](C[NH2+][C@H](C)c2cc(F)cc(F)c2O)C1 ZINC000756545728 621646568 /nfs/dbraw/zinc/64/65/68/621646568.db2.gz OWFDCATVSIKMCA-OLZOCXBDSA-N 2 2 312.404 3.441 20 10 DGCDLP CC[C@@H]1[NH2+]CC[C@H]1[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000863543648 621682539 /nfs/dbraw/zinc/68/25/39/621682539.db2.gz UGWMNGGRNZCEER-AYOQOUSVSA-N 2 2 301.478 3.468 20 10 DGCDLP C[C@@H]([NH2+]CC1(C[NH+](C)C)CCCC1)c1cc(F)cc(F)c1O ZINC000760896552 621972376 /nfs/dbraw/zinc/97/23/76/621972376.db2.gz GSBWYFXPFWCQIF-GFCCVEGCSA-N 2 2 312.404 3.443 20 10 DGCDLP C[C@@H]([NH2+]CC(C)(C)C[NH+]1CCCC1)c1cc(F)cc(F)c1O ZINC000790749126 625691942 /nfs/dbraw/zinc/69/19/42/625691942.db2.gz CUOZHEIQSXJFHJ-GFCCVEGCSA-N 2 2 312.404 3.443 20 10 DGCDLP CC(C)(C[NH2+]Cc1c(O)ccc(Cl)c1F)C[NH+]1CCCC1 ZINC000791011667 625737043 /nfs/dbraw/zinc/73/70/43/625737043.db2.gz VMCNYKKYXIZUAM-UHFFFAOYSA-N 2 2 314.832 3.396 20 10 DGCDLP CN(C)c1ccc(C[N@@H+]2CC[C@H](C[NH+]3CCCCC3)C2)cc1F ZINC000131157096 625952815 /nfs/dbraw/zinc/95/28/15/625952815.db2.gz GAPCUKCASZRROJ-QGZVFWFLSA-N 2 2 319.468 3.200 20 10 DGCDLP CN(C)c1ccc(C[N@H+]2CC[C@H](C[NH+]3CCCCC3)C2)cc1F ZINC000131157096 625952821 /nfs/dbraw/zinc/95/28/21/625952821.db2.gz GAPCUKCASZRROJ-QGZVFWFLSA-N 2 2 319.468 3.200 20 10 DGCDLP Cc1cc(Cl)cc([C@@H](C)[NH2+][C@@H]2CCc3[nH+]c[nH]c3C2)c1O ZINC000810252777 626993310 /nfs/dbraw/zinc/99/33/10/626993310.db2.gz JAGDGZACBXOBJP-ZYHUDNBSSA-N 2 2 305.809 3.285 20 10 DGCDLP C[NH+](C)[C@@H]1CCC[C@H]([NH2+]Cc2cc(Cl)c(F)cc2O)C1 ZINC000816554812 627806587 /nfs/dbraw/zinc/80/65/87/627806587.db2.gz JRVSQAMWKUHYON-NWDGAFQWSA-N 2 2 300.805 3.147 20 10 DGCDLP C[C@H]([NH2+]Cc1ccc(N2CCC(C)CC2)cc1)[C@@H]1CCC[NH2+]1 ZINC000817902525 627957452 /nfs/dbraw/zinc/95/74/52/627957452.db2.gz SKKMUDPIIZVUAM-LPHOPBHVSA-N 2 2 301.478 3.153 20 10 DGCDLP COc1ccccc1[C@@H](C)[NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000817937984 627966384 /nfs/dbraw/zinc/96/63/84/627966384.db2.gz AWYGRBUSDANTDC-KDOFPFPSSA-N 2 2 313.445 3.112 20 10 DGCDLP C[C@H]([NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1)c1ccc(F)cc1 ZINC000817939099 627967489 /nfs/dbraw/zinc/96/74/89/627967489.db2.gz YVTNBBNCUWOFDW-UGSOOPFHSA-N 2 2 301.409 3.242 20 10 DGCDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+][C@H]2CCc3ccc(F)cc32)cc1 ZINC000817938854 627967725 /nfs/dbraw/zinc/96/77/25/627967725.db2.gz UOKSLRNVTCGJMM-OALUTQOASA-N 2 2 313.420 3.169 20 10 DGCDLP COc1cccc([C@@H](C)[NH2+]C[C@@H]([NH3+])c2ccc(N(C)C)cc2)c1 ZINC000817939032 627967999 /nfs/dbraw/zinc/96/79/99/627967999.db2.gz XZISWMMIWWMLIE-AUUYWEPGSA-N 2 2 313.445 3.112 20 10 DGCDLP C[C@@H]([NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1)c1ccnc(Cl)c1 ZINC000817939893 627968039 /nfs/dbraw/zinc/96/80/39/627968039.db2.gz CZZLFMAMADQPMA-MLGOLLRUSA-N 2 2 318.852 3.152 20 10 DGCDLP Oc1ccccc1[C@H](CCc1ccccc1)[NH2+][C@@H]1CCC[NH2+]C1 ZINC000817942108 627968824 /nfs/dbraw/zinc/96/88/24/627968824.db2.gz WTVRFSKNTMIUPH-MJGOQNOKSA-N 2 2 310.441 3.408 20 10 DGCDLP CC(C)C[C@H](C[NH3+])[NH2+][C@@H](C)c1cc(Br)ccc1O ZINC000817957555 627974794 /nfs/dbraw/zinc/97/47/94/627974794.db2.gz CVYPMLZFZYGNAD-CMPLNLGQSA-N 2 2 315.255 3.179 20 10 DGCDLP C[C@H]([NH2+][C@@H]1CC[NH2+][C@H](C)C1)c1cccc(C(F)(F)F)c1O ZINC000817970894 627979665 /nfs/dbraw/zinc/97/96/65/627979665.db2.gz GVZLGZJOHYTVPK-OUAUKWLOSA-N 2 2 302.340 3.202 20 10 DGCDLP C[C@H](CCC[NH3+])[NH2+][C@H](C)c1cc(Br)cc(F)c1O ZINC000817977957 627981749 /nfs/dbraw/zinc/98/17/49/627981749.db2.gz RZECQHZIVXWATG-RKDXNWHRSA-N 2 2 319.218 3.072 20 10 DGCDLP CC[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1)c1cccc(Cl)c1O ZINC000817987342 627984067 /nfs/dbraw/zinc/98/40/67/627984067.db2.gz SUUWCANCBHPJEL-JFILPPLUSA-N 2 2 308.853 3.474 20 10 DGCDLP C[C@H]([NH2+][C@@H]1CCCC[C@H]1[NH3+])c1cccc(C(F)(F)F)c1O ZINC000818616051 628043652 /nfs/dbraw/zinc/04/36/52/628043652.db2.gz SVJOUVFLSYWSJL-ZWKOPEQDSA-N 2 2 302.340 3.332 20 10 DGCDLP Cc1cc(O)c(C[NH2+]C2CC[NH+](CC3CC3)CC2)c(Cl)c1 ZINC000840879849 630371017 /nfs/dbraw/zinc/37/10/17/630371017.db2.gz ICNVPKAXWXXCPM-UHFFFAOYSA-N 2 2 308.853 3.318 20 10 DGCDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+]Cc2cccc3cccnc32)cc1 ZINC000841041537 630400397 /nfs/dbraw/zinc/40/03/97/630400397.db2.gz DAMDGMGRGGMZCX-IBGZPJMESA-N 2 2 320.440 3.090 20 10 DGCDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+]Cc2ccc(Cl)s2)cc1 ZINC000841044333 630401117 /nfs/dbraw/zinc/40/11/17/630401117.db2.gz WDUWMBLBHLOXLT-AWEZNQCLSA-N 2 2 309.866 3.257 20 10 DGCDLP C[C@@H](C[NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1)c1ccc(F)cc1 ZINC000841042741 630401316 /nfs/dbraw/zinc/40/13/16/630401316.db2.gz NCJUYZMWKSZEES-LIRRHRJNSA-N 2 2 315.436 3.285 20 10 DGCDLP CCc1ccc(C[NH2+]C[C@H]([NH3+])c2ccc(N(C)C)cc2)s1 ZINC000841042383 630401324 /nfs/dbraw/zinc/40/13/24/630401324.db2.gz JBCHRBZQMKLENE-KRWDZBQOSA-N 2 2 303.475 3.166 20 10 DGCDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+]Cc2cc3ccccc3o2)cc1 ZINC000841043946 630401399 /nfs/dbraw/zinc/40/13/99/630401399.db2.gz RQJSAQXTBANUKZ-SFHVURJKSA-N 2 2 309.413 3.288 20 10 DGCDLP C[C@H](CCCC(F)(F)F)[NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000841045530 630402001 /nfs/dbraw/zinc/40/20/01/630402001.db2.gz MKZQKWLUGHQZAA-DOMZBBRYSA-N 2 2 317.399 3.463 20 10 DGCDLP C[C@H](Cc1ccc(F)cc1)[NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000841045777 630402006 /nfs/dbraw/zinc/40/20/06/630402006.db2.gz PTTBVVGXQIRPRI-KUHUBIRLSA-N 2 2 315.436 3.112 20 10 DGCDLP c1cc(N2CCCCC2)ccc1C[NH2+][C@@H]1CC[NH2+]C12CCCC2 ZINC000843129122 630617549 /nfs/dbraw/zinc/61/75/49/630617549.db2.gz RMSRXANBNZKGCW-LJQANCHMSA-N 2 2 313.489 3.441 20 10 DGCDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+]Cc2cccc3c2CCC3)cc1 ZINC000844901742 630970189 /nfs/dbraw/zinc/97/01/89/630970189.db2.gz JTSXMHBMZIUBGG-FQEVSTJZSA-N 2 2 309.457 3.031 20 10 DGCDLP C[C@@H]1CCC[N@H+](Cc2cc(Cl)cc(F)c2O)[C@H]1CC[NH3+] ZINC000844902103 630970225 /nfs/dbraw/zinc/97/02/25/630970225.db2.gz NKKKRONGSYQLHW-YGRLFVJLSA-N 2 2 300.805 3.134 20 10 DGCDLP C[C@@H]1CCC[N@@H+](Cc2cc(Cl)cc(F)c2O)[C@H]1CC[NH3+] ZINC000844902103 630970229 /nfs/dbraw/zinc/97/02/29/630970229.db2.gz NKKKRONGSYQLHW-YGRLFVJLSA-N 2 2 300.805 3.134 20 10 DGCDLP CC(=O)c1cc(Cl)cc(C[N@H+]2CCC[C@@H](C)[C@@H]2CC[NH3+])c1O ZINC000846226377 631215693 /nfs/dbraw/zinc/21/56/93/631215693.db2.gz LSUNYZQWXQGEQJ-BZNIZROVSA-N 2 2 324.852 3.198 20 10 DGCDLP CC(=O)c1cc(Cl)cc(C[N@@H+]2CCC[C@@H](C)[C@@H]2CC[NH3+])c1O ZINC000846226377 631215694 /nfs/dbraw/zinc/21/56/94/631215694.db2.gz LSUNYZQWXQGEQJ-BZNIZROVSA-N 2 2 324.852 3.198 20 10 DGCDLP Cc1ccc(O)c(C[NH2+][C@@H]2C[NH2+]CC[C@@H]2c2ccc(F)cc2)c1 ZINC000849349743 631900692 /nfs/dbraw/zinc/90/06/92/631900692.db2.gz HVFJHLWZASUYGV-QZTJIDSGSA-N 2 2 314.404 3.075 20 10 DGCDLP Cn1c[nH+]cc1CC[N@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000297569089 656178620 /nfs/dbraw/zinc/17/86/20/656178620.db2.gz CSSHXHCJCPJGRL-UHFFFAOYSA-N 2 2 312.461 3.085 20 10 DGCDLP Cn1c[nH+]cc1CC[N@@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000297569089 656178624 /nfs/dbraw/zinc/17/86/24/656178624.db2.gz CSSHXHCJCPJGRL-UHFFFAOYSA-N 2 2 312.461 3.085 20 10 DGCDLP [NH3+]CCC[N@H+](Cc1ccccc1)Cc1c(O)cccc1Cl ZINC000230008708 659295607 /nfs/dbraw/zinc/29/56/07/659295607.db2.gz YKFFQRAXHWLCIO-UHFFFAOYSA-N 2 2 304.821 3.397 20 10 DGCDLP [NH3+]CCC[N@@H+](Cc1ccccc1)Cc1c(O)cccc1Cl ZINC000230008708 659295612 /nfs/dbraw/zinc/29/56/12/659295612.db2.gz YKFFQRAXHWLCIO-UHFFFAOYSA-N 2 2 304.821 3.397 20 10 DGCDLP C[C@@H]([NH2+]Cc1cc(F)c(F)cc1O)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC001474435227 1183922377 /nfs/dbraw/zinc/92/23/77/1183922377.db2.gz BPTWHYDWBVUBFO-CHWSQXEVSA-N 2 2 324.415 3.413 20 10 DGCDLP C[C@@H]([NH2+]Cc1cc(F)c(F)cc1O)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC001474435227 1183922380 /nfs/dbraw/zinc/92/23/80/1183922380.db2.gz BPTWHYDWBVUBFO-CHWSQXEVSA-N 2 2 324.415 3.413 20 10 DGCDLP CC(C)C[C@@H](C[NH+](C)C)[NH2+]C/C=C/c1ccc(N(C)C)cc1 ZINC001560612050 1189347995 /nfs/dbraw/zinc/34/79/95/1189347995.db2.gz VHCWHTIPSXRPRD-DVBCCOPCSA-N 2 2 303.494 3.332 20 10 DGCDLP C[NH+](C)[C@@H]1CCC[C@H]([NH2+]Cc2cc(Cl)cc(F)c2O)C1 ZINC001647040762 1195242924 /nfs/dbraw/zinc/24/29/24/1195242924.db2.gz WVMARBMLLVYZSB-QWHCGFSZSA-N 2 2 300.805 3.147 20 10 DGCDLP C[C@H](C[NH2+]Cc1cc(Cl)cc(F)c1O)C[NH+]1CCCC1 ZINC001648832649 1081938030 /nfs/dbraw/zinc/93/80/30/1081938030.db2.gz GJDZCAULWREZIF-LLVKDONJSA-N 2 2 300.805 3.006 20 10 DGCDLP C[C@]1(C[NH3+])CCCC[N@H+](Cc2cc(F)cc(Cl)c2O)C1 ZINC001206572099 1091673063 /nfs/dbraw/zinc/67/30/63/1091673063.db2.gz ASWRQTKKGXMJIC-OAHLLOKOSA-N 2 2 300.805 3.136 20 10 DGCDLP C[C@]1(C[NH3+])CCCC[N@@H+](Cc2cc(F)cc(Cl)c2O)C1 ZINC001206572099 1091673066 /nfs/dbraw/zinc/67/30/66/1091673066.db2.gz ASWRQTKKGXMJIC-OAHLLOKOSA-N 2 2 300.805 3.136 20 10 DGCDLP C[C@@]1(C[NH3+])CCCC[N@H+](Cc2c(O)ccc(F)c2Cl)C1 ZINC001206575201 1091674434 /nfs/dbraw/zinc/67/44/34/1091674434.db2.gz UZVPXVBCFAYNJP-HNNXBMFYSA-N 2 2 300.805 3.136 20 10 DGCDLP C[C@@]1(C[NH3+])CCCC[N@@H+](Cc2c(O)ccc(F)c2Cl)C1 ZINC001206575201 1091674439 /nfs/dbraw/zinc/67/44/39/1091674439.db2.gz UZVPXVBCFAYNJP-HNNXBMFYSA-N 2 2 300.805 3.136 20 10 DGCDLP Cc1c[nH+]ccc1O[C@H]1CC[N@H+](Cc2c(O)cccc2Cl)C1 ZINC001140342297 1091835386 /nfs/dbraw/zinc/83/53/86/1091835386.db2.gz CFDLDMQBUGJIEW-ZDUSSCGKSA-N 2 2 318.804 3.402 20 10 DGCDLP Cc1c[nH+]ccc1O[C@H]1CC[N@@H+](Cc2c(O)cccc2Cl)C1 ZINC001140342297 1091835394 /nfs/dbraw/zinc/83/53/94/1091835394.db2.gz CFDLDMQBUGJIEW-ZDUSSCGKSA-N 2 2 318.804 3.402 20 10 DGCDLP CC1([NH+]2CCCC2)CC[NH+](Cc2ccc(Cl)cc2O)CC1 ZINC001140464382 1091875414 /nfs/dbraw/zinc/87/54/14/1091875414.db2.gz NFCCCJABJUPDSA-UHFFFAOYSA-N 2 2 308.853 3.496 20 10 DGCDLP CN(C)c1ccc(C[NH+]2CCC(n3cc[nH+]c3)CC2)c(Cl)c1 ZINC001140925205 1092064159 /nfs/dbraw/zinc/06/41/59/1092064159.db2.gz PMLRBUFPYFVMCB-UHFFFAOYSA-N 2 2 318.852 3.440 20 10 DGCDLP CC[NH+]1CCC([N@H+](C)Cc2ccc(N(C)C)cc2Cl)CC1 ZINC001140924938 1092065489 /nfs/dbraw/zinc/06/54/89/1092065489.db2.gz XIHBWXZKTMGKRZ-UHFFFAOYSA-N 2 2 309.885 3.322 20 10 DGCDLP CC[NH+]1CCC([N@@H+](C)Cc2ccc(N(C)C)cc2Cl)CC1 ZINC001140924938 1092065501 /nfs/dbraw/zinc/06/55/01/1092065501.db2.gz XIHBWXZKTMGKRZ-UHFFFAOYSA-N 2 2 309.885 3.322 20 10 DGCDLP [NH3+]C[C@@H]1CCCC[N@H+](Cc2c(O)ccc(Cl)c2Cl)C1 ZINC001206639005 1092868457 /nfs/dbraw/zinc/86/84/57/1092868457.db2.gz AJMYIKDGMBUKSV-JTQLQIEISA-N 2 2 303.233 3.260 20 10 DGCDLP [NH3+]C[C@@H]1CCCC[N@@H+](Cc2c(O)ccc(Cl)c2Cl)C1 ZINC001206639005 1092868469 /nfs/dbraw/zinc/86/84/69/1092868469.db2.gz AJMYIKDGMBUKSV-JTQLQIEISA-N 2 2 303.233 3.260 20 10 DGCDLP CN(C)c1ccc(C[N@@H+]2CCC[C@@]3(CCC[NH2+]C3)C2)c(Cl)c1 ZINC001222271026 1095523879 /nfs/dbraw/zinc/52/38/79/1095523879.db2.gz BTPIIRBEIDKHCP-GOSISDBHSA-N 2 2 321.896 3.372 20 10 DGCDLP CN(C)c1ccc(C[N@H+]2CCC[C@@]3(CCC[NH2+]C3)C2)c(Cl)c1 ZINC001222271026 1095523889 /nfs/dbraw/zinc/52/38/89/1095523889.db2.gz BTPIIRBEIDKHCP-GOSISDBHSA-N 2 2 321.896 3.372 20 10 DGCDLP Cc1cc(C[N@@H+]2CCC[C@]3(CCCC[NH2+]3)C2)ccc1N(C)C ZINC001222390186 1095587183 /nfs/dbraw/zinc/58/71/83/1095587183.db2.gz MLKMWYMTLLGINL-LJQANCHMSA-N 2 2 301.478 3.169 20 10 DGCDLP Cc1cc(C[N@H+]2CCC[C@]3(CCCC[NH2+]3)C2)ccc1N(C)C ZINC001222390186 1095587192 /nfs/dbraw/zinc/58/71/92/1095587192.db2.gz MLKMWYMTLLGINL-LJQANCHMSA-N 2 2 301.478 3.169 20 10 DGCDLP Oc1ccc(-c2ccc(F)cc2)cc1C[N@@H+]1CC[C@H]2[NH2+]CC[C@H]21 ZINC001235081947 1098788375 /nfs/dbraw/zinc/78/83/75/1098788375.db2.gz LNSPZKFFESXECH-QZTJIDSGSA-N 2 2 312.388 3.135 20 10 DGCDLP Oc1ccc(-c2ccc(F)cc2)cc1C[N@H+]1CC[C@H]2[NH2+]CC[C@H]21 ZINC001235081947 1098788386 /nfs/dbraw/zinc/78/83/86/1098788386.db2.gz LNSPZKFFESXECH-QZTJIDSGSA-N 2 2 312.388 3.135 20 10 DGCDLP C[N@H+](Cc1cc(-c2ccc(F)cc2)ccc1O)[C@H]1CCC[NH2+]C1 ZINC001235347170 1098971278 /nfs/dbraw/zinc/97/12/78/1098971278.db2.gz NICRMKKZCOWSPK-SFHVURJKSA-N 2 2 314.404 3.382 20 10 DGCDLP C[N@@H+](Cc1cc(-c2ccc(F)cc2)ccc1O)[C@H]1CCC[NH2+]C1 ZINC001235347170 1098971287 /nfs/dbraw/zinc/97/12/87/1098971287.db2.gz NICRMKKZCOWSPK-SFHVURJKSA-N 2 2 314.404 3.382 20 10 DGCDLP Cc1ccc(C[N@H+](Cc2ccccc2)[C@H]2CCC[NH2+]C2)c(O)c1 ZINC001236269591 1099511626 /nfs/dbraw/zinc/51/16/26/1099511626.db2.gz IYOSWWKYKYSKPV-IBGZPJMESA-N 2 2 310.441 3.455 20 10 DGCDLP Cc1ccc(C[N@@H+](Cc2ccccc2)[C@H]2CCC[NH2+]C2)c(O)c1 ZINC001236269591 1099511636 /nfs/dbraw/zinc/51/16/36/1099511636.db2.gz IYOSWWKYKYSKPV-IBGZPJMESA-N 2 2 310.441 3.455 20 10 DGCDLP CC[N@@H+](Cc1c(O)ccc(Cl)c1Cl)C[C@H]1CC[NH2+]C1 ZINC001236412111 1099585493 /nfs/dbraw/zinc/58/54/93/1099585493.db2.gz RBKLWURDLDUABU-JTQLQIEISA-N 2 2 303.233 3.130 20 10 DGCDLP CC[N@H+](Cc1c(O)ccc(Cl)c1Cl)C[C@H]1CC[NH2+]C1 ZINC001236412111 1099585503 /nfs/dbraw/zinc/58/55/03/1099585503.db2.gz RBKLWURDLDUABU-JTQLQIEISA-N 2 2 303.233 3.130 20 10 DGCDLP Cc1cc(Cl)cc(C[N@@H+]2CC[C@H](Oc3cc[nH+]cc3)C2)c1O ZINC001237687195 1100215436 /nfs/dbraw/zinc/21/54/36/1100215436.db2.gz VBCIQHJGERNREJ-INIZCTEOSA-N 2 2 318.804 3.402 20 10 DGCDLP Cc1cc(Cl)cc(C[N@H+]2CC[C@H](Oc3cc[nH+]cc3)C2)c1O ZINC001237687195 1100215439 /nfs/dbraw/zinc/21/54/39/1100215439.db2.gz VBCIQHJGERNREJ-INIZCTEOSA-N 2 2 318.804 3.402 20 10 DGCDLP C[N@@H+]1CCCC2(CC[NH+](Cc3cccc(Cl)c3O)CC2)C1 ZINC001276380344 1105539186 /nfs/dbraw/zinc/53/91/86/1105539186.db2.gz QDEDKLOGSQDXKY-UHFFFAOYSA-N 2 2 308.853 3.353 20 10 DGCDLP C[N@H+]1CCCC2(CC[NH+](Cc3cccc(Cl)c3O)CC2)C1 ZINC001276380344 1105539189 /nfs/dbraw/zinc/53/91/89/1105539189.db2.gz QDEDKLOGSQDXKY-UHFFFAOYSA-N 2 2 308.853 3.353 20 10 DGCDLP CCOc1cccc(C[N@@H+]2CC[C@H](C)[C@H](n3cc[nH+]c3)C2)c1O ZINC000091960312 193133360 /nfs/dbraw/zinc/13/33/60/193133360.db2.gz QQROXWRHXDPXKM-GOEBONIOSA-N 2 2 315.417 3.071 20 10 DGCDLP CCOc1cccc(C[N@H+]2CC[C@H](C)[C@H](n3cc[nH+]c3)C2)c1O ZINC000091960312 193133362 /nfs/dbraw/zinc/13/33/62/193133362.db2.gz QQROXWRHXDPXKM-GOEBONIOSA-N 2 2 315.417 3.071 20 10 DGCDLP C[C@@H]([NH2+]C1CC[NH+](C)CC1)c1cc(Cl)c(Cl)cc1O ZINC000192617637 296114771 /nfs/dbraw/zinc/11/47/71/296114771.db2.gz VMNIVDUKJBYNEO-SECBINFHSA-N 2 2 303.233 3.444 20 10 DGCDLP COc1cc(Cl)cc(C[N@@H+]2CCC[C@@H](c3[nH]cc[nH+]3)C2)c1O ZINC000273750124 130162192 /nfs/dbraw/zinc/16/21/92/130162192.db2.gz NJTUJRAGBHBAFT-LLVKDONJSA-N 2 2 321.808 3.157 20 10 DGCDLP COc1cc(Cl)cc(C[N@H+]2CCC[C@@H](c3[nH]cc[nH+]3)C2)c1O ZINC000273750124 130162195 /nfs/dbraw/zinc/16/21/95/130162195.db2.gz NJTUJRAGBHBAFT-LLVKDONJSA-N 2 2 321.808 3.157 20 10 DGCDLP CC[C@@H]([NH2+]C[C@H]1CCc2[nH+]ccn2C1)c1ccc(F)cc1O ZINC000287675877 131294328 /nfs/dbraw/zinc/29/43/28/131294328.db2.gz VZPUOQPYEZOQOV-IUODEOHRSA-N 2 2 303.381 3.031 20 10 DGCDLP COc1cccc(C[N@H+](C)Cc2[nH+]cc(C)c(OC)c2C)c1O ZINC000183784714 432324779 /nfs/dbraw/zinc/32/47/79/432324779.db2.gz RFZFDJWTDYTSSF-UHFFFAOYSA-N 2 2 316.401 3.053 20 10 DGCDLP COc1cccc(C[N@@H+](C)Cc2[nH+]cc(C)c(OC)c2C)c1O ZINC000183784714 432324782 /nfs/dbraw/zinc/32/47/82/432324782.db2.gz RFZFDJWTDYTSSF-UHFFFAOYSA-N 2 2 316.401 3.053 20 10 DGCDLP C[NH+](C)[C@H]1CCC[N@H+](Cc2c(O)ccc(Cl)c2F)CC1 ZINC000373005016 433074304 /nfs/dbraw/zinc/07/43/04/433074304.db2.gz CDNOZZGPNQOBLV-NSHDSACASA-N 2 2 300.805 3.101 20 10 DGCDLP C[NH+](C)[C@H]1CCC[N@@H+](Cc2c(O)ccc(Cl)c2F)CC1 ZINC000373005016 433074309 /nfs/dbraw/zinc/07/43/09/433074309.db2.gz CDNOZZGPNQOBLV-NSHDSACASA-N 2 2 300.805 3.101 20 10 DGCDLP C[NH+]1CCC([C@H]2CC[N@H+](Cc3cccc(Cl)c3O)C2)CC1 ZINC000290605301 433113275 /nfs/dbraw/zinc/11/32/75/433113275.db2.gz WGKMVTGBPCHZNX-AWEZNQCLSA-N 2 2 308.853 3.209 20 10 DGCDLP C[NH+]1CCC([C@H]2CC[N@@H+](Cc3cccc(Cl)c3O)C2)CC1 ZINC000290605301 433113284 /nfs/dbraw/zinc/11/32/84/433113284.db2.gz WGKMVTGBPCHZNX-AWEZNQCLSA-N 2 2 308.853 3.209 20 10 DGCDLP C[NH+]1CCC(CC[NH2+]Cc2cc(Cl)c(F)cc2O)CC1 ZINC000293573835 433787630 /nfs/dbraw/zinc/78/76/30/433787630.db2.gz JECOJTQLNZHTFZ-UHFFFAOYSA-N 2 2 300.805 3.006 20 10 DGCDLP COc1cc(Cl)cc(C[NH+]2CCC([NH+]3CCCC3)CC2)c1O ZINC000184678026 533952885 /nfs/dbraw/zinc/95/28/85/533952885.db2.gz DRJWMXANUXKFFM-UHFFFAOYSA-N 2 2 324.852 3.114 20 10 DGCDLP C[C@H]1CC[N@H+](Cc2cccc(Cl)c2O)C[C@@H]1n1cc[nH+]c1 ZINC000180720073 524293325 /nfs/dbraw/zinc/29/33/25/524293325.db2.gz PNIDRYUWTMGIGT-WFASDCNBSA-N 2 2 305.809 3.325 20 10 DGCDLP C[C@H]1CC[N@@H+](Cc2cccc(Cl)c2O)C[C@@H]1n1cc[nH+]c1 ZINC000180720073 524293331 /nfs/dbraw/zinc/29/33/31/524293331.db2.gz PNIDRYUWTMGIGT-WFASDCNBSA-N 2 2 305.809 3.325 20 10 DGCDLP C[C@@H]([NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1)c1cc(F)cc(F)c1O ZINC000853242057 620681546 /nfs/dbraw/zinc/68/15/46/620681546.db2.gz ZUPRWVGLYZETHW-TZMCWYRMSA-N 2 2 324.415 3.443 20 10 DGCDLP C[C@@H]([NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1)c1cc(F)cc(F)c1O ZINC000853242057 620681547 /nfs/dbraw/zinc/68/15/47/620681547.db2.gz ZUPRWVGLYZETHW-TZMCWYRMSA-N 2 2 324.415 3.443 20 10 DGCDLP C[C@@H]([NH2+][C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1)c1ccccc1O ZINC000854225180 620785620 /nfs/dbraw/zinc/78/56/20/620785620.db2.gz YAGFIJNOUIIPDW-FSPWUOQZSA-N 2 2 314.404 3.328 20 10 DGCDLP COc1cc(Cl)cc(C[NH+]2CCC(C)([NH+]3CCC3)CC2)c1O ZINC000895670387 618816039 /nfs/dbraw/zinc/81/60/39/618816039.db2.gz FXEOYFDTKVCOHJ-UHFFFAOYSA-N 2 2 324.852 3.114 20 10 DGCDLP C[C@H]([NH2+][C@@H]1Cc2ccccc2[C@H]1[NH3+])c1cc(Cl)ccc1O ZINC000902435145 619635741 /nfs/dbraw/zinc/63/57/41/619635741.db2.gz AEGGTAZZGJDFKL-UDTVLSCZSA-N 2 2 302.805 3.321 20 10 DGCDLP C[NH+](C)CC[C@H]([NH2+][C@H]1CCc2cccc(O)c21)c1cccnc1 ZINC000903381373 619768622 /nfs/dbraw/zinc/76/86/22/619768622.db2.gz WBCQKNTVVGNJGZ-IRXDYDNUSA-N 2 2 311.429 3.057 20 10 DGCDLP C[C@H]([NH2+][C@@H](CC[NH+](C)C)c1cccnc1)c1ccc(F)cc1O ZINC000903380777 619768822 /nfs/dbraw/zinc/76/88/22/619768822.db2.gz PHVRYSKDKFLXLE-GUYCJALGSA-N 2 2 317.408 3.270 20 10 DGCDLP C[C@H]([NH2+]CCC[NH+]1CCC(C)CC1)c1cc(F)cc(F)c1O ZINC000756361254 621631006 /nfs/dbraw/zinc/63/10/06/621631006.db2.gz JQKHYCNQKJPNKE-ZDUSSCGKSA-N 2 2 312.404 3.443 20 10 DGCDLP CC[C@@H]([NH2+][C@@H]1CC[NH2+][C@H]1C)c1ccc(C(F)(F)F)cc1O ZINC000863546574 621683115 /nfs/dbraw/zinc/68/31/15/621683115.db2.gz LFXAZHNRCFKAJL-ZWKOPEQDSA-N 2 2 302.340 3.202 20 10 DGCDLP [NH3+]C[C@H]1C[N@H+](Cc2c(O)cccc2Cl)CC[C@@H]1C(F)(F)F ZINC000863646294 621693296 /nfs/dbraw/zinc/69/32/96/621693296.db2.gz ISGYFGSFMYOJON-ONGXEEELSA-N 2 2 322.758 3.005 20 10 DGCDLP [NH3+]C[C@H]1C[N@@H+](Cc2c(O)cccc2Cl)CC[C@@H]1C(F)(F)F ZINC000863646294 621693299 /nfs/dbraw/zinc/69/32/99/621693299.db2.gz ISGYFGSFMYOJON-ONGXEEELSA-N 2 2 322.758 3.005 20 10 DGCDLP C[C@H]1CC[C@@H]([NH2+]Cc2ccc(N(C)C)cc2C(F)(F)F)C[NH2+]1 ZINC000863649700 621693402 /nfs/dbraw/zinc/69/34/02/621693402.db2.gz GTTZKTFSJYQHEN-WCQYABFASA-N 2 2 315.383 3.002 20 10 DGCDLP CCC[N@H+](Cc1c(O)ccc(Cl)c1F)C1CC[NH2+]CC1 ZINC000843045383 621695545 /nfs/dbraw/zinc/69/55/45/621695545.db2.gz WBLBJYLFZCIFGI-UHFFFAOYSA-N 2 2 300.805 3.149 20 10 DGCDLP CCC[N@@H+](Cc1c(O)ccc(Cl)c1F)C1CC[NH2+]CC1 ZINC000843045383 621695548 /nfs/dbraw/zinc/69/55/48/621695548.db2.gz WBLBJYLFZCIFGI-UHFFFAOYSA-N 2 2 300.805 3.149 20 10 DGCDLP CC1(C)C[NH2+]CC[C@@H]([NH2+]Cc2c(O)ccc(Cl)c2F)C1 ZINC000872254331 622867721 /nfs/dbraw/zinc/86/77/21/622867721.db2.gz ZTANIPKQEHHHTN-SNVBAGLBSA-N 2 2 300.805 3.053 20 10 DGCDLP CC(C)(C)[C@]1(C[NH3+])CC[N@H+](Cc2cc(Cl)cc(F)c2O)C1 ZINC000873224209 623081457 /nfs/dbraw/zinc/08/14/57/623081457.db2.gz XPNYHIIOEZVVGW-INIZCTEOSA-N 2 2 314.832 3.382 20 10 DGCDLP CC(C)(C)[C@]1(C[NH3+])CC[N@@H+](Cc2cc(Cl)cc(F)c2O)C1 ZINC000873224209 623081461 /nfs/dbraw/zinc/08/14/61/623081461.db2.gz XPNYHIIOEZVVGW-INIZCTEOSA-N 2 2 314.832 3.382 20 10 DGCDLP Cc1cccc(C[NH2+]Cc2ccccc2Cn2cc[nH+]c2)c1O ZINC000775931822 623352433 /nfs/dbraw/zinc/35/24/33/623352433.db2.gz YMAWZJDWCCZXOF-UHFFFAOYSA-N 2 2 307.397 3.235 20 10 DGCDLP C[C@H]([NH2+][C@H]1CCn2cc[nH+]c2C1)c1ccc2ccccc2c1O ZINC000779061705 623726028 /nfs/dbraw/zinc/72/60/28/623726028.db2.gz MKQKFBRFEWURGK-ZFWWWQNUSA-N 2 2 307.397 3.408 20 10 DGCDLP CC[C@H]([NH2+][C@H]1CCn2cc[nH+]c2C1)c1cc(Cl)ccc1O ZINC000779067355 623726481 /nfs/dbraw/zinc/72/64/81/623726481.db2.gz VZBNVDPYQWIEHB-JSGCOSHPSA-N 2 2 305.809 3.298 20 10 DGCDLP C[C@H]1CCC[N@H+](CCCC[NH2+]Cc2cc(F)cc(F)c2O)C1 ZINC000882892050 625848633 /nfs/dbraw/zinc/84/86/33/625848633.db2.gz LOMGWNCDFOTICL-ZDUSSCGKSA-N 2 2 312.404 3.272 20 10 DGCDLP C[C@H]1CCC[N@@H+](CCCC[NH2+]Cc2cc(F)cc(F)c2O)C1 ZINC000882892050 625848635 /nfs/dbraw/zinc/84/86/35/625848635.db2.gz LOMGWNCDFOTICL-ZDUSSCGKSA-N 2 2 312.404 3.272 20 10 DGCDLP Cc1ccc(O)c(C[NH+](C)CCC[N@@H+](C)Cc2ccco2)c1 ZINC000809717895 626940492 /nfs/dbraw/zinc/94/04/92/626940492.db2.gz CDEKZRRQBFSTAV-UHFFFAOYSA-N 2 2 302.418 3.248 20 10 DGCDLP Cc1ccc(O)c(C[NH+](C)CCC[N@H+](C)Cc2ccco2)c1 ZINC000809717895 626940494 /nfs/dbraw/zinc/94/04/94/626940494.db2.gz CDEKZRRQBFSTAV-UHFFFAOYSA-N 2 2 302.418 3.248 20 10 DGCDLP Cc1ccc(O)c(C[N@@H+](C)CCC[NH+](C)Cc2ccco2)c1 ZINC000809717895 626940496 /nfs/dbraw/zinc/94/04/96/626940496.db2.gz CDEKZRRQBFSTAV-UHFFFAOYSA-N 2 2 302.418 3.248 20 10 DGCDLP Cc1ccc(O)c(C[N@H+](C)CCC[NH+](C)Cc2ccco2)c1 ZINC000809717895 626940498 /nfs/dbraw/zinc/94/04/98/626940498.db2.gz CDEKZRRQBFSTAV-UHFFFAOYSA-N 2 2 302.418 3.248 20 10 DGCDLP Cc1ccc([C@H](C)[N@@H+]2CCc3sc(C[NH3+])nc3C2)c(O)c1C ZINC000925751551 627787480 /nfs/dbraw/zinc/78/74/80/627787480.db2.gz NSTXAYMUJVGMKQ-LBPRGKRZSA-N 2 2 317.458 3.044 20 10 DGCDLP Cc1ccc([C@H](C)[N@H+]2CCc3sc(C[NH3+])nc3C2)c(O)c1C ZINC000925751551 627787483 /nfs/dbraw/zinc/78/74/83/627787483.db2.gz NSTXAYMUJVGMKQ-LBPRGKRZSA-N 2 2 317.458 3.044 20 10 DGCDLP C[C@H](C[NH2+]Cc1cc(Cl)c(F)cc1O)C[NH+]1CCCCC1 ZINC000816536799 627804540 /nfs/dbraw/zinc/80/45/40/627804540.db2.gz KIQLLZAMDCYZNO-GFCCVEGCSA-N 2 2 314.832 3.396 20 10 DGCDLP C[NH+](C)[C@H]1CCC[C@H]([NH2+]Cc2cc(Cl)c(F)cc2O)C1 ZINC000816554813 627806620 /nfs/dbraw/zinc/80/66/20/627806620.db2.gz JRVSQAMWKUHYON-RYUDHWBXSA-N 2 2 300.805 3.147 20 10 DGCDLP C[NH+](C)C1CCC([NH2+]Cc2cc(Cl)cc(F)c2O)CC1 ZINC000817416213 627896930 /nfs/dbraw/zinc/89/69/30/627896930.db2.gz ROBDCZNCGGNGML-UHFFFAOYSA-N 2 2 300.805 3.147 20 10 DGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+][C@H]2CCCc3ccccc32)cc1 ZINC000817938530 627966638 /nfs/dbraw/zinc/96/66/38/627966638.db2.gz MMOZDKDCAJXQLR-UXHICEINSA-N 2 2 309.457 3.420 20 10 DGCDLP C[C@@H]([NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1)c1cccc(F)c1 ZINC000817938792 627967820 /nfs/dbraw/zinc/96/78/20/627967820.db2.gz SLMGXSZXBPVSCA-FZKQIMNGSA-N 2 2 301.409 3.242 20 10 DGCDLP Cc1ccc([C@@H](C)[NH2+]C[C@H]([NH3+])c2ccc(N(C)C)cc2)c(C)n1 ZINC000817941144 627968938 /nfs/dbraw/zinc/96/89/38/627968938.db2.gz JDWNRLQWZKQWGG-KUHUBIRLSA-N 2 2 312.461 3.115 20 10 DGCDLP C[C@@H](CSC(C)(C)C)[NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000817944039 627969361 /nfs/dbraw/zinc/96/93/61/627969361.db2.gz WZPYLNDFRNLWJP-BBRMVZONSA-N 2 2 309.523 3.262 20 10 DGCDLP CC[C@@H]([NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1)c1ccccc1O ZINC000817942305 627969400 /nfs/dbraw/zinc/96/94/00/627969400.db2.gz NZNYXLPMOJJQBB-ZWKOTPCHSA-N 2 2 313.445 3.199 20 10 DGCDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+]C(C2CCC2)C2CCC2)cc1 ZINC000817942704 627969471 /nfs/dbraw/zinc/96/94/71/627969471.db2.gz QGSOGGMWIRASIH-SFHVURJKSA-N 2 2 301.478 3.311 20 10 DGCDLP C[C@@H]([NH2+]C[C@@H]1CCCC[NH2+]1)c1ccc(N2CCCCC2)cc1 ZINC000817945850 627970699 /nfs/dbraw/zinc/97/06/99/627970699.db2.gz NINLLWDPKPRFBX-AEFFLSMTSA-N 2 2 301.478 3.470 20 10 DGCDLP C[C@@H]([NH2+][C@@H]1CCCC[C@H]1[NH3+])c1cccc(C(F)(F)F)c1O ZINC000818616050 628043534 /nfs/dbraw/zinc/04/35/34/628043534.db2.gz SVJOUVFLSYWSJL-OASPWFOLSA-N 2 2 302.340 3.332 20 10 DGCDLP C[NH+](C)CCCC(C)(C)[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000824913813 628705848 /nfs/dbraw/zinc/70/58/48/628705848.db2.gz GGPZAWNILYTHGB-UHFFFAOYSA-N 2 2 302.821 3.395 20 10 DGCDLP Oc1c(Cl)cccc1C[NH2+]CC1CC[NH+](CC2CC2)CC1 ZINC000827844761 628996274 /nfs/dbraw/zinc/99/62/74/628996274.db2.gz NUWLPOQBHWCLLN-UHFFFAOYSA-N 2 2 308.853 3.257 20 10 DGCDLP Cc1ccccc1C[C@H](C)[NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000841041751 630400686 /nfs/dbraw/zinc/40/06/86/630400686.db2.gz BHCCLTBHSFSHTQ-OXJNMPFZSA-N 2 2 311.473 3.282 20 10 DGCDLP C[C@@H](C[NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1)Cc1ccccc1 ZINC000841046060 630401779 /nfs/dbraw/zinc/40/17/79/630401779.db2.gz VKGYTXBKICKYAK-UZLBHIALSA-N 2 2 311.473 3.221 20 10 DGCDLP Oc1c(F)cc(Cl)cc1C[N@@H+]1CCC[C@@H]([C@H]2CC[NH2+]C2)C1 ZINC000843124626 630616054 /nfs/dbraw/zinc/61/60/54/630616054.db2.gz DQDSIGPUJYVFNU-NWDGAFQWSA-N 2 2 312.816 3.006 20 10 DGCDLP Oc1c(F)cc(Cl)cc1C[N@H+]1CCC[C@@H]([C@H]2CC[NH2+]C2)C1 ZINC000843124626 630616058 /nfs/dbraw/zinc/61/60/58/630616058.db2.gz DQDSIGPUJYVFNU-NWDGAFQWSA-N 2 2 312.816 3.006 20 10 DGCDLP C[C@H]1CCC[N@H+](Cc2cc(Cl)cc(F)c2O)[C@H]1CC[NH3+] ZINC000844902099 630970197 /nfs/dbraw/zinc/97/01/97/630970197.db2.gz NKKKRONGSYQLHW-HZMBPMFUSA-N 2 2 300.805 3.134 20 10 DGCDLP C[C@H]1CCC[N@@H+](Cc2cc(Cl)cc(F)c2O)[C@H]1CC[NH3+] ZINC000844902099 630970200 /nfs/dbraw/zinc/97/02/00/630970200.db2.gz NKKKRONGSYQLHW-HZMBPMFUSA-N 2 2 300.805 3.134 20 10 DGCDLP C[C@H]1C[C@@H]([NH3+])CC[N@@H+]1Cc1ccc(N(C)C)cc1C(F)(F)F ZINC000846704289 631290188 /nfs/dbraw/zinc/29/01/88/631290188.db2.gz UIQCEXXXLAXETE-AAEUAGOBSA-N 2 2 315.383 3.083 20 10 DGCDLP C[C@H]1C[C@@H]([NH3+])CC[N@H+]1Cc1ccc(N(C)C)cc1C(F)(F)F ZINC000846704289 631290194 /nfs/dbraw/zinc/29/01/94/631290194.db2.gz UIQCEXXXLAXETE-AAEUAGOBSA-N 2 2 315.383 3.083 20 10 DGCDLP Cc1cc(O)c(C[NH2+][C@@H]2C[NH2+]CC[C@@H]2c2ccccc2)cc1C ZINC000849350483 631900292 /nfs/dbraw/zinc/90/02/92/631900292.db2.gz YUTNTAJXTLXNJV-RTBURBONSA-N 2 2 310.441 3.244 20 10 DGCDLP CN(C)c1ccc(/C=C\C[NH2+]C[C@@H]2CC[N@@H+]2C(C)(C)C)cc1 ZINC000850341809 632118456 /nfs/dbraw/zinc/11/84/56/632118456.db2.gz ATBVTELVDHCNJW-MJRGOJFPSA-N 2 2 301.478 3.228 20 10 DGCDLP CN(C)c1ccc(/C=C\C[NH2+]C[C@@H]2CC[N@H+]2C(C)(C)C)cc1 ZINC000850341809 632118458 /nfs/dbraw/zinc/11/84/58/632118458.db2.gz ATBVTELVDHCNJW-MJRGOJFPSA-N 2 2 301.478 3.228 20 10 DGCDLP CCC[N@H+](Cc1cc(Cl)c(F)cc1O)C1CC[NH2+]CC1 ZINC001577526878 1191906831 /nfs/dbraw/zinc/90/68/31/1191906831.db2.gz ICOREBCCBHVXLW-UHFFFAOYSA-N 2 2 300.805 3.149 20 10 DGCDLP CN(C)c1ccc(C[NH2+][C@@H](Cn2cc[nH+]c2)C(C)(C)C)cc1F ZINC001473950135 1183836319 /nfs/dbraw/zinc/83/63/19/1183836319.db2.gz DXWMEQTUYORLGW-KRWDZBQOSA-N 2 2 318.440 3.293 20 10 DGCDLP CC[N@@H+]1CCC[C@@H](C[NH2+]Cc2cc(Cl)cc(F)c2O)C1 ZINC001657000137 1196091605 /nfs/dbraw/zinc/09/16/05/1196091605.db2.gz MJOJXZDLKMJHHB-NSHDSACASA-N 2 2 300.805 3.006 20 10 DGCDLP CC[N@H+]1CCC[C@@H](C[NH2+]Cc2cc(Cl)cc(F)c2O)C1 ZINC001657000137 1196091608 /nfs/dbraw/zinc/09/16/08/1196091608.db2.gz MJOJXZDLKMJHHB-NSHDSACASA-N 2 2 300.805 3.006 20 10 DGCDLP Cc1ccc(C[NH2+][C@H](Cn2cc[nH+]c2)c2ccccc2)c(O)c1 ZINC001658789199 1196301466 /nfs/dbraw/zinc/30/14/66/1196301466.db2.gz YLMORHGTJFCTBA-GOSISDBHSA-N 2 2 307.397 3.428 20 10 DGCDLP CC[NH+](CC)CCC[N@H+](CC)Cc1cc(F)cc(F)c1O ZINC001659699946 1196407219 /nfs/dbraw/zinc/40/72/19/1196407219.db2.gz SXFGRVBGSLFLEW-UHFFFAOYSA-N 2 2 300.393 3.224 20 10 DGCDLP CC[NH+](CC)CCC[N@@H+](CC)Cc1cc(F)cc(F)c1O ZINC001659699946 1196407221 /nfs/dbraw/zinc/40/72/21/1196407221.db2.gz SXFGRVBGSLFLEW-UHFFFAOYSA-N 2 2 300.393 3.224 20 10 DGCDLP c1ccc(NCCC[NH2+]Cc2ccc(N3CCCC3)cc2)[nH+]c1 ZINC001661643167 1196627379 /nfs/dbraw/zinc/62/73/79/1196627379.db2.gz VKXVIDVZAWYWLB-UHFFFAOYSA-N 2 2 310.445 3.274 20 10 DGCDLP C[N@H+](C1CC1)C1CC[NH+](Cc2ccc(N3CCCC3)cc2)CC1 ZINC001204328268 1090950487 /nfs/dbraw/zinc/95/04/87/1090950487.db2.gz FLANKPHCQGJAOD-UHFFFAOYSA-N 2 2 313.489 3.345 20 10 DGCDLP C[N@@H+](C1CC1)C1CC[NH+](Cc2ccc(N3CCCC3)cc2)CC1 ZINC001204328268 1090950492 /nfs/dbraw/zinc/95/04/92/1090950492.db2.gz FLANKPHCQGJAOD-UHFFFAOYSA-N 2 2 313.489 3.345 20 10 DGCDLP CC[N@H+](CCn1cc[nH+]c1)Cc1ccc(N2CCCCC2)cc1 ZINC001138222170 1091119785 /nfs/dbraw/zinc/11/97/85/1091119785.db2.gz KARCGUIEVRYCQA-UHFFFAOYSA-N 2 2 312.461 3.396 20 10 DGCDLP CC[N@@H+](CCn1cc[nH+]c1)Cc1ccc(N2CCCCC2)cc1 ZINC001138222170 1091119790 /nfs/dbraw/zinc/11/97/90/1091119790.db2.gz KARCGUIEVRYCQA-UHFFFAOYSA-N 2 2 312.461 3.396 20 10 DGCDLP C[N@@H+]1CCC[C@H]2C[NH+](Cc3ccc(N4CCCCC4)cc3)C[C@H]21 ZINC001138220673 1091120252 /nfs/dbraw/zinc/12/02/52/1091120252.db2.gz MAMSWYIXGVPVLI-AZUAARDMSA-N 2 2 313.489 3.203 20 10 DGCDLP C[N@H+]1CCC[C@H]2C[NH+](Cc3ccc(N4CCCCC4)cc3)C[C@H]21 ZINC001138220673 1091120254 /nfs/dbraw/zinc/12/02/54/1091120254.db2.gz MAMSWYIXGVPVLI-AZUAARDMSA-N 2 2 313.489 3.203 20 10 DGCDLP C[NH+]1CCC[C@H]2C[N@H+](Cc3ccc(N4CCCCC4)cc3)C[C@H]21 ZINC001138220673 1091120258 /nfs/dbraw/zinc/12/02/58/1091120258.db2.gz MAMSWYIXGVPVLI-AZUAARDMSA-N 2 2 313.489 3.203 20 10 DGCDLP C[NH+]1CCC[C@H]2C[N@@H+](Cc3ccc(N4CCCCC4)cc3)C[C@H]21 ZINC001138220673 1091120262 /nfs/dbraw/zinc/12/02/62/1091120262.db2.gz MAMSWYIXGVPVLI-AZUAARDMSA-N 2 2 313.489 3.203 20 10 DGCDLP CCN(CC)c1ccc(C[N@@H+]2CC[C@@]3(C2)CCCC[NH2+]3)cc1 ZINC001222420526 1095605633 /nfs/dbraw/zinc/60/56/33/1095605633.db2.gz DRGBIZKKKRZSNJ-LJQANCHMSA-N 2 2 301.478 3.251 20 10 DGCDLP CCN(CC)c1ccc(C[N@H+]2CC[C@@]3(C2)CCCC[NH2+]3)cc1 ZINC001222420526 1095605639 /nfs/dbraw/zinc/60/56/39/1095605639.db2.gz DRGBIZKKKRZSNJ-LJQANCHMSA-N 2 2 301.478 3.251 20 10 DGCDLP CC(C)(C)c1ccc(C[N@@H+]2CC[C@@]3(C2)CCCC[NH2+]3)c(O)c1 ZINC001222436783 1095614426 /nfs/dbraw/zinc/61/44/26/1095614426.db2.gz ZZZJOTPMIWFOET-LJQANCHMSA-N 2 2 302.462 3.408 20 10 DGCDLP CC(C)(C)c1ccc(C[N@H+]2CC[C@@]3(C2)CCCC[NH2+]3)c(O)c1 ZINC001222436783 1095614432 /nfs/dbraw/zinc/61/44/32/1095614432.db2.gz ZZZJOTPMIWFOET-LJQANCHMSA-N 2 2 302.462 3.408 20 10 DGCDLP Cc1cc(O)c(C[N@@H+]2CC[C@H](Oc3cc[nH+]cc3)C2)cc1Cl ZINC001231869926 1097869452 /nfs/dbraw/zinc/86/94/52/1097869452.db2.gz ARFMWYHKXXWLAY-HNNXBMFYSA-N 2 2 318.804 3.402 20 10 DGCDLP Cc1cc(O)c(C[N@H+]2CC[C@H](Oc3cc[nH+]cc3)C2)cc1Cl ZINC001231869926 1097869463 /nfs/dbraw/zinc/86/94/63/1097869463.db2.gz ARFMWYHKXXWLAY-HNNXBMFYSA-N 2 2 318.804 3.402 20 10 DGCDLP Cc1cc(C[N@@H+]2CC[C@H]3[NH2+]CC[C@H]3C2)c(C)n1-c1ccccc1 ZINC001235265264 1098937243 /nfs/dbraw/zinc/93/72/43/1098937243.db2.gz CMCGAWOVMSRYKG-FXAWDEMLSA-N 2 2 309.457 3.278 20 10 DGCDLP Cc1cc(C[N@H+]2CC[C@H]3[NH2+]CC[C@H]3C2)c(C)n1-c1ccccc1 ZINC001235265264 1098937255 /nfs/dbraw/zinc/93/72/55/1098937255.db2.gz CMCGAWOVMSRYKG-FXAWDEMLSA-N 2 2 309.457 3.278 20 10 DGCDLP C[N@@H+]1CCC[C@H]2C[NH+](Cc3ccc(C(C)(C)C)cc3O)C[C@H]21 ZINC001235678089 1099122791 /nfs/dbraw/zinc/12/27/91/1099122791.db2.gz ADYPRGVBONWUPI-WMLDXEAASA-N 2 2 302.462 3.216 20 10 DGCDLP C[N@H+]1CCC[C@H]2C[NH+](Cc3ccc(C(C)(C)C)cc3O)C[C@H]21 ZINC001235678089 1099122795 /nfs/dbraw/zinc/12/27/95/1099122795.db2.gz ADYPRGVBONWUPI-WMLDXEAASA-N 2 2 302.462 3.216 20 10 DGCDLP C[NH+]1CCC[C@H]2C[N@H+](Cc3ccc(C(C)(C)C)cc3O)C[C@H]21 ZINC001235678089 1099122797 /nfs/dbraw/zinc/12/27/97/1099122797.db2.gz ADYPRGVBONWUPI-WMLDXEAASA-N 2 2 302.462 3.216 20 10 DGCDLP C[NH+]1CCC[C@H]2C[N@@H+](Cc3ccc(C(C)(C)C)cc3O)C[C@H]21 ZINC001235678089 1099122801 /nfs/dbraw/zinc/12/28/01/1099122801.db2.gz ADYPRGVBONWUPI-WMLDXEAASA-N 2 2 302.462 3.216 20 10 DGCDLP C[N@@H+](Cc1c(O)ccc(Cl)c1Cl)C[C@H]1CCC[NH2+]C1 ZINC001235957042 1099288772 /nfs/dbraw/zinc/28/87/72/1099288772.db2.gz KBFKEGORZIWYSJ-JTQLQIEISA-N 2 2 303.233 3.130 20 10 DGCDLP C[N@H+](Cc1c(O)ccc(Cl)c1Cl)C[C@H]1CCC[NH2+]C1 ZINC001235957042 1099288785 /nfs/dbraw/zinc/28/87/85/1099288785.db2.gz KBFKEGORZIWYSJ-JTQLQIEISA-N 2 2 303.233 3.130 20 10 DGCDLP CCC[N@H+](Cc1c(O)ccc(F)c1Cl)C1CC[NH2+]CC1 ZINC001236183905 1099452144 /nfs/dbraw/zinc/45/21/44/1099452144.db2.gz BJCYFNPZBVIJTD-UHFFFAOYSA-N 2 2 300.805 3.149 20 10 DGCDLP CCC[N@@H+](Cc1c(O)ccc(F)c1Cl)C1CC[NH2+]CC1 ZINC001236183905 1099452147 /nfs/dbraw/zinc/45/21/47/1099452147.db2.gz BJCYFNPZBVIJTD-UHFFFAOYSA-N 2 2 300.805 3.149 20 10 DGCDLP Cc1ccc(C[N@H+](Cc2ccccc2)[C@@H]2CCC[NH2+]C2)c(O)c1 ZINC001236269593 1099511984 /nfs/dbraw/zinc/51/19/84/1099511984.db2.gz IYOSWWKYKYSKPV-LJQANCHMSA-N 2 2 310.441 3.455 20 10 DGCDLP Cc1ccc(C[N@@H+](Cc2ccccc2)[C@@H]2CCC[NH2+]C2)c(O)c1 ZINC001236269593 1099511993 /nfs/dbraw/zinc/51/19/93/1099511993.db2.gz IYOSWWKYKYSKPV-LJQANCHMSA-N 2 2 310.441 3.455 20 10 DGCDLP CC[N@@H+](Cc1cc(Cl)c(Cl)cc1O)C[C@@H]1CC[NH2+]C1 ZINC001236410814 1099585338 /nfs/dbraw/zinc/58/53/38/1099585338.db2.gz KQXCVDILAKTPGK-SNVBAGLBSA-N 2 2 303.233 3.130 20 10 DGCDLP CC[N@H+](Cc1cc(Cl)c(Cl)cc1O)C[C@@H]1CC[NH2+]C1 ZINC001236410814 1099585348 /nfs/dbraw/zinc/58/53/48/1099585348.db2.gz KQXCVDILAKTPGK-SNVBAGLBSA-N 2 2 303.233 3.130 20 10 DGCDLP C[NH+]1CCC2(C[NH+](Cc3cc(Cl)c(Cl)cc3O)C2)CC1 ZINC001236798693 1099793711 /nfs/dbraw/zinc/79/37/11/1099793711.db2.gz KSRNXEVGTMFHFH-UHFFFAOYSA-N 2 2 315.244 3.227 20 10 DGCDLP Cc1cc(F)cc(C[NH+]2CCC(Oc3cc[nH+]cc3)CC2)c1O ZINC001238059196 1100345634 /nfs/dbraw/zinc/34/56/34/1100345634.db2.gz AYDJKRFNYLQSKF-UHFFFAOYSA-N 2 2 316.376 3.278 20 10 DGCDLP CC[NH+](CC)C1CC[NH+](Cc2cc(OC)c(C)cc2O)CC1 ZINC000160232470 1101494086 /nfs/dbraw/zinc/49/40/86/1101494086.db2.gz FWDGCHLGBXVGLI-UHFFFAOYSA-N 2 2 306.450 3.015 20 10 DGCDLP Cc1cc(O)c(C[NH+]2CCC[C@]3(CC[N@@H+](C)C3)C2)cc1Cl ZINC001276372210 1103689130 /nfs/dbraw/zinc/68/91/30/1103689130.db2.gz JOQUUYDTIPHBTD-QGZVFWFLSA-N 2 2 308.853 3.272 20 10 DGCDLP Cc1cc(O)c(C[NH+]2CCC[C@]3(CC[N@H+](C)C3)C2)cc1Cl ZINC001276372210 1103689147 /nfs/dbraw/zinc/68/91/47/1103689147.db2.gz JOQUUYDTIPHBTD-QGZVFWFLSA-N 2 2 308.853 3.272 20 10 DGCDLP Cc1cc(O)c(C[N@H+]2CCC[C@]3(CC[NH+](C)C3)C2)cc1Cl ZINC001276372210 1103689155 /nfs/dbraw/zinc/68/91/55/1103689155.db2.gz JOQUUYDTIPHBTD-QGZVFWFLSA-N 2 2 308.853 3.272 20 10 DGCDLP Cc1cc(O)c(C[N@@H+]2CCC[C@]3(CC[NH+](C)C3)C2)cc1Cl ZINC001276372210 1103689159 /nfs/dbraw/zinc/68/91/59/1103689159.db2.gz JOQUUYDTIPHBTD-QGZVFWFLSA-N 2 2 308.853 3.272 20 10 DGCDLP C[C@@]1(C[NH3+])CCCC[N@H+](Cc2cccc(C(F)(F)F)c2O)C1 ZINC001206563648 1103791899 /nfs/dbraw/zinc/79/18/99/1103791899.db2.gz GDBXJJXTLJXIMO-HNNXBMFYSA-N 2 2 316.367 3.362 20 10 DGCDLP C[C@@]1(C[NH3+])CCCC[N@@H+](Cc2cccc(C(F)(F)F)c2O)C1 ZINC001206563648 1103791912 /nfs/dbraw/zinc/79/19/12/1103791912.db2.gz GDBXJJXTLJXIMO-HNNXBMFYSA-N 2 2 316.367 3.362 20 10 DGCDLP C[N@@H+]1C[C@H]2C[C@@H](C1)[NH+](Cc1cccc(-c3ccccc3)c1O)C2 ZINC001276139935 1105028988 /nfs/dbraw/zinc/02/89/88/1105028988.db2.gz JRZROCHEWXHXTG-QAPCUYQASA-N 2 2 308.425 3.195 20 10 DGCDLP C[N@H+]1C[C@H]2C[C@@H](C1)[NH+](Cc1cccc(-c3ccccc3)c1O)C2 ZINC001276139935 1105028991 /nfs/dbraw/zinc/02/89/91/1105028991.db2.gz JRZROCHEWXHXTG-QAPCUYQASA-N 2 2 308.425 3.195 20 10 DGCDLP C[NH+]1C[C@H]2C[C@@H](C1)[N@H+](Cc1cccc(-c3ccccc3)c1O)C2 ZINC001276139935 1105028994 /nfs/dbraw/zinc/02/89/94/1105028994.db2.gz JRZROCHEWXHXTG-QAPCUYQASA-N 2 2 308.425 3.195 20 10 DGCDLP C[NH+]1C[C@H]2C[C@@H](C1)[N@@H+](Cc1cccc(-c3ccccc3)c1O)C2 ZINC001276139935 1105028997 /nfs/dbraw/zinc/02/89/97/1105028997.db2.gz JRZROCHEWXHXTG-QAPCUYQASA-N 2 2 308.425 3.195 20 10 DGCDLP C[N@H+](Cc1ccccc1O)C1CC[NH+](Cc2ccccc2)CC1 ZINC000179560739 432062658 /nfs/dbraw/zinc/06/26/58/432062658.db2.gz JCHYJWVAPOJLBV-UHFFFAOYSA-N 2 2 310.441 3.489 20 10 DGCDLP C[N@@H+](Cc1ccccc1O)C1CC[NH+](Cc2ccccc2)CC1 ZINC000179560739 432062661 /nfs/dbraw/zinc/06/26/61/432062661.db2.gz JCHYJWVAPOJLBV-UHFFFAOYSA-N 2 2 310.441 3.489 20 10 DGCDLP CC[C@H]([NH2+]C[C@@H](C)Cn1cc[nH+]c1C)c1ccc(F)cc1O ZINC000286277446 131228294 /nfs/dbraw/zinc/22/82/94/131228294.db2.gz VPBYOVMTPDWHKJ-WBMJQRKESA-N 2 2 305.397 3.413 20 10 DGCDLP CCOc1ccc(O)c(C[NH+]2CCC([NH+]3CCCCC3)CC2)c1 ZINC000271048306 432321333 /nfs/dbraw/zinc/32/13/33/432321333.db2.gz SQBOKGFLYAEWDM-UHFFFAOYSA-N 2 2 318.461 3.241 20 10 DGCDLP C[C@H]1CC[N@H+](Cc2c(O)ccc(Cl)c2F)C[C@H]1n1cc[nH+]c1 ZINC000248892528 432327745 /nfs/dbraw/zinc/32/77/45/432327745.db2.gz SJPKRNAHUGEQES-SMDDNHRTSA-N 2 2 323.799 3.464 20 10 DGCDLP C[C@H]1CC[N@@H+](Cc2c(O)ccc(Cl)c2F)C[C@H]1n1cc[nH+]c1 ZINC000248892528 432327748 /nfs/dbraw/zinc/32/77/48/432327748.db2.gz SJPKRNAHUGEQES-SMDDNHRTSA-N 2 2 323.799 3.464 20 10 DGCDLP C[C@H]1CC[N@H+](Cc2ccc(N(C)C)c(F)c2)C[C@@H]1n1cc[nH+]c1 ZINC000271265732 432364423 /nfs/dbraw/zinc/36/44/23/432364423.db2.gz LTOQGRRFMNFXFV-KSSFIOAISA-N 2 2 316.424 3.171 20 10 DGCDLP C[C@H]1CC[N@@H+](Cc2ccc(N(C)C)c(F)c2)C[C@@H]1n1cc[nH+]c1 ZINC000271265732 432364429 /nfs/dbraw/zinc/36/44/29/432364429.db2.gz LTOQGRRFMNFXFV-KSSFIOAISA-N 2 2 316.424 3.171 20 10 DGCDLP C[C@@H]([NH2+][C@@H](C)CC[NH+](C)C)c1cc(Br)ccc1O ZINC000273466077 432602249 /nfs/dbraw/zinc/60/22/49/432602249.db2.gz DSVSUGPATZEJIS-WDEREUQCSA-N 2 2 315.255 3.146 20 10 DGCDLP Oc1ccc(Cl)cc1C[NH2+]C1CCN(c2cccc[nH+]2)CC1 ZINC000238063131 432811167 /nfs/dbraw/zinc/81/11/67/432811167.db2.gz HYZLHGFNAJYKOY-UHFFFAOYSA-N 2 2 317.820 3.199 20 10 DGCDLP Cc1cccc(C[N@@H+](Cc2ccco2)C2CC[NH+](C)CC2)c1O ZINC000290318775 433030318 /nfs/dbraw/zinc/03/03/18/433030318.db2.gz CTWRWQGWDYTWFU-UHFFFAOYSA-N 2 2 314.429 3.390 20 10 DGCDLP Cc1cccc(C[N@H+](Cc2ccco2)C2CC[NH+](C)CC2)c1O ZINC000290318775 433030320 /nfs/dbraw/zinc/03/03/20/433030320.db2.gz CTWRWQGWDYTWFU-UHFFFAOYSA-N 2 2 314.429 3.390 20 10 DGCDLP CN(C)c1ccc(C[N@@H+]2CCC[C@@H](c3[nH+]ccn3C)C2)cc1F ZINC000373227184 433133501 /nfs/dbraw/zinc/13/35/01/433133501.db2.gz JHVMTPZSOZXKED-OAHLLOKOSA-N 2 2 316.424 3.005 20 10 DGCDLP CN(C)c1ccc(C[N@H+]2CCC[C@@H](c3[nH+]ccn3C)C2)cc1F ZINC000373227184 433133510 /nfs/dbraw/zinc/13/35/10/433133510.db2.gz JHVMTPZSOZXKED-OAHLLOKOSA-N 2 2 316.424 3.005 20 10 DGCDLP Oc1cccc2c1[C@@H]([NH2+]C1CC[NH+](Cc3ccncc3)CC1)CC2 ZINC000296123259 434515243 /nfs/dbraw/zinc/51/52/43/434515243.db2.gz VLIQDSRVMCTMRK-SFHVURJKSA-N 2 2 323.440 3.029 20 10 DGCDLP C[C@H]([NH2+]CCc1cn2c([nH+]1)CCCC2)c1cc(Cl)ccc1O ZINC000368477188 434575539 /nfs/dbraw/zinc/57/55/39/434575539.db2.gz DKOXISMRDYRODR-LBPRGKRZSA-N 2 2 319.836 3.472 20 10 DGCDLP Oc1c(Cl)cccc1C[N@@H+]1CC[C@@H](Oc2cc[nH+]cc2)C1 ZINC000369462729 434596187 /nfs/dbraw/zinc/59/61/87/434596187.db2.gz MAXNBPVTYRUQSL-CQSZACIVSA-N 2 2 304.777 3.094 20 10 DGCDLP Oc1c(Cl)cccc1C[N@H+]1CC[C@@H](Oc2cc[nH+]cc2)C1 ZINC000369462729 434596192 /nfs/dbraw/zinc/59/61/92/434596192.db2.gz MAXNBPVTYRUQSL-CQSZACIVSA-N 2 2 304.777 3.094 20 10 DGCDLP C[C@H]([NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1)c1cc(F)cc(F)c1O ZINC000853242054 620681308 /nfs/dbraw/zinc/68/13/08/620681308.db2.gz ZUPRWVGLYZETHW-GXTWGEPZSA-N 2 2 324.415 3.443 20 10 DGCDLP C[C@H]([NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1)c1cc(F)cc(F)c1O ZINC000853242054 620681309 /nfs/dbraw/zinc/68/13/09/620681309.db2.gz ZUPRWVGLYZETHW-GXTWGEPZSA-N 2 2 324.415 3.443 20 10 DGCDLP CCCN(CCC)c1ccc(C[NH2+]C[C@@H]2CCC[N@@H+]2C)cc1 ZINC000920415043 620799756 /nfs/dbraw/zinc/79/97/56/620799756.db2.gz DDFNRYFZRZEDIR-IBGZPJMESA-N 2 2 303.494 3.497 20 10 DGCDLP CCCN(CCC)c1ccc(C[NH2+]C[C@@H]2CCC[N@H+]2C)cc1 ZINC000920415043 620799757 /nfs/dbraw/zinc/79/97/57/620799757.db2.gz DDFNRYFZRZEDIR-IBGZPJMESA-N 2 2 303.494 3.497 20 10 DGCDLP CN(C)c1ccc(/C=C\C[NH+]2CCC([NH2+]C3CCC3)CC2)cc1 ZINC000897982937 619203051 /nfs/dbraw/zinc/20/30/51/619203051.db2.gz RZDFJJKGWWVIRC-PLNGDYQASA-N 2 2 313.489 3.372 20 10 DGCDLP Cc1ccc([C@H](C)[NH2+][C@H](CC[NH+](C)C)c2cccnc2)c(O)c1 ZINC000903379399 619768229 /nfs/dbraw/zinc/76/82/29/619768229.db2.gz GLAKDISMNUEMAK-MAUKXSAKSA-N 2 2 313.445 3.439 20 10 DGCDLP CC(=O)c1cc(Cl)cc(C[NH2+][C@H]2CC[NH2+]C23CCCC3)c1O ZINC000903487015 619781881 /nfs/dbraw/zinc/78/18/81/619781881.db2.gz ZUQBPRIFXFMYBG-HNNXBMFYSA-N 2 2 322.836 3.013 20 10 DGCDLP CN(C)c1cc(F)c(C[NH2+]CCCNc2cccc[nH+]2)cc1F ZINC000858148808 621158812 /nfs/dbraw/zinc/15/88/12/621158812.db2.gz LXALOQSXBWGJKU-UHFFFAOYSA-N 2 2 320.387 3.018 20 10 DGCDLP CN(C)c1ccc(/C=C/C[NH2+]C[C@H]2CC[N@@H+]2C2CCCC2)cc1 ZINC000858286210 621171847 /nfs/dbraw/zinc/17/18/47/621171847.db2.gz UUQCXUXSFUZVJB-RRFGBZISSA-N 2 2 313.489 3.372 20 10 DGCDLP CN(C)c1ccc(/C=C/C[NH2+]C[C@H]2CC[N@H+]2C2CCCC2)cc1 ZINC000858286210 621171850 /nfs/dbraw/zinc/17/18/50/621171850.db2.gz UUQCXUXSFUZVJB-RRFGBZISSA-N 2 2 313.489 3.372 20 10 DGCDLP Cc1cc(Cl)cc(C[N@@H+]2CC[C@@H](Oc3cc[nH+]cc3)C2)c1O ZINC000789770314 625563162 /nfs/dbraw/zinc/56/31/62/625563162.db2.gz VBCIQHJGERNREJ-MRXNPFEDSA-N 2 2 318.804 3.402 20 10 DGCDLP Cc1cc(Cl)cc(C[N@H+]2CC[C@@H](Oc3cc[nH+]cc3)C2)c1O ZINC000789770314 625563165 /nfs/dbraw/zinc/56/31/65/625563165.db2.gz VBCIQHJGERNREJ-MRXNPFEDSA-N 2 2 318.804 3.402 20 10 DGCDLP Oc1ccc(-c2ccccc2)cc1C[N@@H+]1C[C@@H]2CCC[NH2+][C@@H]2C1 ZINC000769443112 622528214 /nfs/dbraw/zinc/52/82/14/622528214.db2.gz QBGBJJHDJXDDKU-PKOBYXMFSA-N 2 2 308.425 3.243 20 10 DGCDLP Oc1ccc(-c2ccccc2)cc1C[N@H+]1C[C@@H]2CCC[NH2+][C@@H]2C1 ZINC000769443112 622528217 /nfs/dbraw/zinc/52/82/17/622528217.db2.gz QBGBJJHDJXDDKU-PKOBYXMFSA-N 2 2 308.425 3.243 20 10 DGCDLP C[C@@H]([NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1)c1c(O)cccc1F ZINC000886639840 627178533 /nfs/dbraw/zinc/17/85/33/627178533.db2.gz MRBKWGMSHOAFDY-HIFRSBDPSA-N 2 2 306.425 3.304 20 10 DGCDLP C[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1)c1c(O)cccc1F ZINC000886639840 627178536 /nfs/dbraw/zinc/17/85/36/627178536.db2.gz MRBKWGMSHOAFDY-HIFRSBDPSA-N 2 2 306.425 3.304 20 10 DGCDLP CCN(CC)c1ccc(C[N@@H+]2CC[C@@]3(CC[NH+](C)C3)C2)cc1F ZINC000814178140 627547495 /nfs/dbraw/zinc/54/74/95/627547495.db2.gz DFXSKQGDHWEHEQ-LJQANCHMSA-N 2 2 319.468 3.200 20 10 DGCDLP CCN(CC)c1ccc(C[N@H+]2CC[C@@]3(CC[NH+](C)C3)C2)cc1F ZINC000814178140 627547499 /nfs/dbraw/zinc/54/74/99/627547499.db2.gz DFXSKQGDHWEHEQ-LJQANCHMSA-N 2 2 319.468 3.200 20 10 DGCDLP CCN(CC)c1ccc(C[NH+]2CC[C@@]3(CC[N@H+](C)C3)C2)cc1F ZINC000814178140 627547501 /nfs/dbraw/zinc/54/75/01/627547501.db2.gz DFXSKQGDHWEHEQ-LJQANCHMSA-N 2 2 319.468 3.200 20 10 DGCDLP CCN(CC)c1ccc(C[NH+]2CC[C@@]3(CC[N@@H+](C)C3)C2)cc1F ZINC000814178140 627547504 /nfs/dbraw/zinc/54/75/04/627547504.db2.gz DFXSKQGDHWEHEQ-LJQANCHMSA-N 2 2 319.468 3.200 20 10 DGCDLP C[NH+](C)CC1(C[NH2+]Cc2cc(Cl)c(F)cc2O)CCCC1 ZINC000816569538 627809867 /nfs/dbraw/zinc/80/98/67/627809867.db2.gz OQSOOWTYCBJQET-UHFFFAOYSA-N 2 2 314.832 3.396 20 10 DGCDLP Cc1ccc2c(c1)CC[C@H]2[NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000817938559 627966534 /nfs/dbraw/zinc/96/65/34/627966534.db2.gz MZMAICANSUOCOG-WOJBJXKFSA-N 2 2 309.457 3.338 20 10 DGCDLP COc1ccccc1[C@H](C)[NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000817937983 627966861 /nfs/dbraw/zinc/96/68/61/627966861.db2.gz AWYGRBUSDANTDC-KBXCAEBGSA-N 2 2 313.445 3.112 20 10 DGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+][C@@H]2CCC[C@@H]2CCCF)cc1 ZINC000817939544 627967575 /nfs/dbraw/zinc/96/75/75/627967575.db2.gz CKPXRDZNOFFDJY-KBAYOESNSA-N 2 2 307.457 3.260 20 10 DGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+][C@H](C2CC2)C2CCCC2)cc1 ZINC000817940872 627968457 /nfs/dbraw/zinc/96/84/57/627968457.db2.gz LTNCDPAEQNGLAX-MOPGFXCFSA-N 2 2 301.478 3.311 20 10 DGCDLP Cc1ccc([C@@H](C)[NH2+]C[C@@H]([NH3+])c2ccc(N(C)C)cc2)c(C)n1 ZINC000817941137 627968879 /nfs/dbraw/zinc/96/88/79/627968879.db2.gz JDWNRLQWZKQWGG-AUUYWEPGSA-N 2 2 312.461 3.115 20 10 DGCDLP C[C@@H]([NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1)c1ccc(Cl)nc1 ZINC000817944302 627969644 /nfs/dbraw/zinc/96/96/44/627969644.db2.gz ZASUBBGCJZSUED-WBMJQRKESA-N 2 2 318.852 3.152 20 10 DGCDLP CC(C)C[C@@H](C[NH3+])[NH2+][C@H](C)c1cccc(C(F)(F)F)c1O ZINC000817959889 627975781 /nfs/dbraw/zinc/97/57/81/627975781.db2.gz WHVKONDROZCXQH-MNOVXSKESA-N 2 2 304.356 3.435 20 10 DGCDLP CC[C@H]([NH2+][C@@H](C[NH3+])C1CC1)c1ccc(C(F)(F)F)cc1O ZINC000817959689 627976282 /nfs/dbraw/zinc/97/62/82/627976282.db2.gz GIJGAACJWZEXRK-STQMWFEESA-N 2 2 302.340 3.189 20 10 DGCDLP CCC[NH2+]CC[NH2+][C@@H](CC)c1ccc(C(F)(F)F)cc1O ZINC000817963566 627976780 /nfs/dbraw/zinc/97/67/80/627976780.db2.gz UZSYFBVBBNENAM-ZDUSSCGKSA-N 2 2 304.356 3.451 20 10 DGCDLP C[C@@H]([NH2+][C@@H]1CC[NH2+][C@H](C)C1)c1cccc(C(F)(F)F)c1O ZINC000817970892 627979732 /nfs/dbraw/zinc/97/97/32/627979732.db2.gz GVZLGZJOHYTVPK-GMTAPVOTSA-N 2 2 302.340 3.202 20 10 DGCDLP CC[NH2+][C@H](C)C[NH2+][C@@H](CC)c1ccc(C(F)(F)F)cc1O ZINC000817973788 627980378 /nfs/dbraw/zinc/98/03/78/627980378.db2.gz WPFMSKLOTJDCQP-MFKMUULPSA-N 2 2 304.356 3.450 20 10 DGCDLP C[C@H]([NH2+][C@H]1CCCC[NH2+]C1)c1ccc(N2CCCCC2)cc1 ZINC000817983512 627983470 /nfs/dbraw/zinc/98/34/70/627983470.db2.gz FPJVKDWWVBFBLY-WMZOPIPTSA-N 2 2 301.478 3.470 20 10 DGCDLP CC[C@H](C[NH2+]C/C=C/c1ccc(N(C)C)cc1)[NH+]1CCCC1 ZINC000835035931 629830330 /nfs/dbraw/zinc/83/03/30/629830330.db2.gz LQGOQYRKMCJNLK-LKGOPFMKSA-N 2 2 301.478 3.230 20 10 DGCDLP CCCC[C@H](C[NH3+])[NH2+]Cc1cc(C)cc(Br)c1O ZINC000841030759 630398154 /nfs/dbraw/zinc/39/81/54/630398154.db2.gz QKROSDLOAJVPMZ-GFCCVEGCSA-N 2 2 315.255 3.070 20 10 DGCDLP [NH3+][C@H](C[NH2+]Cc1ccc(N2CCCCC2)cc1)c1ccccc1 ZINC000841038095 630399877 /nfs/dbraw/zinc/39/98/77/630399877.db2.gz UGYVVHJCNVJNAH-HXUWFJFHSA-N 2 2 309.457 3.467 20 10 DGCDLP CSc1ccc(C[NH2+]C[C@@H]([NH3+])c2ccc(N(C)C)cc2)cc1 ZINC000841041198 630400453 /nfs/dbraw/zinc/40/04/53/630400453.db2.gz BTVGJMUXMMZAST-GOSISDBHSA-N 2 2 315.486 3.264 20 10 DGCDLP C[C@H](Cc1ccsc1)[NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000841044737 630401042 /nfs/dbraw/zinc/40/10/42/630401042.db2.gz FKMSMFDWWMHEBS-DYVFJYSZSA-N 2 2 303.475 3.035 20 10 DGCDLP C[C@@H](Cc1ccccc1F)[NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000841044068 630401354 /nfs/dbraw/zinc/40/13/54/630401354.db2.gz USOXDEZPXIABLY-LIRRHRJNSA-N 2 2 315.436 3.112 20 10 DGCDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+]C/C=C\c2ccc(F)cc2)cc1 ZINC000841046054 630401772 /nfs/dbraw/zinc/40/17/72/630401772.db2.gz VJYDAJFRUILBEW-LLHWWHOWSA-N 2 2 313.420 3.195 20 10 DGCDLP CN(C)c1ccc(/C=C\C[NH+]2CCC([NH2+]CC3CC3)CC2)cc1 ZINC000843054099 630608738 /nfs/dbraw/zinc/60/87/38/630608738.db2.gz CYWITHVKMXZXMG-ARJAWSKDSA-N 2 2 313.489 3.230 20 10 DGCDLP Cc1ccc2[nH+]cc(CN3CCCc4cc(C[NH3+])ccc43)n2c1 ZINC000843057750 630609628 /nfs/dbraw/zinc/60/96/28/630609628.db2.gz HURHSCZBIODAPR-UHFFFAOYSA-N 2 2 306.413 3.054 20 10 DGCDLP COc1c(C)c[nH+]c(CN2CCCc3cc(C[NH3+])ccc32)c1C ZINC000844219576 630712679 /nfs/dbraw/zinc/71/26/79/630712679.db2.gz LDKXKVNXYWUGMJ-UHFFFAOYSA-N 2 2 311.429 3.119 20 10 DGCDLP CC[C@H]([NH2+][C@H]1CC[N@H+](CC2CC2)C1)c1ccc(N(C)C)cc1 ZINC000157714919 659093768 /nfs/dbraw/zinc/09/37/68/659093768.db2.gz XFGLFFUEDXRNIC-HKUYNNGSSA-N 2 2 301.478 3.278 20 10 DGCDLP CC[C@H]([NH2+][C@H]1CC[N@@H+](CC2CC2)C1)c1ccc(N(C)C)cc1 ZINC000157714919 659093773 /nfs/dbraw/zinc/09/37/73/659093773.db2.gz XFGLFFUEDXRNIC-HKUYNNGSSA-N 2 2 301.478 3.278 20 10 DGCDLP CN(C)c1ccc(C[NH2+][C@H](Cn2cc[nH+]c2)C(C)(C)C)cc1F ZINC001473950136 1183836438 /nfs/dbraw/zinc/83/64/38/1183836438.db2.gz DXWMEQTUYORLGW-QGZVFWFLSA-N 2 2 318.440 3.293 20 10 DGCDLP CC(C)C[N@H+](C)CCC[NH2+]Cc1c(O)ccc(Cl)c1F ZINC001656569720 1196050690 /nfs/dbraw/zinc/05/06/90/1196050690.db2.gz RRFWDSVPNYYDDS-UHFFFAOYSA-N 2 2 302.821 3.252 20 10 DGCDLP CC(C)C[N@@H+](C)CCC[NH2+]Cc1c(O)ccc(Cl)c1F ZINC001656569720 1196050694 /nfs/dbraw/zinc/05/06/94/1196050694.db2.gz RRFWDSVPNYYDDS-UHFFFAOYSA-N 2 2 302.821 3.252 20 10 DGCDLP CCN(CC)c1ccc(C[NH2+]C[C@]2([NH+](C)C)CCSC2)cc1 ZINC001560363967 1189317995 /nfs/dbraw/zinc/31/79/95/1189317995.db2.gz NKJPSPQRNCNBJG-GOSISDBHSA-N 2 2 321.534 3.060 20 10 DGCDLP C[NH+](C)CC[C@@H]([NH2+]Cc1cc(F)cc(F)c1O)C(C)(C)C ZINC001661416116 1196603213 /nfs/dbraw/zinc/60/32/13/1196603213.db2.gz JPRFEHIPHRTDQC-CQSZACIVSA-N 2 2 300.393 3.126 20 10 DGCDLP Cc1c[nH+]ccc1O[C@@H]1CC[N@H+](Cc2cc(Cl)ccc2O)C1 ZINC001203665433 1090776222 /nfs/dbraw/zinc/77/62/22/1090776222.db2.gz JUDSMXOIPDYIMC-OAHLLOKOSA-N 2 2 318.804 3.402 20 10 DGCDLP Cc1c[nH+]ccc1O[C@@H]1CC[N@@H+](Cc2cc(Cl)ccc2O)C1 ZINC001203665433 1090776225 /nfs/dbraw/zinc/77/62/25/1090776225.db2.gz JUDSMXOIPDYIMC-OAHLLOKOSA-N 2 2 318.804 3.402 20 10 DGCDLP CCN(CC)c1ccc(C[N@H+](CC)CCn2cc[nH+]c2)cc1 ZINC001203945467 1090847255 /nfs/dbraw/zinc/84/72/55/1090847255.db2.gz MPIVSOJKKUHVAH-UHFFFAOYSA-N 2 2 300.450 3.251 20 10 DGCDLP CCN(CC)c1ccc(C[N@@H+](CC)CCn2cc[nH+]c2)cc1 ZINC001203945467 1090847262 /nfs/dbraw/zinc/84/72/62/1090847262.db2.gz MPIVSOJKKUHVAH-UHFFFAOYSA-N 2 2 300.450 3.251 20 10 DGCDLP CCN(CC)c1ccc(C[N@@H+]2C[C@H](C)CC[C@@H]2C[NH3+])c(OC)c1 ZINC001205817752 1091365030 /nfs/dbraw/zinc/36/50/30/1091365030.db2.gz QVTJELFZFYCFNG-CRAIPNDOSA-N 2 2 319.493 3.101 20 10 DGCDLP CCN(CC)c1ccc(C[N@H+]2C[C@H](C)CC[C@@H]2C[NH3+])c(OC)c1 ZINC001205817752 1091365039 /nfs/dbraw/zinc/36/50/39/1091365039.db2.gz QVTJELFZFYCFNG-CRAIPNDOSA-N 2 2 319.493 3.101 20 10 DGCDLP C[C@@H]1CC[C@H](C[NH3+])C[N@H+]1Cc1c(O)ccc(Cl)c1Cl ZINC001206810557 1091749457 /nfs/dbraw/zinc/74/94/57/1091749457.db2.gz NYFFQMSYQRGLKF-NXEZZACHSA-N 2 2 303.233 3.258 20 10 DGCDLP C[N@H+](Cc1ccc(-n2cc[nH+]c2)cc1)Cc1cc(F)ccc1O ZINC001140060448 1091753617 /nfs/dbraw/zinc/75/36/17/1091753617.db2.gz WIRXYMFTQKOPTI-UHFFFAOYSA-N 2 2 311.360 3.349 20 10 DGCDLP C[N@@H+](Cc1ccc(-n2cc[nH+]c2)cc1)Cc1cc(F)ccc1O ZINC001140060448 1091753623 /nfs/dbraw/zinc/75/36/23/1091753623.db2.gz WIRXYMFTQKOPTI-UHFFFAOYSA-N 2 2 311.360 3.349 20 10 DGCDLP Cc1cc(N2CC[NH+](Cc3cccc(Cl)c3O)CC2)cc[nH+]1 ZINC001231912976 1097890284 /nfs/dbraw/zinc/89/02/84/1097890284.db2.gz BLPDACZITSSCBJ-UHFFFAOYSA-N 2 2 317.820 3.071 20 10 DGCDLP CCN(CC)c1ccc(C[N@@H+]2CCCC[C@]23CC[NH2+]C3)cc1 ZINC001235127059 1098826354 /nfs/dbraw/zinc/82/63/54/1098826354.db2.gz WYNPIQFAPINNBF-LJQANCHMSA-N 2 2 301.478 3.251 20 10 DGCDLP CCN(CC)c1ccc(C[N@H+]2CCCC[C@]23CC[NH2+]C3)cc1 ZINC001235127059 1098826370 /nfs/dbraw/zinc/82/63/70/1098826370.db2.gz WYNPIQFAPINNBF-LJQANCHMSA-N 2 2 301.478 3.251 20 10 DGCDLP Oc1c(C[N@@H+]2C[C@H]3CCC[NH2+][C@H]3C2)cccc1-c1ccccc1 ZINC001235219508 1098888816 /nfs/dbraw/zinc/88/88/16/1098888816.db2.gz RJAGHYFGCCCIBD-APWZRJJASA-N 2 2 308.425 3.243 20 10 DGCDLP Oc1c(C[N@H+]2C[C@H]3CCC[NH2+][C@H]3C2)cccc1-c1ccccc1 ZINC001235219508 1098888830 /nfs/dbraw/zinc/88/88/30/1098888830.db2.gz RJAGHYFGCCCIBD-APWZRJJASA-N 2 2 308.425 3.243 20 10 DGCDLP CCN(CC)c1ccc(C[N@H+](C)[C@@H]2CCCC[C@@H]2[NH3+])c(OC)c1 ZINC001236219424 1099475756 /nfs/dbraw/zinc/47/57/56/1099475756.db2.gz VZMSYPYNDVYDIZ-ZWKOTPCHSA-N 2 2 319.493 3.243 20 10 DGCDLP CCN(CC)c1ccc(C[N@@H+](C)[C@@H]2CCCC[C@@H]2[NH3+])c(OC)c1 ZINC001236219424 1099475762 /nfs/dbraw/zinc/47/57/62/1099475762.db2.gz VZMSYPYNDVYDIZ-ZWKOTPCHSA-N 2 2 319.493 3.243 20 10 DGCDLP COc1cc(O)c(C[N@H+](C[C@@H]2CCC[NH2+]C2)C2CC2)c(Cl)c1 ZINC001236602690 1099697698 /nfs/dbraw/zinc/69/76/98/1099697698.db2.gz ZWIYZLFNXAAZMO-GFCCVEGCSA-N 2 2 324.852 3.018 20 10 DGCDLP COc1cc(O)c(C[N@@H+](C[C@@H]2CCC[NH2+]C2)C2CC2)c(Cl)c1 ZINC001236602690 1099697700 /nfs/dbraw/zinc/69/77/00/1099697700.db2.gz ZWIYZLFNXAAZMO-GFCCVEGCSA-N 2 2 324.852 3.018 20 10 DGCDLP Oc1cc2ccccc2cc1C[NH+]1CC2(C1)CC[N@H+](CC1CC1)C2 ZINC001236830864 1099818167 /nfs/dbraw/zinc/81/81/67/1099818167.db2.gz RPAVJQXYBBQAST-UHFFFAOYSA-N 2 2 322.452 3.463 20 10 DGCDLP Oc1cc2ccccc2cc1C[NH+]1CC2(C1)CC[N@@H+](CC1CC1)C2 ZINC001236830864 1099818175 /nfs/dbraw/zinc/81/81/75/1099818175.db2.gz RPAVJQXYBBQAST-UHFFFAOYSA-N 2 2 322.452 3.463 20 10 DGCDLP Cc1cc(C)c(C[NH+]2CC3(C2)CC[N@@H+](C2CCCC2)C3)c(O)c1 ZINC001276365210 1103562322 /nfs/dbraw/zinc/56/23/22/1103562322.db2.gz MCGRPTQFOLXLNC-UHFFFAOYSA-N 2 2 314.473 3.459 20 10 DGCDLP Cc1cc(C)c(C[NH+]2CC3(C2)CC[N@H+](C2CCCC2)C3)c(O)c1 ZINC001276365210 1103562330 /nfs/dbraw/zinc/56/23/30/1103562330.db2.gz MCGRPTQFOLXLNC-UHFFFAOYSA-N 2 2 314.473 3.459 20 10 DGCDLP CC[C@H](C)[NH2+][C@H](c1ccccc1O)[C@H]([NH3+])c1ccccc1O ZINC001257431302 1106587562 /nfs/dbraw/zinc/58/75/62/1106587562.db2.gz CFGQHZTZHITSTR-JBBXEZCESA-N 2 2 300.402 3.227 20 10 DGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+]Cc2ccc3c(c2)CCC3)cc1 ZINC001261370833 1107420344 /nfs/dbraw/zinc/42/03/44/1107420344.db2.gz WBNKSXBJEDZJDP-HXUWFJFHSA-N 2 2 309.457 3.031 20 10 DGCDLP CC[NH+](CC)CCC[N@H+](CC)Cc1cc(F)c(F)cc1O ZINC001308744497 1111468896 /nfs/dbraw/zinc/46/88/96/1111468896.db2.gz HPWGEULASZJHHB-UHFFFAOYSA-N 2 2 300.393 3.224 20 10 DGCDLP CC[NH+](CC)CCC[N@@H+](CC)Cc1cc(F)c(F)cc1O ZINC001308744497 1111468898 /nfs/dbraw/zinc/46/88/98/1111468898.db2.gz HPWGEULASZJHHB-UHFFFAOYSA-N 2 2 300.393 3.224 20 10 DGCDLP C[C@@H]([NH2+]C1CC[NH+](CC2CC2)CC1)c1ccc(F)c(F)c1O ZINC000191210268 296115232 /nfs/dbraw/zinc/11/52/32/296115232.db2.gz FPTDZOINWKXLDO-LLVKDONJSA-N 2 2 310.388 3.195 20 10 DGCDLP C[C@@H](Cn1cc[nH+]c1)[NH2+][C@@H](C)c1cc(Br)ccc1O ZINC000273372593 130112362 /nfs/dbraw/zinc/11/23/62/130112362.db2.gz GKCZNCZUYVNANL-QWRGUYRKSA-N 2 2 324.222 3.091 20 10 DGCDLP CC[C@H]([NH2+]C1CC[NH+](CCCOC)CC1)c1ccc(F)cc1O ZINC000285951536 288035250 /nfs/dbraw/zinc/03/52/50/288035250.db2.gz GEPRXEDPXZRUEC-KRWDZBQOSA-N 2 2 324.440 3.073 20 10 DGCDLP CC[N@@H+]1CC[C@@H](C[NH2+]Cc2cc(Cl)cc(Cl)c2O)C1 ZINC000037644074 431848623 /nfs/dbraw/zinc/84/86/23/431848623.db2.gz XJYGRUUNUPDMPC-JTQLQIEISA-N 2 2 303.233 3.130 20 10 DGCDLP CC[N@H+]1CC[C@@H](C[NH2+]Cc2cc(Cl)cc(Cl)c2O)C1 ZINC000037644074 431848625 /nfs/dbraw/zinc/84/86/25/431848625.db2.gz XJYGRUUNUPDMPC-JTQLQIEISA-N 2 2 303.233 3.130 20 10 DGCDLP CCCOc1ccc(C[N@H+](C)[C@H]2CC[NH+](C)[C@H](C)C2)c(O)c1 ZINC000093644672 431915932 /nfs/dbraw/zinc/91/59/32/431915932.db2.gz MBCAUUZWXDFRJQ-ZBFHGGJFSA-N 2 2 306.450 3.096 20 10 DGCDLP CCCOc1ccc(C[N@@H+](C)[C@H]2CC[NH+](C)[C@H](C)C2)c(O)c1 ZINC000093644672 431915933 /nfs/dbraw/zinc/91/59/33/431915933.db2.gz MBCAUUZWXDFRJQ-ZBFHGGJFSA-N 2 2 306.450 3.096 20 10 DGCDLP CCCOc1ccc(C[NH+](C)[C@H]2CC[N@H+](C)[C@H](C)C2)c(O)c1 ZINC000093644672 431915934 /nfs/dbraw/zinc/91/59/34/431915934.db2.gz MBCAUUZWXDFRJQ-ZBFHGGJFSA-N 2 2 306.450 3.096 20 10 DGCDLP CCCOc1ccc(C[NH+](C)[C@H]2CC[N@@H+](C)[C@H](C)C2)c(O)c1 ZINC000093644672 431915936 /nfs/dbraw/zinc/91/59/36/431915936.db2.gz MBCAUUZWXDFRJQ-ZBFHGGJFSA-N 2 2 306.450 3.096 20 10 DGCDLP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@@H](C)c2ccc(C)cc2O)cn1 ZINC000185084429 432465704 /nfs/dbraw/zinc/46/57/04/432465704.db2.gz IEMGAEFDVVNSLT-AWEZNQCLSA-N 2 2 322.412 3.441 20 10 DGCDLP C[C@@H]1CC[N@H+](Cc2cc(Cl)c(F)cc2O)C[C@@H]1n1cc[nH+]c1 ZINC000294434595 434112266 /nfs/dbraw/zinc/11/22/66/434112266.db2.gz XNEGPKNLIXEQKY-ABAIWWIYSA-N 2 2 323.799 3.464 20 10 DGCDLP C[C@@H]1CC[N@@H+](Cc2cc(Cl)c(F)cc2O)C[C@@H]1n1cc[nH+]c1 ZINC000294434595 434112275 /nfs/dbraw/zinc/11/22/75/434112275.db2.gz XNEGPKNLIXEQKY-ABAIWWIYSA-N 2 2 323.799 3.464 20 10 DGCDLP C[C@@H]([NH2+]CCCn1cc[nH+]c1)c1cc(Br)ccc1O ZINC000181006849 525445884 /nfs/dbraw/zinc/44/58/84/525445884.db2.gz CEAJBCPEAFROMD-LLVKDONJSA-N 2 2 324.222 3.092 20 10 DGCDLP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2cc(F)cc(C(C)=O)c2O)C[C@H]1C ZINC000750827077 575754077 /nfs/dbraw/zinc/75/40/77/575754077.db2.gz VJTVNYCWBRCLNJ-MLGOLLRUSA-N 2 2 322.424 3.039 20 10 DGCDLP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2cc(F)cc(C(C)=O)c2O)C[C@H]1C ZINC000750827077 575754083 /nfs/dbraw/zinc/75/40/83/575754083.db2.gz VJTVNYCWBRCLNJ-MLGOLLRUSA-N 2 2 322.424 3.039 20 10 DGCDLP Cc1cccc(CN(c2cccc[nH+]2)[C@H]2CC[C@H]([NH3+])CC2)c1O ZINC000895110765 618539415 /nfs/dbraw/zinc/53/94/15/618539415.db2.gz WWNQNNYRPQDSFT-QAQDUYKDSA-N 2 2 311.429 3.372 20 10 DGCDLP CCOc1ccc(O)c(C[NH2+]CC[NH2+]C2CCCCCC2)c1 ZINC000841028719 619165255 /nfs/dbraw/zinc/16/52/55/619165255.db2.gz QYCDVUDABISCED-UHFFFAOYSA-N 2 2 306.450 3.193 20 10 DGCDLP CN(C)c1ccc(/C=C\C[NH2+]C[C@@H]2CC[N@@H+]2C2CCCC2)cc1 ZINC000858286208 621171970 /nfs/dbraw/zinc/17/19/70/621171970.db2.gz UUQCXUXSFUZVJB-PRPIBZDOSA-N 2 2 313.489 3.372 20 10 DGCDLP CN(C)c1ccc(/C=C\C[NH2+]C[C@@H]2CC[N@H+]2C2CCCC2)cc1 ZINC000858286208 621171971 /nfs/dbraw/zinc/17/19/71/621171971.db2.gz UUQCXUXSFUZVJB-PRPIBZDOSA-N 2 2 313.489 3.372 20 10 DGCDLP CC(C)C[NH+]1CCC([NH2+][C@H](C)c2cc(F)cc(F)c2O)CC1 ZINC000756393716 621634736 /nfs/dbraw/zinc/63/47/36/621634736.db2.gz TULCOGPYRITYFS-GFCCVEGCSA-N 2 2 312.404 3.441 20 10 DGCDLP C[C@H]([NH2+]C1CC[NH+](CC2CC2)CC1)c1cc(F)cc(F)c1O ZINC000756431626 621638267 /nfs/dbraw/zinc/63/82/67/621638267.db2.gz CQAWYVQPOOGYLZ-NSHDSACASA-N 2 2 310.388 3.195 20 10 DGCDLP [NH3+]C[C@H]1C[N@H+](Cc2cccc(Cl)c2O)CC[C@@H]1C(F)(F)F ZINC000863645978 621693358 /nfs/dbraw/zinc/69/33/58/621693358.db2.gz OZHJDYCLPVBECJ-QWRGUYRKSA-N 2 2 322.758 3.005 20 10 DGCDLP [NH3+]C[C@H]1C[N@@H+](Cc2cccc(Cl)c2O)CC[C@@H]1C(F)(F)F ZINC000863645978 621693360 /nfs/dbraw/zinc/69/33/60/621693360.db2.gz OZHJDYCLPVBECJ-QWRGUYRKSA-N 2 2 322.758 3.005 20 10 DGCDLP CCN(C)c1ccc([C@H](C)[NH2+]C[C@@]2([NH+](C)C)CCSC2)cc1 ZINC000766438411 622330145 /nfs/dbraw/zinc/33/01/45/622330145.db2.gz LEFNUDOJFFBEFW-YJBOKZPZSA-N 2 2 321.534 3.231 20 10 DGCDLP C[C@H]([NH2+]C[C@@H]1CCCC[N@@H+]1C1CC1)c1ccc(N(C)C)cc1 ZINC000774378367 623138204 /nfs/dbraw/zinc/13/82/04/623138204.db2.gz LINGGLIVGLNXNT-KXBFYZLASA-N 2 2 301.478 3.420 20 10 DGCDLP C[C@H]([NH2+]C[C@@H]1CCCC[N@H+]1C1CC1)c1ccc(N(C)C)cc1 ZINC000774378367 623138207 /nfs/dbraw/zinc/13/82/07/623138207.db2.gz LINGGLIVGLNXNT-KXBFYZLASA-N 2 2 301.478 3.420 20 10 DGCDLP C[C@@H]([NH2+]C[C@@H]1CCCC[N@@H+]1C1CC1)c1ccc(N(C)C)cc1 ZINC000774378364 623138357 /nfs/dbraw/zinc/13/83/57/623138357.db2.gz LINGGLIVGLNXNT-BEFAXECRSA-N 2 2 301.478 3.420 20 10 DGCDLP C[C@@H]([NH2+]C[C@@H]1CCCC[N@H+]1C1CC1)c1ccc(N(C)C)cc1 ZINC000774378364 623138360 /nfs/dbraw/zinc/13/83/60/623138360.db2.gz LINGGLIVGLNXNT-BEFAXECRSA-N 2 2 301.478 3.420 20 10 DGCDLP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1)c1c(O)cccc1F ZINC000886639842 627178689 /nfs/dbraw/zinc/17/86/89/627178689.db2.gz MRBKWGMSHOAFDY-ZFWWWQNUSA-N 2 2 306.425 3.304 20 10 DGCDLP C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1)c1c(O)cccc1F ZINC000886639842 627178691 /nfs/dbraw/zinc/17/86/91/627178691.db2.gz MRBKWGMSHOAFDY-ZFWWWQNUSA-N 2 2 306.425 3.304 20 10 DGCDLP CC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)c2cccc(C(F)(F)F)c2O)C1 ZINC000815560716 627685114 /nfs/dbraw/zinc/68/51/14/627685114.db2.gz NYFNUEYFTAZFIK-NWDGAFQWSA-N 2 2 316.367 3.403 20 10 DGCDLP CC[N@H+]1CC[C@H](C[NH2+][C@@H](C)c2cccc(C(F)(F)F)c2O)C1 ZINC000815560716 627685120 /nfs/dbraw/zinc/68/51/20/627685120.db2.gz NYFNUEYFTAZFIK-NWDGAFQWSA-N 2 2 316.367 3.403 20 10 DGCDLP Cc1[nH+]ccn1C[C@@H](C)C[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000816532620 627803090 /nfs/dbraw/zinc/80/30/90/627803090.db2.gz OXWQZKCTNLJVHP-JTQLQIEISA-N 2 2 311.788 3.116 20 10 DGCDLP Cc1cc(Cl)cc(C[NH+]2CC[C@]3(C2)CCC[N@@H+](C)C3)c1O ZINC000816643065 627818240 /nfs/dbraw/zinc/81/82/40/627818240.db2.gz UDTJHSMRWPDUAQ-QGZVFWFLSA-N 2 2 308.853 3.272 20 10 DGCDLP Cc1cc(Cl)cc(C[NH+]2CC[C@]3(C2)CCC[N@H+](C)C3)c1O ZINC000816643065 627818242 /nfs/dbraw/zinc/81/82/42/627818242.db2.gz UDTJHSMRWPDUAQ-QGZVFWFLSA-N 2 2 308.853 3.272 20 10 DGCDLP Cc1cc(Cl)cc(C[N@H+]2CC[C@]3(C2)CCC[NH+](C)C3)c1O ZINC000816643065 627818244 /nfs/dbraw/zinc/81/82/44/627818244.db2.gz UDTJHSMRWPDUAQ-QGZVFWFLSA-N 2 2 308.853 3.272 20 10 DGCDLP Cc1cc(Cl)cc(C[N@@H+]2CC[C@]3(C2)CCC[NH+](C)C3)c1O ZINC000816643065 627818247 /nfs/dbraw/zinc/81/82/47/627818247.db2.gz UDTJHSMRWPDUAQ-QGZVFWFLSA-N 2 2 308.853 3.272 20 10 DGCDLP C[C@@H]([NH2+]Cc1ccc(N2CCC(C)CC2)cc1)[C@H]1CCC[NH2+]1 ZINC000817902527 627956760 /nfs/dbraw/zinc/95/67/60/627956760.db2.gz SKKMUDPIIZVUAM-VQIMIIECSA-N 2 2 301.478 3.153 20 10 DGCDLP Cc1ccc2c(c1)[C@@H]([NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1)CC2 ZINC000817938028 627966767 /nfs/dbraw/zinc/96/67/67/627966767.db2.gz BRQWZFFBYHFRBP-PMACEKPBSA-N 2 2 309.457 3.338 20 10 DGCDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+][C@@H]2CCc3cc(F)ccc32)cc1 ZINC000817938968 627967319 /nfs/dbraw/zinc/96/73/19/627967319.db2.gz WNRRDMUONLWSPB-RBUKOAKNSA-N 2 2 313.420 3.169 20 10 DGCDLP C[C@H]([NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1)c1ccc(F)cc1 ZINC000817939098 627967549 /nfs/dbraw/zinc/96/75/49/627967549.db2.gz YVTNBBNCUWOFDW-SCLBCKFNSA-N 2 2 301.409 3.242 20 10 DGCDLP C[C@@H]([NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1)c1ccnc(Cl)c1 ZINC000817939895 627968027 /nfs/dbraw/zinc/96/80/27/627968027.db2.gz CZZLFMAMADQPMA-WBMJQRKESA-N 2 2 318.852 3.152 20 10 DGCDLP Cc1ccc([C@H](C)[NH2+]C[C@@H]([NH3+])c2ccc(N(C)C)cc2)c(O)c1 ZINC000817942252 627968350 /nfs/dbraw/zinc/96/83/50/627968350.db2.gz NNLIYVRTTPJBQP-KBXCAEBGSA-N 2 2 313.445 3.117 20 10 DGCDLP C[C@@H]1Cc2ccccc2[C@@H]1[NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000817940730 627968998 /nfs/dbraw/zinc/96/89/98/627968998.db2.gz HMYZVRCSHRITFZ-VOBQZIQPSA-N 2 2 309.457 3.276 20 10 DGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+]C(C2CCC2)C2CCC2)cc1 ZINC000817942703 627970020 /nfs/dbraw/zinc/97/00/20/627970020.db2.gz QGSOGGMWIRASIH-GOSISDBHSA-N 2 2 301.478 3.311 20 10 DGCDLP C[C@H]([NH2+]Cc1ccc(CC[NH3+])cc1)c1cc(F)cc(F)c1O ZINC000817948364 627971552 /nfs/dbraw/zinc/97/15/52/627971552.db2.gz IOYFFVKARAHELS-NSHDSACASA-N 2 2 306.356 3.022 20 10 DGCDLP C[C@@H]([NH2+]Cc1ccc(CC[NH3+])cc1)c1cc(F)cc(F)c1O ZINC000817948362 627971807 /nfs/dbraw/zinc/97/18/07/627971807.db2.gz IOYFFVKARAHELS-LLVKDONJSA-N 2 2 306.356 3.022 20 10 DGCDLP C[C@@H]([NH2+]C[C@@H]1CCC[NH2+]1)c1ccc(N2CCCCC2)c(F)c1 ZINC000817952803 627973199 /nfs/dbraw/zinc/97/31/99/627973199.db2.gz SUHLOQFKPPKBLB-ZBFHGGJFSA-N 2 2 305.441 3.219 20 10 DGCDLP C[NH+](C)CCCC(C)(C)[NH2+]Cc1cc(Cl)cc(F)c1O ZINC000824914152 628705299 /nfs/dbraw/zinc/70/52/99/628705299.db2.gz NEHKUOPNODDYJI-UHFFFAOYSA-N 2 2 302.821 3.395 20 10 DGCDLP CN(C)c1ccc(/C=C\C[N@@H+]2CCC[C@@H](c3[nH]cc[nH+]3)C2)cc1 ZINC000835025805 629828251 /nfs/dbraw/zinc/82/82/51/629828251.db2.gz NPLVQYMPIUPLEF-MAVJXHJTSA-N 2 2 310.445 3.369 20 10 DGCDLP CN(C)c1ccc(/C=C\C[N@H+]2CCC[C@@H](c3[nH]cc[nH+]3)C2)cc1 ZINC000835025805 629828254 /nfs/dbraw/zinc/82/82/54/629828254.db2.gz NPLVQYMPIUPLEF-MAVJXHJTSA-N 2 2 310.445 3.369 20 10 DGCDLP CN(C)c1ccc(C[NH2+][C@H]2CCCC[NH2+]C2)c(C(F)(F)F)c1 ZINC000841089684 630406654 /nfs/dbraw/zinc/40/66/54/630406654.db2.gz JSEMDQDGOVVVKE-ZDUSSCGKSA-N 2 2 315.383 3.003 20 10 DGCDLP CCN(Cc1ccccc1)c1ccc(C[N@@H+]2CC[C@@H]([NH3+])C2)cc1 ZINC000843044494 630607629 /nfs/dbraw/zinc/60/76/29/630607629.db2.gz DQIFJWXOEHPRFB-LJQANCHMSA-N 2 2 309.457 3.246 20 10 DGCDLP CCN(Cc1ccccc1)c1ccc(C[N@H+]2CC[C@@H]([NH3+])C2)cc1 ZINC000843044494 630607631 /nfs/dbraw/zinc/60/76/31/630607631.db2.gz DQIFJWXOEHPRFB-LJQANCHMSA-N 2 2 309.457 3.246 20 10 DGCDLP Cc1cccc(C[N@H+](Cc2ccccc2)[C@H]2CCC[NH2+]C2)c1O ZINC000843051777 630609005 /nfs/dbraw/zinc/60/90/05/630609005.db2.gz DPGVNBBSAGCUID-IBGZPJMESA-N 2 2 310.441 3.455 20 10 DGCDLP Cc1cccc(C[N@@H+](Cc2ccccc2)[C@H]2CCC[NH2+]C2)c1O ZINC000843051777 630609008 /nfs/dbraw/zinc/60/90/08/630609008.db2.gz DPGVNBBSAGCUID-IBGZPJMESA-N 2 2 310.441 3.455 20 10 DGCDLP C[C@@H]1C[C@@H]([NH3+])CC[N@@H+]1Cc1ccc(N(C)C)cc1C(F)(F)F ZINC000846704293 631289794 /nfs/dbraw/zinc/28/97/94/631289794.db2.gz UIQCEXXXLAXETE-YPMHNXCESA-N 2 2 315.383 3.083 20 10 DGCDLP C[C@@H]1C[C@@H]([NH3+])CC[N@H+]1Cc1ccc(N(C)C)cc1C(F)(F)F ZINC000846704293 631289800 /nfs/dbraw/zinc/28/98/00/631289800.db2.gz UIQCEXXXLAXETE-YPMHNXCESA-N 2 2 315.383 3.083 20 10 DGCDLP CC1=CCC[C@H](C)[C@H]1C[NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1 ZINC001576556146 1191845194 /nfs/dbraw/zinc/84/51/94/1191845194.db2.gz NZHUESLFRHZUJD-ZYSHUDEJSA-N 2 2 301.478 3.334 20 10 DGCDLP C[C@H]([NH2+]Cc1cc(F)c(F)cc1O)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC001474435233 1183922464 /nfs/dbraw/zinc/92/24/64/1183922464.db2.gz BPTWHYDWBVUBFO-STQMWFEESA-N 2 2 324.415 3.413 20 10 DGCDLP C[C@H]([NH2+]Cc1cc(F)c(F)cc1O)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC001474435233 1183922470 /nfs/dbraw/zinc/92/24/70/1183922470.db2.gz BPTWHYDWBVUBFO-STQMWFEESA-N 2 2 324.415 3.413 20 10 DGCDLP CCN(CC)c1ccc(C[NH2+][C@H](C)Cn2cc[nH+]c2)cc1F ZINC001648779957 1195331471 /nfs/dbraw/zinc/33/14/71/1195331471.db2.gz PDZLXPAMVJXHBV-CQSZACIVSA-N 2 2 304.413 3.047 20 10 DGCDLP CCOc1ccc(O)c(C[NH+]2CCC([NH+](CC)CC)CC2)c1 ZINC000121725840 1200227571 /nfs/dbraw/zinc/22/75/71/1200227571.db2.gz BTQYJTKFWDMMTI-UHFFFAOYSA-N 2 2 306.450 3.097 20 10 DGCDLP CN(C)c1ccc(C[N@@H+]2C[C@H]3CCC[NH+](C)[C@H]3C2)c2ccccc21 ZINC001204240391 1090932549 /nfs/dbraw/zinc/93/25/49/1090932549.db2.gz QXKGVIARFUIZRR-UTKZUKDTSA-N 2 2 323.484 3.432 20 10 DGCDLP CN(C)c1ccc(C[N@H+]2C[C@H]3CCC[NH+](C)[C@H]3C2)c2ccccc21 ZINC001204240391 1090932553 /nfs/dbraw/zinc/93/25/53/1090932553.db2.gz QXKGVIARFUIZRR-UTKZUKDTSA-N 2 2 323.484 3.432 20 10 DGCDLP CN(C)c1ccc(C[NH+]2C[C@H]3CCC[N@H+](C)[C@H]3C2)c2ccccc21 ZINC001204240391 1090932555 /nfs/dbraw/zinc/93/25/55/1090932555.db2.gz QXKGVIARFUIZRR-UTKZUKDTSA-N 2 2 323.484 3.432 20 10 DGCDLP CN(C)c1ccc(C[NH+]2C[C@H]3CCC[N@@H+](C)[C@H]3C2)c2ccccc21 ZINC001204240391 1090932558 /nfs/dbraw/zinc/93/25/58/1090932558.db2.gz QXKGVIARFUIZRR-UTKZUKDTSA-N 2 2 323.484 3.432 20 10 DGCDLP C[C@@H]1CC[N@H+](Cc2c(O)ccc(Cl)c2Cl)C[C@H]1C[NH3+] ZINC001205317338 1091181905 /nfs/dbraw/zinc/18/19/05/1091181905.db2.gz OCKDREFKXYTYBG-NXEZZACHSA-N 2 2 303.233 3.116 20 10 DGCDLP C[C@@H]1CC[N@@H+](Cc2c(O)ccc(Cl)c2Cl)C[C@H]1C[NH3+] ZINC001205317338 1091181911 /nfs/dbraw/zinc/18/19/11/1091181911.db2.gz OCKDREFKXYTYBG-NXEZZACHSA-N 2 2 303.233 3.116 20 10 DGCDLP C[C@@H]1CC[C@H](C[NH3+])[N@H+](Cc2ccc3c(c2O)C=CC(C)(C)O3)C1 ZINC001205853339 1091379360 /nfs/dbraw/zinc/37/93/60/1091379360.db2.gz IAJDBOPJTLHIHW-UKRRQHHQSA-N 2 2 316.445 3.136 20 10 DGCDLP C[C@@H]1CC[C@H](C[NH3+])[N@@H+](Cc2ccc3c(c2O)C=CC(C)(C)O3)C1 ZINC001205853339 1091379368 /nfs/dbraw/zinc/37/93/68/1091379368.db2.gz IAJDBOPJTLHIHW-UKRRQHHQSA-N 2 2 316.445 3.136 20 10 DGCDLP C[NH+]1CCC(C2CC[NH+](Cc3c(O)cc(F)cc3F)CC2)CC1 ZINC001140583593 1091919315 /nfs/dbraw/zinc/91/93/15/1091919315.db2.gz MKVBTHGJQYLIHW-UHFFFAOYSA-N 2 2 324.415 3.224 20 10 DGCDLP CCN(CC)c1ccc(C[N@H+](CC)C2CC[NH+](C)CC2)c(O)c1 ZINC001140855056 1092030358 /nfs/dbraw/zinc/03/03/58/1092030358.db2.gz LYDGQAFJLMFKLF-UHFFFAOYSA-N 2 2 319.493 3.155 20 10 DGCDLP CCN(CC)c1ccc(C[N@@H+](CC)C2CC[NH+](C)CC2)c(O)c1 ZINC001140855056 1092030368 /nfs/dbraw/zinc/03/03/68/1092030368.db2.gz LYDGQAFJLMFKLF-UHFFFAOYSA-N 2 2 319.493 3.155 20 10 DGCDLP CC[N@H+](CCn1cc[nH+]c1)Cc1cc2c3c(c1)CCCN3CCC2 ZINC001141078098 1092129880 /nfs/dbraw/zinc/12/98/80/1092129880.db2.gz KRODAZXJXJGKHF-UHFFFAOYSA-N 2 2 324.472 3.104 20 10 DGCDLP CC[N@@H+](CCn1cc[nH+]c1)Cc1cc2c3c(c1)CCCN3CCC2 ZINC001141078098 1092129883 /nfs/dbraw/zinc/12/98/83/1092129883.db2.gz KRODAZXJXJGKHF-UHFFFAOYSA-N 2 2 324.472 3.104 20 10 DGCDLP Oc1ccc(F)c(Cl)c1C[N@@H+]1CCC[C@]12CCC[NH2+]CC2 ZINC001222320493 1095549166 /nfs/dbraw/zinc/54/91/66/1095549166.db2.gz IKADMKXEGMGFEC-INIZCTEOSA-N 2 2 312.816 3.293 20 10 DGCDLP Oc1ccc(F)c(Cl)c1C[N@H+]1CCC[C@]12CCC[NH2+]CC2 ZINC001222320493 1095549180 /nfs/dbraw/zinc/54/91/80/1095549180.db2.gz IKADMKXEGMGFEC-INIZCTEOSA-N 2 2 312.816 3.293 20 10 DGCDLP c1cc(N2CCCCC2)ccc1C[N@@H+]1CC[C@@]2(C1)CCCC[NH2+]2 ZINC001222427263 1095609338 /nfs/dbraw/zinc/60/93/38/1095609338.db2.gz PKKZWMZMLFUZNC-HXUWFJFHSA-N 2 2 313.489 3.395 20 10 DGCDLP c1cc(N2CCCCC2)ccc1C[N@H+]1CC[C@@]2(C1)CCCC[NH2+]2 ZINC001222427263 1095609344 /nfs/dbraw/zinc/60/93/44/1095609344.db2.gz PKKZWMZMLFUZNC-HXUWFJFHSA-N 2 2 313.489 3.395 20 10 DGCDLP Cc1cc(C)c(C[NH+]2CCN(c3cccc(C)[nH+]3)CC2)c(O)c1 ZINC001231842804 1097860966 /nfs/dbraw/zinc/86/09/66/1097860966.db2.gz PXKGVQAWPJYOAK-UHFFFAOYSA-N 2 2 311.429 3.035 20 10 DGCDLP CCN(CC)c1ccc(C[N@@H+]2CCCC[C@@]23CC[NH2+]C3)cc1 ZINC001235127058 1098827043 /nfs/dbraw/zinc/82/70/43/1098827043.db2.gz WYNPIQFAPINNBF-IBGZPJMESA-N 2 2 301.478 3.251 20 10 DGCDLP CCN(CC)c1ccc(C[N@H+]2CCCC[C@@]23CC[NH2+]C3)cc1 ZINC001235127058 1098827054 /nfs/dbraw/zinc/82/70/54/1098827054.db2.gz WYNPIQFAPINNBF-IBGZPJMESA-N 2 2 301.478 3.251 20 10 DGCDLP Cc1cc(C[N@@H+]2CC[C@@H]3C[NH2+]C[C@H]3C2)c(C)n1-c1ccccc1 ZINC001235184702 1098863401 /nfs/dbraw/zinc/86/34/01/1098863401.db2.gz LTKXIIOTKJSOHR-MJGOQNOKSA-N 2 2 309.457 3.135 20 10 DGCDLP Cc1cc(C[N@H+]2CC[C@@H]3C[NH2+]C[C@H]3C2)c(C)n1-c1ccccc1 ZINC001235184702 1098863408 /nfs/dbraw/zinc/86/34/08/1098863408.db2.gz LTKXIIOTKJSOHR-MJGOQNOKSA-N 2 2 309.457 3.135 20 10 DGCDLP Cc1cc(Cl)cc(C[N@@H+]2CCCC[C@@](F)(C[NH3+])C2)c1O ZINC001206371695 1099031451 /nfs/dbraw/zinc/03/14/51/1099031451.db2.gz UUKIUVOVNCUSOI-OAHLLOKOSA-N 2 2 300.805 3.007 20 10 DGCDLP Cc1cc(Cl)cc(C[N@H+]2CCCC[C@@](F)(C[NH3+])C2)c1O ZINC001206371695 1099031463 /nfs/dbraw/zinc/03/14/63/1099031463.db2.gz UUKIUVOVNCUSOI-OAHLLOKOSA-N 2 2 300.805 3.007 20 10 DGCDLP c1cc(N2CCCCC2)ccc1C[N@H+](C1CC1)[C@@H]1CCC[NH2+]C1 ZINC001236242037 1099496901 /nfs/dbraw/zinc/49/69/01/1099496901.db2.gz VYVDFQDORQNRCF-HXUWFJFHSA-N 2 2 313.489 3.393 20 10 DGCDLP c1cc(N2CCCCC2)ccc1C[N@@H+](C1CC1)[C@@H]1CCC[NH2+]C1 ZINC001236242037 1099496904 /nfs/dbraw/zinc/49/69/04/1099496904.db2.gz VYVDFQDORQNRCF-HXUWFJFHSA-N 2 2 313.489 3.393 20 10 DGCDLP CCC[N@H+](CCC[NH+](C)C)Cc1c(O)cc(OC)cc1Cl ZINC001236807769 1099800839 /nfs/dbraw/zinc/80/08/39/1099800839.db2.gz JBZSBNPOJFLEEI-UHFFFAOYSA-N 2 2 314.857 3.218 20 10 DGCDLP CCC[N@@H+](CCC[NH+](C)C)Cc1c(O)cc(OC)cc1Cl ZINC001236807769 1099800845 /nfs/dbraw/zinc/80/08/45/1099800845.db2.gz JBZSBNPOJFLEEI-UHFFFAOYSA-N 2 2 314.857 3.218 20 10 DGCDLP c1c[nH+]c([C@@H]2CCC[N@@H+](Cc3ccc(N4CCCC4)cc3)C2)[nH]1 ZINC001319696398 1108598226 /nfs/dbraw/zinc/59/82/26/1108598226.db2.gz RVVMLFAULAQQLD-QGZVFWFLSA-N 2 2 310.445 3.390 20 10 DGCDLP c1c[nH+]c([C@@H]2CCC[N@H+](Cc3ccc(N4CCCC4)cc3)C2)[nH]1 ZINC001319696398 1108598235 /nfs/dbraw/zinc/59/82/35/1108598235.db2.gz RVVMLFAULAQQLD-QGZVFWFLSA-N 2 2 310.445 3.390 20 10 DGCDLP CN(C)c1ccc(C[NH2+]CCCc2[nH+]c3ccccc3n2C)cc1 ZINC000076901214 185052872 /nfs/dbraw/zinc/05/28/72/185052872.db2.gz QNEIWJBFHMAXIL-UHFFFAOYSA-N 2 2 322.456 3.362 20 10 DGCDLP CCOc1cccc(C[N@@H+]2CC[C@@H](C)[C@H](n3cc[nH+]c3)C2)c1O ZINC000091960314 193132963 /nfs/dbraw/zinc/13/29/63/193132963.db2.gz QQROXWRHXDPXKM-GDBMZVCRSA-N 2 2 315.417 3.071 20 10 DGCDLP CCOc1cccc(C[N@H+]2CC[C@@H](C)[C@H](n3cc[nH+]c3)C2)c1O ZINC000091960314 193132964 /nfs/dbraw/zinc/13/29/64/193132964.db2.gz QQROXWRHXDPXKM-GDBMZVCRSA-N 2 2 315.417 3.071 20 10 DGCDLP CC[C@H]([NH2+]CCn1cc[nH+]c1)c1cc(Br)ccc1O ZINC000041119162 183166733 /nfs/dbraw/zinc/16/67/33/183166733.db2.gz RRNLDRJUTVIHND-ZDUSSCGKSA-N 2 2 324.222 3.092 20 10 DGCDLP CC[C@H]([NH2+]CCc1cn2ccccc2[nH+]1)c1ccc(F)cc1O ZINC000285883000 131206910 /nfs/dbraw/zinc/20/69/10/131206910.db2.gz ZPMCFKMUDAPHFF-INIZCTEOSA-N 2 2 313.376 3.462 20 10 DGCDLP Cc1cc[nH+]cc1CCC[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC000289035925 131353237 /nfs/dbraw/zinc/35/32/37/131353237.db2.gz AGWCLOULXVQDPU-UHFFFAOYSA-N 2 2 301.409 3.318 20 10 DGCDLP Cc1cc(O)c(C[N@H+]2CCC[C@H](Cc3[nH+]ccn3C)C2)cc1C ZINC000182093742 228366779 /nfs/dbraw/zinc/36/67/79/228366779.db2.gz CLMPTIMPKHINCH-MRXNPFEDSA-N 2 2 313.445 3.197 20 10 DGCDLP Cc1cc(O)c(C[N@@H+]2CCC[C@H](Cc3[nH+]ccn3C)C2)cc1C ZINC000182093742 228366783 /nfs/dbraw/zinc/36/67/83/228366783.db2.gz CLMPTIMPKHINCH-MRXNPFEDSA-N 2 2 313.445 3.197 20 10 DGCDLP C[NH+]1CCC2(CCC[N@@H+]2Cc2c(O)ccc(Cl)c2F)CC1 ZINC000365266413 277038451 /nfs/dbraw/zinc/03/84/51/277038451.db2.gz WNGMBANNTGWRPS-UHFFFAOYSA-N 2 2 312.816 3.245 20 10 DGCDLP C[NH+]1CCC2(CCC[N@H+]2Cc2c(O)ccc(Cl)c2F)CC1 ZINC000365266413 277038452 /nfs/dbraw/zinc/03/84/52/277038452.db2.gz WNGMBANNTGWRPS-UHFFFAOYSA-N 2 2 312.816 3.245 20 10 DGCDLP Oc1c(Cl)cc(Cl)cc1C[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000037649130 431849662 /nfs/dbraw/zinc/84/96/62/431849662.db2.gz CHCWYTLDXHTHGT-SNVBAGLBSA-N 2 2 315.244 3.273 20 10 DGCDLP Oc1c(Cl)cc(Cl)cc1C[NH2+]C[C@H]1CC[N@H+](C2CC2)C1 ZINC000037649130 431849665 /nfs/dbraw/zinc/84/96/65/431849665.db2.gz CHCWYTLDXHTHGT-SNVBAGLBSA-N 2 2 315.244 3.273 20 10 DGCDLP CC[NH+](CC)C[C@@H]1CC[N@H+](Cc2ccc(N(C)C)c(F)c2)C1 ZINC000131381600 520728147 /nfs/dbraw/zinc/72/81/47/520728147.db2.gz WBZSXHMGMLNZJV-INIZCTEOSA-N 2 2 307.457 3.055 20 10 DGCDLP CC[NH+](CC)C[C@@H]1CC[N@@H+](Cc2ccc(N(C)C)c(F)c2)C1 ZINC000131381600 520728154 /nfs/dbraw/zinc/72/81/54/520728154.db2.gz WBZSXHMGMLNZJV-INIZCTEOSA-N 2 2 307.457 3.055 20 10 DGCDLP CN(C)c1ccc(/C=C\C[NH2+]C[C@H]2CC[N@@H+]2C2CCCC2)cc1 ZINC000858286206 621171882 /nfs/dbraw/zinc/17/18/82/621171882.db2.gz UUQCXUXSFUZVJB-KKHYBRAUSA-N 2 2 313.489 3.372 20 10 DGCDLP CN(C)c1ccc(/C=C\C[NH2+]C[C@H]2CC[N@H+]2C2CCCC2)cc1 ZINC000858286206 621171884 /nfs/dbraw/zinc/17/18/84/621171884.db2.gz UUQCXUXSFUZVJB-KKHYBRAUSA-N 2 2 313.489 3.372 20 10 DGCDLP CC[NH+]1CCC(CC[NH2+][C@H](C)c2cc(F)cc(F)c2O)CC1 ZINC000756612045 621652490 /nfs/dbraw/zinc/65/24/90/621652490.db2.gz LSNHJBHJHBWESO-GFCCVEGCSA-N 2 2 312.404 3.443 20 10 DGCDLP CCN(CC)c1ccc(C[NH2+][C@H]2CC[NH2+]C23CCC3)cc1F ZINC000863483288 621677548 /nfs/dbraw/zinc/67/75/48/621677548.db2.gz USAXMLZRMMLMIS-KRWDZBQOSA-N 2 2 305.441 3.046 20 10 DGCDLP C[C@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1cc(F)cc(F)c1O ZINC000774498027 623151708 /nfs/dbraw/zinc/15/17/08/623151708.db2.gz PVWYOWUOVUFYMB-NSHDSACASA-N 2 2 310.388 3.195 20 10 DGCDLP CC[C@@H]([NH2+]CCC[N@H+](C)CCOC)c1cc(Cl)ccc1O ZINC000775491624 623280156 /nfs/dbraw/zinc/28/01/56/623280156.db2.gz GFWBLTQLPXPSFH-OAHLLOKOSA-N 2 2 314.857 3.055 20 10 DGCDLP CC[C@@H]([NH2+]CCC[N@@H+](C)CCOC)c1cc(Cl)ccc1O ZINC000775491624 623280161 /nfs/dbraw/zinc/28/01/61/623280161.db2.gz GFWBLTQLPXPSFH-OAHLLOKOSA-N 2 2 314.857 3.055 20 10 DGCDLP C[C@H](C[NH2+]Cc1c(O)ccc(Cl)c1F)C[NH+]1CCCCC1 ZINC000790947910 625721032 /nfs/dbraw/zinc/72/10/32/625721032.db2.gz CQIDJRUTHBELAK-GFCCVEGCSA-N 2 2 314.832 3.396 20 10 DGCDLP C[C@@H]([NH2+][C@@H](Cn1cc[nH+]c1)C(C)(C)C)c1c(O)cccc1F ZINC000886509028 627154611 /nfs/dbraw/zinc/15/46/11/627154611.db2.gz XWCOPKKRIAKOCZ-DOMZBBRYSA-N 2 2 305.397 3.493 20 10 DGCDLP C[C@H](CC[NH+](C)C)[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O ZINC000815570990 627685485 /nfs/dbraw/zinc/68/54/85/627685485.db2.gz QSBNUAPMOIPHDY-MNOVXSKESA-N 2 2 304.356 3.402 20 10 DGCDLP CC[N@@H+]1CCC[C@H](C[NH2+]Cc2cc(Cl)c(F)cc2O)C1 ZINC000816543519 627805033 /nfs/dbraw/zinc/80/50/33/627805033.db2.gz DMYALFKQYSXFOH-LLVKDONJSA-N 2 2 300.805 3.006 20 10 DGCDLP CC[N@H+]1CCC[C@H](C[NH2+]Cc2cc(Cl)c(F)cc2O)C1 ZINC000816543519 627805037 /nfs/dbraw/zinc/80/50/37/627805037.db2.gz DMYALFKQYSXFOH-LLVKDONJSA-N 2 2 300.805 3.006 20 10 DGCDLP CC(C)[N@@H+]1CCC[C@@H](C[NH2+]Cc2cc(Cl)c(F)cc2O)C1 ZINC000816548366 627805536 /nfs/dbraw/zinc/80/55/36/627805536.db2.gz FLWQCTCVCVGBEW-LBPRGKRZSA-N 2 2 314.832 3.395 20 10 DGCDLP CC(C)[N@H+]1CCC[C@@H](C[NH2+]Cc2cc(Cl)c(F)cc2O)C1 ZINC000816548366 627805539 /nfs/dbraw/zinc/80/55/39/627805539.db2.gz FLWQCTCVCVGBEW-LBPRGKRZSA-N 2 2 314.832 3.395 20 10 DGCDLP CCC[NH+]1CCC([NH2+]Cc2cc(Cl)c(F)cc2O)CC1 ZINC000816561419 627808466 /nfs/dbraw/zinc/80/84/66/627808466.db2.gz XFCCBQTVBMUANJ-UHFFFAOYSA-N 2 2 300.805 3.149 20 10 DGCDLP CCN(CC)c1ccc(C[NH2+][C@@H](C)c2c[nH+]ccc2N)cc1F ZINC000817903341 627957344 /nfs/dbraw/zinc/95/73/44/627957344.db2.gz NPEJWSRMRJFGOL-ZDUSSCGKSA-N 2 2 316.424 3.330 20 10 DGCDLP C[C@@H]([NH2+][C@H]1CCC[NH2+]C1)c1ccc(N2CCCCCC2)cc1 ZINC000817940073 627967412 /nfs/dbraw/zinc/96/74/12/627967412.db2.gz DDSGCTXGUGVHHZ-AEFFLSMTSA-N 2 2 301.478 3.470 20 10 DGCDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+][C@@H]2CCCc3sccc32)cc1 ZINC000817938748 627967585 /nfs/dbraw/zinc/96/75/85/627967585.db2.gz RHCNELAYAHIGIU-DLBZAZTESA-N 2 2 315.486 3.481 20 10 DGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+][C@H]2CCc3cc(F)ccc32)cc1 ZINC000817938966 627968055 /nfs/dbraw/zinc/96/80/55/627968055.db2.gz WNRRDMUONLWSPB-MOPGFXCFSA-N 2 2 313.420 3.169 20 10 DGCDLP Cc1ccc([C@H](C)[NH2+]C[C@@H]([NH3+])c2ccc(N(C)C)cc2)c(C)n1 ZINC000817941141 627968357 /nfs/dbraw/zinc/96/83/57/627968357.db2.gz JDWNRLQWZKQWGG-IFXJQAMLSA-N 2 2 312.461 3.115 20 10 DGCDLP Cc1ccc(O)c([C@@H](C)[NH2+]C[C@@H]([NH3+])c2ccc(N(C)C)cc2)c1 ZINC000817940795 627968682 /nfs/dbraw/zinc/96/86/82/627968682.db2.gz HSXVBHSSCKEOEE-RDTXWAMCSA-N 2 2 313.445 3.117 20 10 DGCDLP Cc1ccc(O)c([C@H](C)[NH2+]C[C@H]([NH3+])c2ccc(N(C)C)cc2)c1 ZINC000817940791 627968912 /nfs/dbraw/zinc/96/89/12/627968912.db2.gz HSXVBHSSCKEOEE-KSSFIOAISA-N 2 2 313.445 3.117 20 10 DGCDLP CC[C@@H]([NH2+]CCC[NH2+]Cc1cccnc1)c1ccc(F)cc1O ZINC000817942034 627969045 /nfs/dbraw/zinc/96/90/45/627969045.db2.gz XBNRZFGILVDEAG-QGZVFWFLSA-N 2 2 317.408 3.147 20 10 DGCDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+][C@@H](c2cccnc2)C2CCC2)cc1 ZINC000817943262 627969291 /nfs/dbraw/zinc/96/92/91/627969291.db2.gz SXJZCELRPOIATI-VQTJNVASSA-N 2 2 324.472 3.278 20 10 DGCDLP C[C@H]([NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1)c1ccc(Cl)nc1 ZINC000817944299 627969779 /nfs/dbraw/zinc/96/97/79/627969779.db2.gz ZASUBBGCJZSUED-BLLLJJGKSA-N 2 2 318.852 3.152 20 10 DGCDLP C[C@H]([NH2+]C[C@H]1CCC[NH2+]1)c1ccc(N2CCCCCC2)cc1 ZINC000817951229 627972834 /nfs/dbraw/zinc/97/28/34/627972834.db2.gz CBMNVYOILCSFQR-FUHWJXTLSA-N 2 2 301.478 3.470 20 10 DGCDLP C[C@@H]1C[C@H]([NH2+]C[C@H]([NH3+])c2ccccc2)c2c1c(F)ccc2O ZINC000817954048 627973582 /nfs/dbraw/zinc/97/35/82/627973582.db2.gz AQXNPEUONVZDKW-UGFHNGPFSA-N 2 2 300.377 3.369 20 10 DGCDLP CC(C)C[C@H](C[NH3+])[NH2+][C@H](C)c1ccc(Br)cc1O ZINC000817958982 627974879 /nfs/dbraw/zinc/97/48/79/627974879.db2.gz NXWHBGMXNOMAQD-ZYHUDNBSSA-N 2 2 315.255 3.179 20 10 DGCDLP CC[NH2+][C@H](C)C[NH2+][C@H](CC)c1ccc(C(F)(F)F)cc1O ZINC000817973789 627979835 /nfs/dbraw/zinc/97/98/35/627979835.db2.gz WPFMSKLOTJDCQP-ZWNOBZJWSA-N 2 2 304.356 3.450 20 10 DGCDLP CC(C)n1c[nH+]cc1CN(C)c1ccc(OCC[NH+](C)C)cc1 ZINC000822469892 628454511 /nfs/dbraw/zinc/45/45/11/628454511.db2.gz FRUSALJVUCXSFH-UHFFFAOYSA-N 2 2 316.449 3.041 20 10 DGCDLP Oc1cccc2c1[C@H]([NH2+]Cc1cccc(Cn3cc[nH+]c3)c1)CC2 ZINC000834507709 629718935 /nfs/dbraw/zinc/71/89/35/629718935.db2.gz CNKCXWSMMFXVIL-GOSISDBHSA-N 2 2 319.408 3.414 20 10 DGCDLP Cc1cc(O)c(C[NH+]2CCC(c3[nH]cc[nH+]3)CC2)c(Cl)c1 ZINC000840911877 630376530 /nfs/dbraw/zinc/37/65/30/630376530.db2.gz BYCYZOKIJOQEGB-UHFFFAOYSA-N 2 2 305.809 3.457 20 10 DGCDLP C[C@@H]([NH3+])c1ccc(C[NH2+]Cc2cc(Cl)cc(F)c2O)cc1 ZINC000841028969 630398312 /nfs/dbraw/zinc/39/83/12/630398312.db2.gz KCUVPVRIQTYWIJ-SNVBAGLBSA-N 2 2 308.784 3.494 20 10 DGCDLP COc1cccc(C[NH2+]C[C@H]([NH3+])c2ccc(C(C)C)cc2)c1O ZINC000841037457 630400036 /nfs/dbraw/zinc/40/00/36/630400036.db2.gz QPZNKIHABKXUCK-KRWDZBQOSA-N 2 2 314.429 3.314 20 10 DGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+]Cc2ccc(Cl)c(F)c2)cc1 ZINC000841041166 630400655 /nfs/dbraw/zinc/40/06/55/630400655.db2.gz BCTXTWDRQNBJFZ-QGZVFWFLSA-N 2 2 321.827 3.335 20 10 DGCDLP Oc1c(F)cc(Cl)cc1C[N@@H+]1CCCC[C@@H]1[C@H]1CC[NH2+]C1 ZINC000841087481 630406150 /nfs/dbraw/zinc/40/61/50/630406150.db2.gz OGGTZBSZPCRDKU-XHDPSFHLSA-N 2 2 312.816 3.149 20 10 DGCDLP Oc1c(F)cc(Cl)cc1C[N@H+]1CCCC[C@@H]1[C@H]1CC[NH2+]C1 ZINC000841087481 630406154 /nfs/dbraw/zinc/40/61/54/630406154.db2.gz OGGTZBSZPCRDKU-XHDPSFHLSA-N 2 2 312.816 3.149 20 10 DGCDLP Oc1ccc(Cl)c(F)c1C[N@@H+]1CCC[C@@H]([C@H]2CCC[NH2+]2)C1 ZINC000843045343 630607711 /nfs/dbraw/zinc/60/77/11/630607711.db2.gz NUUXCWMCAZCCRE-BXUZGUMPSA-N 2 2 312.816 3.149 20 10 DGCDLP Oc1ccc(Cl)c(F)c1C[N@H+]1CCC[C@@H]([C@H]2CCC[NH2+]2)C1 ZINC000843045343 630607713 /nfs/dbraw/zinc/60/77/13/630607713.db2.gz NUUXCWMCAZCCRE-BXUZGUMPSA-N 2 2 312.816 3.149 20 10 DGCDLP CN(C)c1ccc(/C=C/C[N@@H+]2CCCC[C@@H]2[C@H]2CCC[NH2+]2)cc1 ZINC000843048121 630608187 /nfs/dbraw/zinc/60/81/87/630608187.db2.gz OAFVERRODSYCKB-NHQAVIFJSA-N 2 2 313.489 3.372 20 10 DGCDLP CN(C)c1ccc(/C=C/C[N@H+]2CCCC[C@@H]2[C@H]2CCC[NH2+]2)cc1 ZINC000843048121 630608188 /nfs/dbraw/zinc/60/81/88/630608188.db2.gz OAFVERRODSYCKB-NHQAVIFJSA-N 2 2 313.489 3.372 20 10 DGCDLP CC(C)(C)[C@@H](Cn1cc[nH+]c1)[NH2+]Cc1cc(Cl)ccc1O ZINC000037156666 661217069 /nfs/dbraw/zinc/21/70/69/661217069.db2.gz GSRWROZQRDOIEC-OAHLLOKOSA-N 2 2 307.825 3.447 20 10 DGCDLP C[C@@H]1CCC[N@@H+]1CC[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC001620821760 1192174152 /nfs/dbraw/zinc/17/41/52/1192174152.db2.gz IPQAURPXMJDOFI-QGZVFWFLSA-N 2 2 301.478 3.251 20 10 DGCDLP C[C@@H]1CCC[N@H+]1CC[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC001620821760 1192174154 /nfs/dbraw/zinc/17/41/54/1192174154.db2.gz IPQAURPXMJDOFI-QGZVFWFLSA-N 2 2 301.478 3.251 20 10 DGCDLP CCCOc1ccc(C[NH2+]C[C@H](C)Cn2cc[nH+]c2)cc1C ZINC001655526199 1195927736 /nfs/dbraw/zinc/92/77/36/1195927736.db2.gz DZFOUCLEYSYDPG-HNNXBMFYSA-N 2 2 301.434 3.406 20 10 DGCDLP Oc1cc(Cl)ccc1C[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC001657228496 1196120648 /nfs/dbraw/zinc/12/06/48/1196120648.db2.gz AKKNGVHGXDRTMM-GUYCJALGSA-N 2 2 320.864 3.494 20 10 DGCDLP Oc1cc(Cl)ccc1C[N@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC001657228496 1196120650 /nfs/dbraw/zinc/12/06/50/1196120650.db2.gz AKKNGVHGXDRTMM-GUYCJALGSA-N 2 2 320.864 3.494 20 10 DGCDLP Oc1cc(Cl)ccc1C[NH+]1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC001657228496 1196120652 /nfs/dbraw/zinc/12/06/52/1196120652.db2.gz AKKNGVHGXDRTMM-GUYCJALGSA-N 2 2 320.864 3.494 20 10 DGCDLP Oc1cc(Cl)ccc1C[NH+]1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC001657228496 1196120654 /nfs/dbraw/zinc/12/06/54/1196120654.db2.gz AKKNGVHGXDRTMM-GUYCJALGSA-N 2 2 320.864 3.494 20 10 DGCDLP Oc1cc(Cl)ccc1C[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC001657228497 1196121108 /nfs/dbraw/zinc/12/11/08/1196121108.db2.gz AKKNGVHGXDRTMM-SUMWQHHRSA-N 2 2 320.864 3.494 20 10 DGCDLP Oc1cc(Cl)ccc1C[N@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC001657228497 1196121111 /nfs/dbraw/zinc/12/11/11/1196121111.db2.gz AKKNGVHGXDRTMM-SUMWQHHRSA-N 2 2 320.864 3.494 20 10 DGCDLP Oc1cc(Cl)ccc1C[NH+]1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC001657228497 1196121116 /nfs/dbraw/zinc/12/11/16/1196121116.db2.gz AKKNGVHGXDRTMM-SUMWQHHRSA-N 2 2 320.864 3.494 20 10 DGCDLP Oc1cc(Cl)ccc1C[NH+]1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC001657228497 1196121122 /nfs/dbraw/zinc/12/11/22/1196121122.db2.gz AKKNGVHGXDRTMM-SUMWQHHRSA-N 2 2 320.864 3.494 20 10 DGCDLP Cc1cc(CN(C)c2ccc(OCC[NH+](C)C)cc2)cc(C)[nH+]1 ZINC001658764935 1196297954 /nfs/dbraw/zinc/29/79/54/1196297954.db2.gz UBFQXNVZMBJRGC-UHFFFAOYSA-N 2 2 313.445 3.275 20 10 DGCDLP CN1CCCc2cc(C[NH+]3CCC(n4cc[nH+]c4)CC3)ccc21 ZINC001138356949 1091150520 /nfs/dbraw/zinc/15/05/20/1091150520.db2.gz VTPJFNLURQBGPX-UHFFFAOYSA-N 2 2 310.445 3.103 20 10 DGCDLP C[C@H]1CC[N@H+](Cc2cc(Cl)c(Cl)cc2O)C[C@@H]1C[NH3+] ZINC001205314552 1091180625 /nfs/dbraw/zinc/18/06/25/1091180625.db2.gz BRPWNWKAFLBRRZ-ONGXEEELSA-N 2 2 303.233 3.116 20 10 DGCDLP C[C@H]1CC[N@@H+](Cc2cc(Cl)c(Cl)cc2O)C[C@@H]1C[NH3+] ZINC001205314552 1091180630 /nfs/dbraw/zinc/18/06/30/1091180630.db2.gz BRPWNWKAFLBRRZ-ONGXEEELSA-N 2 2 303.233 3.116 20 10 DGCDLP CCN(CC)c1ccc(C[N@@H+]2C[C@@H](C)CC[C@H]2C[NH3+])c(OC)c1 ZINC001205817757 1091364430 /nfs/dbraw/zinc/36/44/30/1091364430.db2.gz QVTJELFZFYCFNG-YJBOKZPZSA-N 2 2 319.493 3.101 20 10 DGCDLP CCN(CC)c1ccc(C[N@H+]2C[C@@H](C)CC[C@H]2C[NH3+])c(OC)c1 ZINC001205817757 1091364443 /nfs/dbraw/zinc/36/44/43/1091364443.db2.gz QVTJELFZFYCFNG-YJBOKZPZSA-N 2 2 319.493 3.101 20 10 DGCDLP C[C@@]1(C[NH3+])CCCC[N@H+](Cc2cc(F)cc(Cl)c2O)C1 ZINC001206572097 1091673879 /nfs/dbraw/zinc/67/38/79/1091673879.db2.gz ASWRQTKKGXMJIC-HNNXBMFYSA-N 2 2 300.805 3.136 20 10 DGCDLP C[C@@]1(C[NH3+])CCCC[N@@H+](Cc2cc(F)cc(Cl)c2O)C1 ZINC001206572097 1091673884 /nfs/dbraw/zinc/67/38/84/1091673884.db2.gz ASWRQTKKGXMJIC-HNNXBMFYSA-N 2 2 300.805 3.136 20 10 DGCDLP C[C@H]1CC[C@H](C[NH3+])C[N@H+]1Cc1c(O)ccc(Cl)c1Cl ZINC001206810559 1091749858 /nfs/dbraw/zinc/74/98/58/1091749858.db2.gz NYFFQMSYQRGLKF-VHSXEESVSA-N 2 2 303.233 3.258 20 10 DGCDLP C[N@@H+]1CCC[C@@]2(CCC[NH+](Cc3cc(Cl)c(O)cc3O)C2)C1 ZINC001276617073 1092662641 /nfs/dbraw/zinc/66/26/41/1092662641.db2.gz NLPIRAUNTDAVMK-QGZVFWFLSA-N 2 2 324.852 3.059 20 10 DGCDLP C[N@H+]1CCC[C@@]2(CCC[NH+](Cc3cc(Cl)c(O)cc3O)C2)C1 ZINC001276617073 1092662649 /nfs/dbraw/zinc/66/26/49/1092662649.db2.gz NLPIRAUNTDAVMK-QGZVFWFLSA-N 2 2 324.852 3.059 20 10 DGCDLP C[NH+]1CCC[C@@]2(CCC[N@H+](Cc3cc(Cl)c(O)cc3O)C2)C1 ZINC001276617073 1092662653 /nfs/dbraw/zinc/66/26/53/1092662653.db2.gz NLPIRAUNTDAVMK-QGZVFWFLSA-N 2 2 324.852 3.059 20 10 DGCDLP C[NH+]1CCC[C@@]2(CCC[N@@H+](Cc3cc(Cl)c(O)cc3O)C2)C1 ZINC001276617073 1092662657 /nfs/dbraw/zinc/66/26/57/1092662657.db2.gz NLPIRAUNTDAVMK-QGZVFWFLSA-N 2 2 324.852 3.059 20 10 DGCDLP C[N@@H+]1CCC[C@H]2C[NH+](Cc3cc(C(C)(C)C)ccc3O)C[C@H]21 ZINC001233286816 1098276432 /nfs/dbraw/zinc/27/64/32/1098276432.db2.gz JQNRKSVYDMCPAE-WMLDXEAASA-N 2 2 302.462 3.216 20 10 DGCDLP C[N@H+]1CCC[C@H]2C[NH+](Cc3cc(C(C)(C)C)ccc3O)C[C@H]21 ZINC001233286816 1098276434 /nfs/dbraw/zinc/27/64/34/1098276434.db2.gz JQNRKSVYDMCPAE-WMLDXEAASA-N 2 2 302.462 3.216 20 10 DGCDLP C[NH+]1CCC[C@H]2C[N@H+](Cc3cc(C(C)(C)C)ccc3O)C[C@H]21 ZINC001233286816 1098276438 /nfs/dbraw/zinc/27/64/38/1098276438.db2.gz JQNRKSVYDMCPAE-WMLDXEAASA-N 2 2 302.462 3.216 20 10 DGCDLP C[NH+]1CCC[C@H]2C[N@@H+](Cc3cc(C(C)(C)C)ccc3O)C[C@H]21 ZINC001233286816 1098276441 /nfs/dbraw/zinc/27/64/41/1098276441.db2.gz JQNRKSVYDMCPAE-WMLDXEAASA-N 2 2 302.462 3.216 20 10 DGCDLP CC[N@H+](CCn1cc[nH+]c1)Cc1ccc(C(F)(F)F)cc1O ZINC001233455381 1098340268 /nfs/dbraw/zinc/34/02/68/1098340268.db2.gz IOOBALNHQRCPNE-UHFFFAOYSA-N 2 2 313.323 3.130 20 10 DGCDLP CC[N@@H+](CCn1cc[nH+]c1)Cc1ccc(C(F)(F)F)cc1O ZINC001233455381 1098340274 /nfs/dbraw/zinc/34/02/74/1098340274.db2.gz IOOBALNHQRCPNE-UHFFFAOYSA-N 2 2 313.323 3.130 20 10 DGCDLP c1cc(N2CCCCC2)ccc1C[N@@H+]1CCCC[C@@]12CC[NH2+]C2 ZINC001235118451 1098818078 /nfs/dbraw/zinc/81/80/78/1098818078.db2.gz VJGAYVAHBLCFQN-FQEVSTJZSA-N 2 2 313.489 3.395 20 10 DGCDLP c1cc(N2CCCCC2)ccc1C[N@H+]1CCCC[C@@]12CC[NH2+]C2 ZINC001235118451 1098818089 /nfs/dbraw/zinc/81/80/89/1098818089.db2.gz VJGAYVAHBLCFQN-FQEVSTJZSA-N 2 2 313.489 3.395 20 10 DGCDLP CC(C)(C)c1ccc(C[N@@H+]2CCCC[C@]23CC[NH2+]C3)c(O)c1 ZINC001235128594 1098825867 /nfs/dbraw/zinc/82/58/67/1098825867.db2.gz HNIOBRHWDOAXBQ-LJQANCHMSA-N 2 2 302.462 3.408 20 10 DGCDLP CC(C)(C)c1ccc(C[N@H+]2CCCC[C@]23CC[NH2+]C3)c(O)c1 ZINC001235128594 1098825882 /nfs/dbraw/zinc/82/58/82/1098825882.db2.gz HNIOBRHWDOAXBQ-LJQANCHMSA-N 2 2 302.462 3.408 20 10 DGCDLP C[N@H+](Cc1ccc2c(c1O)C=CC(C)(C)O2)[C@@]1(C)CCC[NH2+]C1 ZINC001236207618 1099464243 /nfs/dbraw/zinc/46/42/43/1099464243.db2.gz BZETXAIFHQNAFX-IBGZPJMESA-N 2 2 316.445 3.150 20 10 DGCDLP C[N@@H+](Cc1ccc2c(c1O)C=CC(C)(C)O2)[C@@]1(C)CCC[NH2+]C1 ZINC001236207618 1099464250 /nfs/dbraw/zinc/46/42/50/1099464250.db2.gz BZETXAIFHQNAFX-IBGZPJMESA-N 2 2 316.445 3.150 20 10 DGCDLP CCC[N@H+](Cc1ccc2c(c1O)C=CC(C)(C)O2)[C@@H]1CC[NH2+]C1 ZINC001236331087 1099542123 /nfs/dbraw/zinc/54/21/23/1099542123.db2.gz WHHMLAJMKBXKEE-OAHLLOKOSA-N 2 2 316.445 3.150 20 10 DGCDLP CCC[N@@H+](Cc1ccc2c(c1O)C=CC(C)(C)O2)[C@@H]1CC[NH2+]C1 ZINC001236331087 1099542130 /nfs/dbraw/zinc/54/21/30/1099542130.db2.gz WHHMLAJMKBXKEE-OAHLLOKOSA-N 2 2 316.445 3.150 20 10 DGCDLP CCC[N@@H+](Cc1cccc(C(F)(F)F)c1O)C[C@@H]1CC[NH2+]C1 ZINC001236844521 1099830169 /nfs/dbraw/zinc/83/01/69/1099830169.db2.gz VOUSRUAVHPHMAX-GFCCVEGCSA-N 2 2 316.367 3.233 20 10 DGCDLP CCC[N@H+](Cc1cccc(C(F)(F)F)c1O)C[C@@H]1CC[NH2+]C1 ZINC001236844521 1099830179 /nfs/dbraw/zinc/83/01/79/1099830179.db2.gz VOUSRUAVHPHMAX-GFCCVEGCSA-N 2 2 316.367 3.233 20 10 DGCDLP CC(C)c1ccc(C[NH+]2CC3(C2)CC[N@H+](CC2CC2)C3)c(O)c1 ZINC001237048290 1099942238 /nfs/dbraw/zinc/94/22/38/1099942238.db2.gz JFFIFHUSQWLPBN-UHFFFAOYSA-N 2 2 314.473 3.433 20 10 DGCDLP CC(C)c1ccc(C[NH+]2CC3(C2)CC[N@@H+](CC2CC2)C3)c(O)c1 ZINC001237048290 1099942250 /nfs/dbraw/zinc/94/22/50/1099942250.db2.gz JFFIFHUSQWLPBN-UHFFFAOYSA-N 2 2 314.473 3.433 20 10 DGCDLP Cc1cc(C)c(O)c2c1CC(C)(C)[C@H]2[NH2+][C@H]1CC[C@H](C)[NH2+]C1 ZINC001246525851 1104577661 /nfs/dbraw/zinc/57/76/61/1104577661.db2.gz OJAFNCRIJAZNFW-DEYYWGMASA-N 2 2 302.462 3.363 20 10 DGCDLP C[N@@H+]1CCC2(C[NH+](Cc3cccc(-c4ccccc4)c3O)C2)C1 ZINC001276140011 1105029261 /nfs/dbraw/zinc/02/92/61/1105029261.db2.gz MXSHHPXFFPHGRE-UHFFFAOYSA-N 2 2 308.425 3.197 20 10 DGCDLP C[N@H+]1CCC2(C[NH+](Cc3cccc(-c4ccccc4)c3O)C2)C1 ZINC001276140011 1105029269 /nfs/dbraw/zinc/02/92/69/1105029269.db2.gz MXSHHPXFFPHGRE-UHFFFAOYSA-N 2 2 308.425 3.197 20 10 DGCDLP Cc1ccc(O)c(C[N@@H+](Cc2ccco2)C2CC[NH+](C)CC2)c1 ZINC000290567070 292164597 /nfs/dbraw/zinc/16/45/97/292164597.db2.gz STWPYXJTQAXQEB-UHFFFAOYSA-N 2 2 314.429 3.390 20 10 DGCDLP Cc1ccc(O)c(C[N@H+](Cc2ccco2)C2CC[NH+](C)CC2)c1 ZINC000290567070 292164600 /nfs/dbraw/zinc/16/46/00/292164600.db2.gz STWPYXJTQAXQEB-UHFFFAOYSA-N 2 2 314.429 3.390 20 10 DGCDLP C[C@@H]([NH2+]C1CC[NH+](Cc2ccncc2)CC1)c1ccccc1O ZINC000183430577 432293437 /nfs/dbraw/zinc/29/34/37/432293437.db2.gz ATTLWNYSDQCEIJ-OAHLLOKOSA-N 2 2 311.429 3.102 20 10 DGCDLP CC[C@H]([NH2+]Cc1ccc(-n2cc[nH+]c2)nc1)c1ccccc1O ZINC000373212836 433129414 /nfs/dbraw/zinc/12/94/14/433129414.db2.gz VHUSGOPJWGSXIW-INIZCTEOSA-N 2 2 308.385 3.214 20 10 DGCDLP Cc1[nH+]ccn1CCC[N@@H+](C)Cc1cc(Cl)c(F)cc1O ZINC000293973720 433948406 /nfs/dbraw/zinc/94/84/06/433948406.db2.gz QVAVLAGQSHNDTD-UHFFFAOYSA-N 2 2 311.788 3.212 20 10 DGCDLP Cc1[nH+]ccn1CCC[N@H+](C)Cc1cc(Cl)c(F)cc1O ZINC000293973720 433948414 /nfs/dbraw/zinc/94/84/14/433948414.db2.gz QVAVLAGQSHNDTD-UHFFFAOYSA-N 2 2 311.788 3.212 20 10 DGCDLP C[N@H+](Cc1c(O)ccc(Cl)c1F)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000377633363 433938619 /nfs/dbraw/zinc/93/86/19/433938619.db2.gz XSDZBBTUPNUVSX-FOSCPWQOSA-N 2 2 312.816 3.242 20 10 DGCDLP C[N@@H+](Cc1c(O)ccc(Cl)c1F)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000377633363 433938622 /nfs/dbraw/zinc/93/86/22/433938622.db2.gz XSDZBBTUPNUVSX-FOSCPWQOSA-N 2 2 312.816 3.242 20 10 DGCDLP C[NH+](Cc1c(O)ccc(Cl)c1F)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000377633363 433938630 /nfs/dbraw/zinc/93/86/30/433938630.db2.gz XSDZBBTUPNUVSX-FOSCPWQOSA-N 2 2 312.816 3.242 20 10 DGCDLP C[NH+](Cc1c(O)ccc(Cl)c1F)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000377633363 433938634 /nfs/dbraw/zinc/93/86/34/433938634.db2.gz XSDZBBTUPNUVSX-FOSCPWQOSA-N 2 2 312.816 3.242 20 10 DGCDLP CC[C@@H]([NH2+]C1CC[NH+](CCCOC)CC1)c1ccc(F)cc1O ZINC000285951539 434115722 /nfs/dbraw/zinc/11/57/22/434115722.db2.gz GEPRXEDPXZRUEC-QGZVFWFLSA-N 2 2 324.440 3.073 20 10 DGCDLP CN(C)c1ccc(CN(c2cccc[nH+]2)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC000895111397 618539928 /nfs/dbraw/zinc/53/99/28/618539928.db2.gz OPDKHQFKPQQNME-UAPYVXQJSA-N 2 2 324.472 3.424 20 10 DGCDLP CCc1cccc(C[NH2+][C@H](CC[NH+](C)C)c2cccnc2)c1O ZINC000896717929 618949916 /nfs/dbraw/zinc/94/99/16/618949916.db2.gz YIXVKCSTKDXNDT-GOSISDBHSA-N 2 2 313.445 3.132 20 10 DGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+]Cc2cccc(Cl)c2)cc1 ZINC000841041454 619243039 /nfs/dbraw/zinc/24/30/39/619243039.db2.gz CJCMKASRNBTLOE-QGZVFWFLSA-N 2 2 303.837 3.196 20 10 DGCDLP C[N@@H+]1CCC[C@@H](CC[NH2+]Cc2cc(Cl)c(F)cc2O)C1 ZINC000839183276 621344691 /nfs/dbraw/zinc/34/46/91/621344691.db2.gz VSHJUWCNJOMSPY-NSHDSACASA-N 2 2 300.805 3.006 20 10 DGCDLP C[N@H+]1CCC[C@@H](CC[NH2+]Cc2cc(Cl)c(F)cc2O)C1 ZINC000839183276 621344694 /nfs/dbraw/zinc/34/46/94/621344694.db2.gz VSHJUWCNJOMSPY-NSHDSACASA-N 2 2 300.805 3.006 20 10 DGCDLP C[C@@H](C[NH2+][C@@H](C)c1cc(F)cc(F)c1O)C[NH+]1CCCCC1 ZINC000756435033 621638373 /nfs/dbraw/zinc/63/83/73/621638373.db2.gz SXCLZDLLVZQCQL-STQMWFEESA-N 2 2 312.404 3.443 20 10 DGCDLP Cc1[nH+]ccn1C[C@@H](C)C[NH2+][C@@H](C)c1cc(F)cc(F)c1O ZINC000756534212 621645970 /nfs/dbraw/zinc/64/59/70/621645970.db2.gz LFNQTEYWQHQTOV-QWRGUYRKSA-N 2 2 309.360 3.162 20 10 DGCDLP C[C@@H]1CC[C@@H]([NH2+]Cc2ccc(N(C)C)cc2C(F)(F)F)C[NH2+]1 ZINC000863649699 621693318 /nfs/dbraw/zinc/69/33/18/621693318.db2.gz GTTZKTFSJYQHEN-DGCLKSJQSA-N 2 2 315.383 3.002 20 10 DGCDLP CCN(C)c1ccc([C@H](C)[NH2+]CCCCn2cc[nH+]c2)cc1 ZINC000765257083 622254507 /nfs/dbraw/zinc/25/45/07/622254507.db2.gz HZBILNKMZOLRJJ-INIZCTEOSA-N 2 2 300.450 3.470 20 10 DGCDLP CC[C@@H]([NH2+]C[C@]1([NH+](C)C)CCSC1)c1ccc(N(C)C)cc1 ZINC000766440727 622330025 /nfs/dbraw/zinc/33/00/25/622330025.db2.gz YVBYIWHYBJKHKQ-QZTJIDSGSA-N 2 2 321.534 3.231 20 10 DGCDLP CCOc1ccc(C[N@H+](C)C2CC[NH+](C(C)C)CC2)c(O)c1 ZINC000768228750 622446468 /nfs/dbraw/zinc/44/64/68/622446468.db2.gz IWHUCXNISWTEFH-UHFFFAOYSA-N 2 2 306.450 3.096 20 10 DGCDLP CCOc1ccc(C[N@@H+](C)C2CC[NH+](C(C)C)CC2)c(O)c1 ZINC000768228750 622446471 /nfs/dbraw/zinc/44/64/71/622446471.db2.gz IWHUCXNISWTEFH-UHFFFAOYSA-N 2 2 306.450 3.096 20 10 DGCDLP C[C@@H]([NH2+][C@@H]1CCn2cc[nH+]c2C1)c1cc2c(cc1O)CCCC2 ZINC000779065652 623726656 /nfs/dbraw/zinc/72/66/56/623726656.db2.gz NIIHTIUEYCAFNR-CZUORRHYSA-N 2 2 311.429 3.133 20 10 DGCDLP CC[NH+](CC)CCC[C@H](C)[NH2+]Cc1cc(F)cc(F)c1O ZINC000882877764 625841065 /nfs/dbraw/zinc/84/10/65/625841065.db2.gz DATZDHGCSFCAST-LBPRGKRZSA-N 2 2 300.393 3.271 20 10 DGCDLP Cc1[nH+]ccn1CCC[N@@H+](C)Cc1c(O)ccc(Cl)c1F ZINC000809753516 626946826 /nfs/dbraw/zinc/94/68/26/626946826.db2.gz VFGCBCAGEZXWBZ-UHFFFAOYSA-N 2 2 311.788 3.212 20 10 DGCDLP Cc1[nH+]ccn1CCC[N@H+](C)Cc1c(O)ccc(Cl)c1F ZINC000809753516 626946828 /nfs/dbraw/zinc/94/68/28/626946828.db2.gz VFGCBCAGEZXWBZ-UHFFFAOYSA-N 2 2 311.788 3.212 20 10 DGCDLP C[C@H]([NH2+][C@@H](Cn1cc[nH+]c1)C(C)(C)C)c1c(O)cccc1F ZINC000886509031 627154642 /nfs/dbraw/zinc/15/46/42/627154642.db2.gz XWCOPKKRIAKOCZ-WFASDCNBSA-N 2 2 305.397 3.493 20 10 DGCDLP C[C@@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)c1cccc(C(F)(F)F)c1O ZINC000815578312 627686856 /nfs/dbraw/zinc/68/68/56/627686856.db2.gz LWGFLJHDTZDPHS-VXGBXAGGSA-N 2 2 316.367 3.403 20 10 DGCDLP C[C@@H]([NH2+]C[C@H]1CCC[N@@H+](C)C1)c1cccc(C(F)(F)F)c1O ZINC000815578312 627686859 /nfs/dbraw/zinc/68/68/59/627686859.db2.gz LWGFLJHDTZDPHS-VXGBXAGGSA-N 2 2 316.367 3.403 20 10 DGCDLP C[C@H](C[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O)C[NH+](C)C ZINC000815627810 627693039 /nfs/dbraw/zinc/69/30/39/627693039.db2.gz KEFQACVOZNQIIL-MNOVXSKESA-N 2 2 304.356 3.259 20 10 DGCDLP C[C@H](C[NH2+]Cc1cc(Cl)c(F)cc1O)C[NH+]1CCCC1 ZINC000816536443 627804272 /nfs/dbraw/zinc/80/42/72/627804272.db2.gz XVXXOJLKGWSXMW-LLVKDONJSA-N 2 2 300.805 3.006 20 10 DGCDLP CC1CCN(c2ccc(C[NH2+][C@@H]3C[NH2+]CC[C@H]3C)cc2)CC1 ZINC000817902783 627957118 /nfs/dbraw/zinc/95/71/18/627957118.db2.gz YEEROIXBQJRKQY-VQIMIIECSA-N 2 2 301.478 3.011 20 10 DGCDLP COc1ccc([C@@H](C)[NH2+]C[C@@H]([NH3+])c2ccc(N(C)C)cc2)cc1 ZINC000817938359 627966794 /nfs/dbraw/zinc/96/67/94/627966794.db2.gz JKJVGUQYRRGWMK-AUUYWEPGSA-N 2 2 313.445 3.112 20 10 DGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+][C@H]2CCc3ccc(F)cc32)cc1 ZINC000817938853 627967686 /nfs/dbraw/zinc/96/76/86/627967686.db2.gz UOKSLRNVTCGJMM-MOPGFXCFSA-N 2 2 313.420 3.169 20 10 DGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+][C@@H]2CCCc3sccc32)cc1 ZINC000817938749 627967891 /nfs/dbraw/zinc/96/78/91/627967891.db2.gz RHCNELAYAHIGIU-IAGOWNOFSA-N 2 2 315.486 3.481 20 10 DGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+][C@H](c2ccccc2)C2CC2)cc1 ZINC000817942610 627969392 /nfs/dbraw/zinc/96/93/92/627969392.db2.gz PWBBQWVDUSEMOG-WOJBJXKFSA-N 2 2 309.457 3.493 20 10 DGCDLP C[C@@H](CSC(C)(C)C)[NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000817944050 627970037 /nfs/dbraw/zinc/97/00/37/627970037.db2.gz WZPYLNDFRNLWJP-XJKSGUPXSA-N 2 2 309.523 3.262 20 10 DGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+][C@H]2CCCc3ccccc3C2)cc1 ZINC000817944202 627970097 /nfs/dbraw/zinc/97/00/97/627970097.db2.gz YCPSLDQOALGBIK-PZJWPPBQSA-N 2 2 323.484 3.290 20 10 DGCDLP CC(C)C[C@H](C[NH3+])[NH2+][C@H](C)c1cc(Br)ccc1O ZINC000817957558 627974783 /nfs/dbraw/zinc/97/47/83/627974783.db2.gz CVYPMLZFZYGNAD-ZYHUDNBSSA-N 2 2 315.255 3.179 20 10 DGCDLP CC(C)C[C@H](C[NH3+])[NH2+][C@@H](C)c1ccc(Br)cc1O ZINC000817958979 627975197 /nfs/dbraw/zinc/97/51/97/627975197.db2.gz NXWHBGMXNOMAQD-CMPLNLGQSA-N 2 2 315.255 3.179 20 10 DGCDLP C[N@H+](CCCC[NH2+]Cc1cc(Cl)cc(F)c1O)C1CC1 ZINC000835063281 629841350 /nfs/dbraw/zinc/84/13/50/629841350.db2.gz JLUAJYRIQZCKRU-UHFFFAOYSA-N 2 2 300.805 3.149 20 10 DGCDLP C[N@@H+](CCCC[NH2+]Cc1cc(Cl)cc(F)c1O)C1CC1 ZINC000835063281 629841355 /nfs/dbraw/zinc/84/13/55/629841355.db2.gz JLUAJYRIQZCKRU-UHFFFAOYSA-N 2 2 300.805 3.149 20 10 DGCDLP COc1cccc(C[NH2+]C[C@@H]([NH3+])c2ccc(C(C)C)cc2)c1O ZINC000841037458 630399869 /nfs/dbraw/zinc/39/98/69/630399869.db2.gz QPZNKIHABKXUCK-QGZVFWFLSA-N 2 2 314.429 3.314 20 10 DGCDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+]Cc2ccc3cnccc3c2)cc1 ZINC000841043230 630400986 /nfs/dbraw/zinc/40/09/86/630400986.db2.gz PLGOBXSFZGUCOH-FQEVSTJZSA-N 2 2 320.440 3.090 20 10 DGCDLP Cc1cc(C[NH2+]C[C@H]([NH3+])c2ccc(N(C)C)cc2)c(C)s1 ZINC000841044917 630401226 /nfs/dbraw/zinc/40/12/26/630401226.db2.gz FYBDQAIPSWXVDM-KRWDZBQOSA-N 2 2 303.475 3.221 20 10 DGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+][C@H]2CCCC[C@@H]2C2CC2)cc1 ZINC000841045305 630401251 /nfs/dbraw/zinc/40/12/51/630401251.db2.gz JRVQKYCZJGECGW-QRVBRYPASA-N 2 2 301.478 3.311 20 10 DGCDLP C[C@@H](CCCC(F)(F)F)[NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000841045534 630401812 /nfs/dbraw/zinc/40/18/12/630401812.db2.gz MKZQKWLUGHQZAA-SWLSCSKDSA-N 2 2 317.399 3.463 20 10 DGCDLP CCC[NH2+]CC[NH2+]Cc1ccc(OCc2ccccc2)cc1O ZINC000841047285 630401924 /nfs/dbraw/zinc/40/19/24/630401924.db2.gz ZBGMVOUQGAKYRM-UHFFFAOYSA-N 2 2 314.429 3.060 20 10 DGCDLP CN(C)c1ccc(C[NH+]2CCC(C)([NH3+])CC2)c(C(F)(F)F)c1 ZINC000843108905 630614459 /nfs/dbraw/zinc/61/44/59/630614459.db2.gz WAPJKHRQLKZLKR-UHFFFAOYSA-N 2 2 315.383 3.085 20 10 DGCDLP C[C@H]1CCC[N@H+](Cc2cc(Cl)cc(F)c2O)[C@@H]1CC[NH3+] ZINC000844902100 630970654 /nfs/dbraw/zinc/97/06/54/630970654.db2.gz NKKKRONGSYQLHW-IINYFYTJSA-N 2 2 300.805 3.134 20 10 DGCDLP C[C@H]1CCC[N@@H+](Cc2cc(Cl)cc(F)c2O)[C@@H]1CC[NH3+] ZINC000844902100 630970657 /nfs/dbraw/zinc/97/06/57/630970657.db2.gz NKKKRONGSYQLHW-IINYFYTJSA-N 2 2 300.805 3.134 20 10 DGCDLP COc1ccc(C[NH2+][C@@H]2C[NH2+]CC[C@@H]2c2ccccc2)cc1C ZINC000849350118 631900625 /nfs/dbraw/zinc/90/06/25/631900625.db2.gz QJUFHESRTCACNN-RTBURBONSA-N 2 2 310.441 3.239 20 10 DGCDLP CCN(C)c1ccc([C@H](C)[NH2+][C@@H]2CC[N@H+](CC3CC3)C2)cc1 ZINC000157651099 659074353 /nfs/dbraw/zinc/07/43/53/659074353.db2.gz OCNZLAROFHONSN-MAUKXSAKSA-N 2 2 301.478 3.278 20 10 DGCDLP CCN(C)c1ccc([C@H](C)[NH2+][C@@H]2CC[N@@H+](CC3CC3)C2)cc1 ZINC000157651099 659074359 /nfs/dbraw/zinc/07/43/59/659074359.db2.gz OCNZLAROFHONSN-MAUKXSAKSA-N 2 2 301.478 3.278 20 10 DGCDLP CCN(CC)c1ccc(C[N@@H+]2CC[C@@H](C[NH+](C)CC)C2)cc1F ZINC000093770229 662360038 /nfs/dbraw/zinc/36/00/38/662360038.db2.gz QRJBIIWFDQHJRT-KRWDZBQOSA-N 2 2 321.484 3.446 20 10 DGCDLP CCN(CC)c1ccc(C[N@H+]2CC[C@@H](C[NH+](C)CC)C2)cc1F ZINC000093770229 662360039 /nfs/dbraw/zinc/36/00/39/662360039.db2.gz QRJBIIWFDQHJRT-KRWDZBQOSA-N 2 2 321.484 3.446 20 10 DGCDLP CCN(CC)c1ccc(C[NH+]2CC[C@@H](C[N@H+](C)CC)C2)cc1F ZINC000093770229 662360040 /nfs/dbraw/zinc/36/00/40/662360040.db2.gz QRJBIIWFDQHJRT-KRWDZBQOSA-N 2 2 321.484 3.446 20 10 DGCDLP CCN(CC)c1ccc(C[NH+]2CC[C@@H](C[N@@H+](C)CC)C2)cc1F ZINC000093770229 662360041 /nfs/dbraw/zinc/36/00/41/662360041.db2.gz QRJBIIWFDQHJRT-KRWDZBQOSA-N 2 2 321.484 3.446 20 10 DGCDLP CC1=CCC[C@H](C)[C@@H]1C[NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1 ZINC001576556140 1191843975 /nfs/dbraw/zinc/84/39/75/1191843975.db2.gz NZHUESLFRHZUJD-IPELMVKDSA-N 2 2 301.478 3.334 20 10 DGCDLP CS[C@@H]1CCC[C@H]([NH2+]C[C@H]([NH3+])c2ccc(N(C)C)cc2)C1 ZINC001579370395 1191974523 /nfs/dbraw/zinc/97/45/23/1191974523.db2.gz QWCLZAFMKXYESQ-UAGQMJEPSA-N 2 2 307.507 3.016 20 10 DGCDLP CS[C@@H]1CCC[C@H]([NH2+]C[C@@H]([NH3+])c2ccc(N(C)C)cc2)C1 ZINC001579370472 1191974736 /nfs/dbraw/zinc/97/47/36/1191974736.db2.gz QWCLZAFMKXYESQ-USXIJHARSA-N 2 2 307.507 3.016 20 10 DGCDLP C[NH+](C)[C@H]1CCC[C@H]([NH2+]Cc2cc(Cl)cc(F)c2O)C1 ZINC001647040763 1195242401 /nfs/dbraw/zinc/24/24/01/1195242401.db2.gz WVMARBMLLVYZSB-STQMWFEESA-N 2 2 300.805 3.147 20 10 DGCDLP CCC[N@@H+]1CC[C@@H](C[NH2+]Cc2cc(Cl)cc(F)c2O)C1 ZINC001648920630 1082849570 /nfs/dbraw/zinc/84/95/70/1082849570.db2.gz FIJFAULAVNHQFH-NSHDSACASA-N 2 2 300.805 3.006 20 10 DGCDLP CCC[N@H+]1CC[C@@H](C[NH2+]Cc2cc(Cl)cc(F)c2O)C1 ZINC001648920630 1082849576 /nfs/dbraw/zinc/84/95/76/1082849576.db2.gz FIJFAULAVNHQFH-NSHDSACASA-N 2 2 300.805 3.006 20 10 DGCDLP CCC[N@@H+]1CC[C@H](C[NH2+]Cc2cc(Cl)cc(F)c2O)C1 ZINC001648920629 1082849751 /nfs/dbraw/zinc/84/97/51/1082849751.db2.gz FIJFAULAVNHQFH-LLVKDONJSA-N 2 2 300.805 3.006 20 10 DGCDLP CCC[N@H+]1CC[C@H](C[NH2+]Cc2cc(Cl)cc(F)c2O)C1 ZINC001648920629 1082849755 /nfs/dbraw/zinc/84/97/55/1082849755.db2.gz FIJFAULAVNHQFH-LLVKDONJSA-N 2 2 300.805 3.006 20 10 DGCDLP Cn1c[nH+]cc1-c1cccc(N2C[C@@H]([NH3+])Cc3ccccc32)c1 ZINC001162853343 1089993247 /nfs/dbraw/zinc/99/32/47/1089993247.db2.gz HXSIDKJQSRHEID-INIZCTEOSA-N 2 2 304.397 3.109 20 10 DGCDLP CCN(CC)c1ccc(C[NH+]2CCC([N@H+](C)CC)CC2)cc1 ZINC001203943882 1090846863 /nfs/dbraw/zinc/84/68/63/1090846863.db2.gz IFOPJWRIPQOMLR-UHFFFAOYSA-N 2 2 303.494 3.449 20 10 DGCDLP CCN(CC)c1ccc(C[NH+]2CCC([N@@H+](C)CC)CC2)cc1 ZINC001203943882 1090846869 /nfs/dbraw/zinc/84/68/69/1090846869.db2.gz IFOPJWRIPQOMLR-UHFFFAOYSA-N 2 2 303.494 3.449 20 10 DGCDLP C[C@@H]1[C@H](C[NH3+])CCC[N@@H+]1Cc1c(O)ccc(Cl)c1Cl ZINC001205916174 1091411617 /nfs/dbraw/zinc/41/16/17/1091411617.db2.gz SGYMDEUOKFJRHH-ZJUUUORDSA-N 2 2 303.233 3.258 20 10 DGCDLP C[C@@H]1[C@H](C[NH3+])CCC[N@H+]1Cc1c(O)ccc(Cl)c1Cl ZINC001205916174 1091411620 /nfs/dbraw/zinc/41/16/20/1091411620.db2.gz SGYMDEUOKFJRHH-ZJUUUORDSA-N 2 2 303.233 3.258 20 10 DGCDLP C[C@H](C[NH+](C)C)[C@@H]1CCCC[N@@H+]1Cc1cc(F)c(F)cc1O ZINC001206800505 1091745914 /nfs/dbraw/zinc/74/59/14/1091745914.db2.gz KTYMWBSRYNNLJV-WBMJQRKESA-N 2 2 312.404 3.223 20 10 DGCDLP C[C@H](C[NH+](C)C)[C@@H]1CCCC[N@H+]1Cc1cc(F)c(F)cc1O ZINC001206800505 1091745922 /nfs/dbraw/zinc/74/59/22/1091745922.db2.gz KTYMWBSRYNNLJV-WBMJQRKESA-N 2 2 312.404 3.223 20 10 DGCDLP Oc1c(C[N@@H+]2CC[C@]23CCC[NH2+]C3)cccc1-c1ccccc1 ZINC001222196775 1095487768 /nfs/dbraw/zinc/48/77/68/1095487768.db2.gz CCAZVRCJUFEJIB-FQEVSTJZSA-N 2 2 308.425 3.387 20 10 DGCDLP Oc1c(C[N@H+]2CC[C@]23CCC[NH2+]C3)cccc1-c1ccccc1 ZINC001222196775 1095487778 /nfs/dbraw/zinc/48/77/78/1095487778.db2.gz CCAZVRCJUFEJIB-FQEVSTJZSA-N 2 2 308.425 3.387 20 10 DGCDLP Oc1cc(Cl)c(F)cc1C[N@@H+]1CCC[C@]12CCC[NH2+]CC2 ZINC001222320354 1095549797 /nfs/dbraw/zinc/54/97/97/1095549797.db2.gz HDLBVQWEDRJQTA-INIZCTEOSA-N 2 2 312.816 3.293 20 10 DGCDLP Oc1cc(Cl)c(F)cc1C[N@H+]1CCC[C@]12CCC[NH2+]CC2 ZINC001222320354 1095549809 /nfs/dbraw/zinc/54/98/09/1095549809.db2.gz HDLBVQWEDRJQTA-INIZCTEOSA-N 2 2 312.816 3.293 20 10 DGCDLP Oc1ccc(F)c(Cl)c1C[N@@H+]1CCC[C@]2(CCC[NH2+]2)CC1 ZINC001235036796 1098766480 /nfs/dbraw/zinc/76/64/80/1098766480.db2.gz BQVGUBZVEXUJOU-MRXNPFEDSA-N 2 2 312.816 3.293 20 10 DGCDLP Oc1ccc(F)c(Cl)c1C[N@H+]1CCC[C@]2(CCC[NH2+]2)CC1 ZINC001235036796 1098766491 /nfs/dbraw/zinc/76/64/91/1098766491.db2.gz BQVGUBZVEXUJOU-MRXNPFEDSA-N 2 2 312.816 3.293 20 10 DGCDLP Oc1cc(C(F)(F)F)ccc1C[N@@H+]1CCCC[C@]12CC[NH2+]C2 ZINC001235116242 1098815966 /nfs/dbraw/zinc/81/59/66/1098815966.db2.gz FJMGFBIHYHYSAV-OAHLLOKOSA-N 2 2 314.351 3.129 20 10 DGCDLP Oc1cc(C(F)(F)F)ccc1C[N@H+]1CCCC[C@]12CC[NH2+]C2 ZINC001235116242 1098815978 /nfs/dbraw/zinc/81/59/78/1098815978.db2.gz FJMGFBIHYHYSAV-OAHLLOKOSA-N 2 2 314.351 3.129 20 10 DGCDLP c1cc(N2CCCCC2)ccc1C[N@@H+]1CCCC[C@]12CC[NH2+]C2 ZINC001235118454 1098819470 /nfs/dbraw/zinc/81/94/70/1098819470.db2.gz VJGAYVAHBLCFQN-HXUWFJFHSA-N 2 2 313.489 3.395 20 10 DGCDLP c1cc(N2CCCCC2)ccc1C[N@H+]1CCCC[C@]12CC[NH2+]C2 ZINC001235118454 1098819479 /nfs/dbraw/zinc/81/94/79/1098819479.db2.gz VJGAYVAHBLCFQN-HXUWFJFHSA-N 2 2 313.489 3.395 20 10 DGCDLP Cc1cc(C[N@@H+]2CC[C@@H]3[NH2+]CC[C@H]3C2)c(C)n1-c1ccccc1 ZINC001235265265 1098937198 /nfs/dbraw/zinc/93/71/98/1098937198.db2.gz CMCGAWOVMSRYKG-PXNSSMCTSA-N 2 2 309.457 3.278 20 10 DGCDLP Cc1cc(C[N@H+]2CC[C@@H]3[NH2+]CC[C@H]3C2)c(C)n1-c1ccccc1 ZINC001235265265 1098937206 /nfs/dbraw/zinc/93/72/06/1098937206.db2.gz CMCGAWOVMSRYKG-PXNSSMCTSA-N 2 2 309.457 3.278 20 10 DGCDLP C[N@@H+](Cc1ccc(N2CCCC2)cc1)C[C@H]([NH3+])Cc1ccccc1 ZINC001235693542 1099132193 /nfs/dbraw/zinc/13/21/93/1099132193.db2.gz CMIUFLBPCJCRSM-HXUWFJFHSA-N 2 2 323.484 3.289 20 10 DGCDLP C[N@H+](Cc1ccc(N2CCCC2)cc1)C[C@H]([NH3+])Cc1ccccc1 ZINC001235693542 1099132195 /nfs/dbraw/zinc/13/21/95/1099132195.db2.gz CMIUFLBPCJCRSM-HXUWFJFHSA-N 2 2 323.484 3.289 20 10 DGCDLP C[N@H+](Cc1cccc(C(F)(F)F)c1O)[C@@H]1CCCC[C@H]1[NH3+] ZINC001236214080 1099470422 /nfs/dbraw/zinc/47/04/22/1099470422.db2.gz DXIFZAYVWGMKOW-CHWSQXEVSA-N 2 2 302.340 3.113 20 10 DGCDLP C[N@@H+](Cc1cccc(C(F)(F)F)c1O)[C@@H]1CCCC[C@H]1[NH3+] ZINC001236214080 1099470423 /nfs/dbraw/zinc/47/04/23/1099470423.db2.gz DXIFZAYVWGMKOW-CHWSQXEVSA-N 2 2 302.340 3.113 20 10 DGCDLP CCC[N@H+](CCC[NH+](C)C)Cc1c(O)ccc(F)c1Cl ZINC001237128216 1099984381 /nfs/dbraw/zinc/98/43/81/1099984381.db2.gz MQJAENGVUVLDJB-UHFFFAOYSA-N 2 2 302.821 3.348 20 10 DGCDLP C[N@@H+]1CCC[C@@]2(CCC[NH+](Cc3cc(Cl)ccc3O)C2)C1 ZINC001275275319 1104700364 /nfs/dbraw/zinc/70/03/64/1104700364.db2.gz GWFUYIXXHWVXSJ-QGZVFWFLSA-N 2 2 308.853 3.353 20 10 DGCDLP C[N@H+]1CCC[C@@]2(CCC[NH+](Cc3cc(Cl)ccc3O)C2)C1 ZINC001275275319 1104700371 /nfs/dbraw/zinc/70/03/71/1104700371.db2.gz GWFUYIXXHWVXSJ-QGZVFWFLSA-N 2 2 308.853 3.353 20 10 DGCDLP C[NH+]1CCC[C@@]2(CCC[N@H+](Cc3cc(Cl)ccc3O)C2)C1 ZINC001275275319 1104700377 /nfs/dbraw/zinc/70/03/77/1104700377.db2.gz GWFUYIXXHWVXSJ-QGZVFWFLSA-N 2 2 308.853 3.353 20 10 DGCDLP C[NH+]1CCC[C@@]2(CCC[N@@H+](Cc3cc(Cl)ccc3O)C2)C1 ZINC001275275319 1104700386 /nfs/dbraw/zinc/70/03/86/1104700386.db2.gz GWFUYIXXHWVXSJ-QGZVFWFLSA-N 2 2 308.853 3.353 20 10 DGCDLP CCC[N@@H+](c1ccc(C[NH3+])cc1)C1CCC(C(=O)OC)CC1 ZINC000278355370 283308298 /nfs/dbraw/zinc/30/82/98/283308298.db2.gz JBBWPIOSRQCQNL-UHFFFAOYSA-N 2 2 304.434 3.094 20 10 DGCDLP CCC[N@H+](c1ccc(C[NH3+])cc1)C1CCC(C(=O)OC)CC1 ZINC000278355370 283308302 /nfs/dbraw/zinc/30/83/02/283308302.db2.gz JBBWPIOSRQCQNL-UHFFFAOYSA-N 2 2 304.434 3.094 20 10 DGCDLP Cc1[nH+]c2ccccc2n1CC[NH2+]Cc1ccc2c(c1)CCO2 ZINC000043288649 183351374 /nfs/dbraw/zinc/35/13/74/183351374.db2.gz LHQAKGOFMYPPAJ-UHFFFAOYSA-N 2 2 307.397 3.069 20 10 DGCDLP CCOc1cccc(C[NH2+]C[C@@H](c2ccccc2)[NH+](C)C)c1O ZINC000074334541 431414273 /nfs/dbraw/zinc/41/42/73/431414273.db2.gz CRLPXBLWUJNVAY-KRWDZBQOSA-N 2 2 314.429 3.183 20 10 DGCDLP C[C@@H]([NH2+]CCc1cn2c([nH+]1)CCCC2)c1ccc(N(C)C)cc1 ZINC000152756713 432354659 /nfs/dbraw/zinc/35/46/59/432354659.db2.gz DIGVFHRHOHOXMK-OAHLLOKOSA-N 2 2 312.461 3.179 20 10 DGCDLP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@@H](C)c2ccc(F)c(F)c2O)C1 ZINC000187701360 432677633 /nfs/dbraw/zinc/67/76/33/432677633.db2.gz UPPBXTYMJZSPLP-QWHCGFSZSA-N 2 2 312.404 3.441 20 10 DGCDLP CC(C)[N@H+]1CCC[C@H](C[NH2+][C@@H](C)c2ccc(F)c(F)c2O)C1 ZINC000187701360 432677637 /nfs/dbraw/zinc/67/76/37/432677637.db2.gz UPPBXTYMJZSPLP-QWHCGFSZSA-N 2 2 312.404 3.441 20 10 DGCDLP C[NH+](C)[C@@H]1CCC[N@H+](Cc2c(O)ccc(Cl)c2F)CC1 ZINC000373005009 433073841 /nfs/dbraw/zinc/07/38/41/433073841.db2.gz CDNOZZGPNQOBLV-LLVKDONJSA-N 2 2 300.805 3.101 20 10 DGCDLP C[NH+](C)[C@@H]1CCC[N@@H+](Cc2c(O)ccc(Cl)c2F)CC1 ZINC000373005009 433073843 /nfs/dbraw/zinc/07/38/43/433073843.db2.gz CDNOZZGPNQOBLV-LLVKDONJSA-N 2 2 300.805 3.101 20 10 DGCDLP CC[C@H]([NH2+]Cc1c[nH+]c2n1CCCC2)c1ccc(F)cc1O ZINC000375800453 433570661 /nfs/dbraw/zinc/57/06/61/433570661.db2.gz AQWCZNDXIJJFSY-HNNXBMFYSA-N 2 2 303.381 3.305 20 10 DGCDLP CC(C)[NH+]1CCC([N@H+](C)Cc2cc(Cl)c(F)cc2O)CC1 ZINC000294876837 434151770 /nfs/dbraw/zinc/15/17/70/434151770.db2.gz KPCDVFXRKKBOEC-UHFFFAOYSA-N 2 2 314.832 3.489 20 10 DGCDLP CC(C)[NH+]1CCC([N@@H+](C)Cc2cc(Cl)c(F)cc2O)CC1 ZINC000294876837 434151779 /nfs/dbraw/zinc/15/17/79/434151779.db2.gz KPCDVFXRKKBOEC-UHFFFAOYSA-N 2 2 314.832 3.489 20 10 DGCDLP C[C@@H]([NH2+]CCc1cn2c([nH+]1)CCCC2)c1cc(Cl)ccc1O ZINC000368477186 434575327 /nfs/dbraw/zinc/57/53/27/434575327.db2.gz DKOXISMRDYRODR-GFCCVEGCSA-N 2 2 319.836 3.472 20 10 DGCDLP Cc1ccc([C@@H](C)[NH2+]CCc2cn3c([nH+]2)CCCC3)c(O)c1C ZINC000368477330 434575343 /nfs/dbraw/zinc/57/53/43/434575343.db2.gz FQFKSRLZPMPEOX-OAHLLOKOSA-N 2 2 313.445 3.435 20 10 DGCDLP Oc1cccc(Cl)c1C[NH+]1CCC([NH+]2CCCCC2)CC1 ZINC000132477313 526362545 /nfs/dbraw/zinc/36/25/45/526362545.db2.gz MHXLXFBWLHPTMT-UHFFFAOYSA-N 2 2 308.853 3.496 20 10 DGCDLP C[N@H+](CCCC[NH+]1CCCCC1)Cc1cc(F)cc(F)c1O ZINC000895683881 618818441 /nfs/dbraw/zinc/81/84/41/618818441.db2.gz WTIYLZDXYXYWFB-UHFFFAOYSA-N 2 2 312.404 3.368 20 10 DGCDLP C[N@@H+](CCCC[NH+]1CCCCC1)Cc1cc(F)cc(F)c1O ZINC000895683881 618818443 /nfs/dbraw/zinc/81/84/43/618818443.db2.gz WTIYLZDXYXYWFB-UHFFFAOYSA-N 2 2 312.404 3.368 20 10 DGCDLP Cc1ccc(O)c(C[NH2+]C2CC[NH+](CCC(F)(F)F)CC2)c1 ZINC000858238939 621167210 /nfs/dbraw/zinc/16/72/10/621167210.db2.gz FIQBZJHYKNJYHD-UHFFFAOYSA-N 2 2 316.367 3.207 20 10 DGCDLP C[C@H]([NH2+]C[C@@H]1CC[N@@H+]1C1CCCC1)c1ccc(N(C)C)cc1 ZINC000858532284 621202220 /nfs/dbraw/zinc/20/22/20/621202220.db2.gz IMPHVWVDEOOLFM-KXBFYZLASA-N 2 2 301.478 3.420 20 10 DGCDLP C[C@H]([NH2+]C[C@@H]1CC[N@H+]1C1CCCC1)c1ccc(N(C)C)cc1 ZINC000858532284 621202222 /nfs/dbraw/zinc/20/22/22/621202222.db2.gz IMPHVWVDEOOLFM-KXBFYZLASA-N 2 2 301.478 3.420 20 10 DGCDLP C[C@H]1C[C@H]([NH2+]CCCCn2cc[nH+]c2)c2c1c(F)ccc2O ZINC000756458241 621639429 /nfs/dbraw/zinc/63/94/29/621639429.db2.gz KQTADRPKFDZNAU-JSGCOSHPSA-N 2 2 303.381 3.346 20 10 DGCDLP Cc1[nH+]ccn1CCCC[NH2+][C@H](C)c1cc(F)cc(F)c1O ZINC000756597475 621651846 /nfs/dbraw/zinc/65/18/46/621651846.db2.gz NKRULGXDCNIDQA-LLVKDONJSA-N 2 2 309.360 3.306 20 10 DGCDLP C[C@H]([NH2+][C@@H]1CC[C@@H](C)[NH2+]C1)c1ccc(N2CCCCC2)cc1 ZINC000863545398 621682492 /nfs/dbraw/zinc/68/24/92/621682492.db2.gz QRLUIVGEWXFPEZ-SOLBZPMBSA-N 2 2 301.478 3.468 20 10 DGCDLP CC[C@@H]([NH2+]C[C@@]1([NH+](C)C)CCSC1)c1ccc(N(C)C)cc1 ZINC000766440726 622330357 /nfs/dbraw/zinc/33/03/57/622330357.db2.gz YVBYIWHYBJKHKQ-MSOLQXFVSA-N 2 2 321.534 3.231 20 10 DGCDLP C[C@@H]([NH2+]C[C@H]1CCCC[N@@H+]1C1CC1)c1ccc(N(C)C)cc1 ZINC000774378365 623138466 /nfs/dbraw/zinc/13/84/66/623138466.db2.gz LINGGLIVGLNXNT-DNVCBOLYSA-N 2 2 301.478 3.420 20 10 DGCDLP C[C@@H]([NH2+]C[C@H]1CCCC[N@H+]1C1CC1)c1ccc(N(C)C)cc1 ZINC000774378365 623138469 /nfs/dbraw/zinc/13/84/69/623138469.db2.gz LINGGLIVGLNXNT-DNVCBOLYSA-N 2 2 301.478 3.420 20 10 DGCDLP Cc1ccc(C[NH+]2CCC(Oc3cc[nH+]cc3C)CC2)c(O)c1 ZINC000877481333 623902984 /nfs/dbraw/zinc/90/29/84/623902984.db2.gz DPGXGXNQUFFWAX-UHFFFAOYSA-N 2 2 312.413 3.447 20 10 DGCDLP CC(C)C[N@@H+]1CCC[C@H](C[NH2+]Cc2cc(F)cc(F)c2O)C1 ZINC000883073513 625917330 /nfs/dbraw/zinc/91/73/30/625917330.db2.gz SAGIVFQELOCCJN-CYBMUJFWSA-N 2 2 312.404 3.128 20 10 DGCDLP CC(C)C[N@H+]1CCC[C@H](C[NH2+]Cc2cc(F)cc(F)c2O)C1 ZINC000883073513 625917339 /nfs/dbraw/zinc/91/73/39/625917339.db2.gz SAGIVFQELOCCJN-CYBMUJFWSA-N 2 2 312.404 3.128 20 10 DGCDLP C[C@@H]([NH2+]C[C@H](C)C[NH+](C)C)c1cccc(C(F)(F)F)c1O ZINC000815627812 627693026 /nfs/dbraw/zinc/69/30/26/627693026.db2.gz KEFQACVOZNQIIL-WDEREUQCSA-N 2 2 304.356 3.259 20 10 DGCDLP CC[C@H]([NH2+]C[C@@H]1C[NH2+]CCC1(F)F)c1cccc(Cl)c1O ZINC000925779622 627793842 /nfs/dbraw/zinc/79/38/42/627793842.db2.gz YPOKQIRQSBSAOZ-GWCFXTLKSA-N 2 2 318.795 3.331 20 10 DGCDLP C[NH+](C)[C@H]1CCC[C@@H]([NH2+]Cc2cc(Cl)c(F)cc2O)C1 ZINC000816554811 627806722 /nfs/dbraw/zinc/80/67/22/627806722.db2.gz JRVSQAMWKUHYON-NEPJUHHUSA-N 2 2 300.805 3.147 20 10 DGCDLP CC[N@H+](CCC[NH+]1CCCC1)Cc1cc(Cl)c(F)cc1O ZINC000816610871 627814662 /nfs/dbraw/zinc/81/46/62/627814662.db2.gz BJFJGWJFTIDJAK-UHFFFAOYSA-N 2 2 314.832 3.493 20 10 DGCDLP CC[N@@H+](CCC[NH+]1CCCC1)Cc1cc(Cl)c(F)cc1O ZINC000816610871 627814666 /nfs/dbraw/zinc/81/46/66/627814666.db2.gz BJFJGWJFTIDJAK-UHFFFAOYSA-N 2 2 314.832 3.493 20 10 DGCDLP C[C@@H]([NH2+][C@@H]1CCC[NH2+]C1)c1ccc(N2CCCCCC2)cc1 ZINC000817940075 627967607 /nfs/dbraw/zinc/96/76/07/627967607.db2.gz DDSGCTXGUGVHHZ-SJLPKXTDSA-N 2 2 301.478 3.470 20 10 DGCDLP COc1cccc([C@H](C)[NH2+]C[C@@H]([NH3+])c2ccc(N(C)C)cc2)c1 ZINC000817939033 627967972 /nfs/dbraw/zinc/96/79/72/627967972.db2.gz XZISWMMIWWMLIE-IFXJQAMLSA-N 2 2 313.445 3.112 20 10 DGCDLP C[C@@H]([NH2+][C@@H]1CCC[NH2+]C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000817940098 627967982 /nfs/dbraw/zinc/96/79/82/627967982.db2.gz DWVDMLQDCUKJJZ-GDBMZVCRSA-N 2 2 305.441 3.219 20 10 DGCDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+][C@@H]2CCCC23CCCC3)cc1 ZINC000817943312 627969613 /nfs/dbraw/zinc/96/96/13/627969613.db2.gz UGXQBZACARFFNA-ZWKOTPCHSA-N 2 2 301.478 3.455 20 10 DGCDLP C[C@H]([NH2+]C[C@H]1CCCC[NH2+]1)c1ccc(N2CCCCC2)cc1 ZINC000817945851 627970362 /nfs/dbraw/zinc/97/03/62/627970362.db2.gz NINLLWDPKPRFBX-FUHWJXTLSA-N 2 2 301.478 3.470 20 10 DGCDLP CC(C)C[C@@H](C[NH3+])[NH2+][C@@H](C)c1cc(Br)ccc1O ZINC000817957556 627974653 /nfs/dbraw/zinc/97/46/53/627974653.db2.gz CVYPMLZFZYGNAD-JQWIXIFHSA-N 2 2 315.255 3.179 20 10 DGCDLP CCCC[C@H](C[NH3+])[NH2+][C@@H](C)c1cc(Br)ccc1O ZINC000817961679 627976026 /nfs/dbraw/zinc/97/60/26/627976026.db2.gz CGVNXSPYRLWYEF-CMPLNLGQSA-N 2 2 315.255 3.323 20 10 DGCDLP C[C@H]([NH2+][C@H]1C[NH2+]CC[C@H]1C)c1ccc(N2CCCCC2)c(F)c1 ZINC000817967210 627977939 /nfs/dbraw/zinc/97/79/39/627977939.db2.gz FOCKMFTUGGSIET-VKJFTORMSA-N 2 2 319.468 3.465 20 10 DGCDLP C[C@@H]1CC2(C[N@@H+]1Cc1cc(Cl)cc(F)c1O)CC[NH2+]CC2 ZINC000818430859 628022238 /nfs/dbraw/zinc/02/22/38/628022238.db2.gz AEXCBGJRQALTOY-LLVKDONJSA-N 2 2 312.816 3.149 20 10 DGCDLP C[C@@H]1CC2(C[N@H+]1Cc1cc(Cl)cc(F)c1O)CC[NH2+]CC2 ZINC000818430859 628022239 /nfs/dbraw/zinc/02/22/39/628022239.db2.gz AEXCBGJRQALTOY-LLVKDONJSA-N 2 2 312.816 3.149 20 10 DGCDLP Cc1cc(O)c(C[NH2+]C2CC([NH+]3CCCCC3)C2)cc1Cl ZINC000825749914 628794432 /nfs/dbraw/zinc/79/44/32/628794432.db2.gz XOMPRJFKAZLUKK-UHFFFAOYSA-N 2 2 308.853 3.461 20 10 DGCDLP Cc1cc(O)c(C[NH+]2CCC(n3cc[nH+]c3)CC2)c(Cl)c1 ZINC000840912093 630376275 /nfs/dbraw/zinc/37/62/75/630376275.db2.gz GPXQDOJHMOTKSL-UHFFFAOYSA-N 2 2 305.809 3.388 20 10 DGCDLP CC(C)c1ccc([C@H]([NH3+])C[NH2+]Cc2cc(F)ccc2O)cc1 ZINC000841034937 630399940 /nfs/dbraw/zinc/39/99/40/630399940.db2.gz FJJIGRHHHMEQMQ-QGZVFWFLSA-N 2 2 302.393 3.444 20 10 DGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+][C@@H]2CCC[C@@H](C3CC3)C2)cc1 ZINC000841045809 630401719 /nfs/dbraw/zinc/40/17/19/630401719.db2.gz QOHAQUJQWVHQDV-ZHALLVOQSA-N 2 2 301.478 3.311 20 10 DGCDLP Oc1c(F)cc(Cl)cc1C[N@@H+]1CCCC[C@H]1[C@@H]1CC[NH2+]C1 ZINC000841087478 630406090 /nfs/dbraw/zinc/40/60/90/630406090.db2.gz OGGTZBSZPCRDKU-ABAIWWIYSA-N 2 2 312.816 3.149 20 10 DGCDLP Oc1c(F)cc(Cl)cc1C[N@H+]1CCCC[C@H]1[C@@H]1CC[NH2+]C1 ZINC000841087478 630406093 /nfs/dbraw/zinc/40/60/93/630406093.db2.gz OGGTZBSZPCRDKU-ABAIWWIYSA-N 2 2 312.816 3.149 20 10 DGCDLP CC(=O)c1cc(Cl)cc(C[N@@H+](C)CC[C@H]([NH3+])C(C)C)c1O ZINC000843354401 630648832 /nfs/dbraw/zinc/64/88/32/630648832.db2.gz DUDUXYOKUIIOAE-HNNXBMFYSA-N 2 2 312.841 3.053 20 10 DGCDLP CC(=O)c1cc(Cl)cc(C[N@H+](C)CC[C@H]([NH3+])C(C)C)c1O ZINC000843354401 630648835 /nfs/dbraw/zinc/64/88/35/630648835.db2.gz DUDUXYOKUIIOAE-HNNXBMFYSA-N 2 2 312.841 3.053 20 10 DGCDLP C[C@H]([NH2+][C@@H]1CCC[N@@H+]2CCCC[C@H]12)c1ccc(N(C)C)cc1 ZINC000848568696 631696657 /nfs/dbraw/zinc/69/66/57/631696657.db2.gz OQBMUPNFLMXWMB-KFKAGJAMSA-N 2 2 301.478 3.420 20 10 DGCDLP C[C@H]([NH2+][C@@H]1CCC[N@H+]2CCCC[C@H]12)c1ccc(N(C)C)cc1 ZINC000848568696 631696662 /nfs/dbraw/zinc/69/66/62/631696662.db2.gz OQBMUPNFLMXWMB-KFKAGJAMSA-N 2 2 301.478 3.420 20 10 DGCDLP COc1cccc([C@H](C)[NH2+][C@@H]2CCC[N@@H+]3CCCC[C@@H]23)c1O ZINC000848568260 631696998 /nfs/dbraw/zinc/69/69/98/631696998.db2.gz CFTVSVIUGPYGNU-IMJJTQAJSA-N 2 2 304.434 3.068 20 10 DGCDLP COc1cccc([C@H](C)[NH2+][C@@H]2CCC[N@H+]3CCCC[C@@H]23)c1O ZINC000848568260 631697001 /nfs/dbraw/zinc/69/70/01/631697001.db2.gz CFTVSVIUGPYGNU-IMJJTQAJSA-N 2 2 304.434 3.068 20 10 DGCDLP CN(C)c1ccc(/C=C\C[NH2+]C[C@H]2CC[N@@H+]2C(C)(C)C)cc1 ZINC000850341802 632118321 /nfs/dbraw/zinc/11/83/21/632118321.db2.gz ATBVTELVDHCNJW-HPFMTEOYSA-N 2 2 301.478 3.228 20 10 DGCDLP CN(C)c1ccc(/C=C\C[NH2+]C[C@H]2CC[N@H+]2C(C)(C)C)cc1 ZINC000850341802 632118325 /nfs/dbraw/zinc/11/83/25/632118325.db2.gz ATBVTELVDHCNJW-HPFMTEOYSA-N 2 2 301.478 3.228 20 10 DGCDLP CN(C)c1ccc(/C=C/C[NH2+]C[C@@H]2CCCC[N@@H+]2C2CC2)cc1 ZINC001474137483 1183873351 /nfs/dbraw/zinc/87/33/51/1183873351.db2.gz FRXQDLGPWIGAFP-XJDXJNMNSA-N 2 2 313.489 3.372 20 10 DGCDLP CN(C)c1ccc(/C=C/C[NH2+]C[C@@H]2CCCC[N@H+]2C2CC2)cc1 ZINC001474137483 1183873355 /nfs/dbraw/zinc/87/33/55/1183873355.db2.gz FRXQDLGPWIGAFP-XJDXJNMNSA-N 2 2 313.489 3.372 20 10 DGCDLP CCN(CC)c1ccc(C[NH2+][C@@H]2CC[N@@H+]3CCCC[C@H]23)cc1F ZINC001560271560 1189303232 /nfs/dbraw/zinc/30/32/32/1189303232.db2.gz PKEYFUQBOMKIAV-IEBWSBKVSA-N 2 2 319.468 3.388 20 10 DGCDLP CCN(CC)c1ccc(C[NH2+][C@@H]2CC[N@H+]3CCCC[C@H]23)cc1F ZINC001560271560 1189303237 /nfs/dbraw/zinc/30/32/37/1189303237.db2.gz PKEYFUQBOMKIAV-IEBWSBKVSA-N 2 2 319.468 3.388 20 10 DGCDLP CC(C)[N@@H+]1CCC[C@H](C[NH2+]Cc2cc(Cl)cc(F)c2O)C1 ZINC001661351177 1196596952 /nfs/dbraw/zinc/59/69/52/1196596952.db2.gz MSRRZMNSRJXQLR-GFCCVEGCSA-N 2 2 314.832 3.395 20 10 DGCDLP CC(C)[N@H+]1CCC[C@H](C[NH2+]Cc2cc(Cl)cc(F)c2O)C1 ZINC001661351177 1196596955 /nfs/dbraw/zinc/59/69/55/1196596955.db2.gz MSRRZMNSRJXQLR-GFCCVEGCSA-N 2 2 314.832 3.395 20 10 DGCDLP CCC1([NH+]2CCC2)CC[NH+](Cc2ccc(Cl)cc2O)CC1 ZINC001207582052 1084082839 /nfs/dbraw/zinc/08/28/39/1084082839.db2.gz TVPXSVVKSDANEA-UHFFFAOYSA-N 2 2 308.853 3.496 20 10 DGCDLP Nc1ccc(N2CCCC3=C[C@H]4C[C@H](C[N@@H+]5CCCC[C@H]45)[C@@H]32)[nH+]c1 ZINC001155629281 1089193174 /nfs/dbraw/zinc/19/31/74/1089193174.db2.gz GTYKMSMXOIUPGS-IXIUHKBRSA-N 2 2 324.472 3.063 20 10 DGCDLP Nc1ccc(N2CCCC3=C[C@H]4C[C@H](C[N@H+]5CCCC[C@H]45)[C@@H]32)[nH+]c1 ZINC001155629281 1089193184 /nfs/dbraw/zinc/19/31/84/1089193184.db2.gz GTYKMSMXOIUPGS-IXIUHKBRSA-N 2 2 324.472 3.063 20 10 DGCDLP COc1ccc(O)c(C[N@H+](C2CCCC2)C2CC[NH+](C)CC2)c1 ZINC001203684328 1090779790 /nfs/dbraw/zinc/77/97/90/1090779790.db2.gz RTMNSLMORGLUIR-UHFFFAOYSA-N 2 2 318.461 3.240 20 10 DGCDLP CC[N@H+](C)C1CC[NH+](Cc2ccc(N3CCCC3)cc2)CC1 ZINC001204329591 1090950880 /nfs/dbraw/zinc/95/08/80/1090950880.db2.gz REARUYFCLROFDE-UHFFFAOYSA-N 2 2 301.478 3.203 20 10 DGCDLP CC[N@@H+](C)C1CC[NH+](Cc2ccc(N3CCCC3)cc2)CC1 ZINC001204329591 1090950887 /nfs/dbraw/zinc/95/08/87/1090950887.db2.gz REARUYFCLROFDE-UHFFFAOYSA-N 2 2 301.478 3.203 20 10 DGCDLP CCN(CC)c1ccc(C[N@H+](CC)CCC[NH+](C)C)c(OC)c1 ZINC001138392471 1091165526 /nfs/dbraw/zinc/16/55/26/1091165526.db2.gz WYALNUWOZKGXHD-UHFFFAOYSA-N 2 2 321.509 3.315 20 10 DGCDLP CCN(CC)c1ccc(C[N@@H+](CC)CCC[NH+](C)C)c(OC)c1 ZINC001138392471 1091165535 /nfs/dbraw/zinc/16/55/35/1091165535.db2.gz WYALNUWOZKGXHD-UHFFFAOYSA-N 2 2 321.509 3.315 20 10 DGCDLP COc1ccc2ccc(O)c(C[N@@H+]3C[C@H](C)CC[C@@H]3C[NH3+])c2c1 ZINC001205842024 1091376666 /nfs/dbraw/zinc/37/66/66/1091376666.db2.gz MCDSCPSZOVBWGZ-UKRRQHHQSA-N 2 2 314.429 3.113 20 10 DGCDLP COc1ccc2ccc(O)c(C[N@H+]3C[C@H](C)CC[C@@H]3C[NH3+])c2c1 ZINC001205842024 1091376673 /nfs/dbraw/zinc/37/66/73/1091376673.db2.gz MCDSCPSZOVBWGZ-UKRRQHHQSA-N 2 2 314.429 3.113 20 10 DGCDLP Cc1cc(O)c(C[N@@H+]2CCCC[C@@](F)(C[NH3+])C2)cc1Cl ZINC001206363661 1091600711 /nfs/dbraw/zinc/60/07/11/1091600711.db2.gz ZLEKFTLPFUAQSV-OAHLLOKOSA-N 2 2 300.805 3.007 20 10 DGCDLP Cc1cc(O)c(C[N@H+]2CCCC[C@@](F)(C[NH3+])C2)cc1Cl ZINC001206363661 1091600718 /nfs/dbraw/zinc/60/07/18/1091600718.db2.gz ZLEKFTLPFUAQSV-OAHLLOKOSA-N 2 2 300.805 3.007 20 10 DGCDLP C[C@@]1(C[NH3+])CCCC[N@H+](Cc2cc(F)c(Cl)cc2O)C1 ZINC001206575861 1091675282 /nfs/dbraw/zinc/67/52/82/1091675282.db2.gz ZYEKFXFENNYDSN-HNNXBMFYSA-N 2 2 300.805 3.136 20 10 DGCDLP C[C@@]1(C[NH3+])CCCC[N@@H+](Cc2cc(F)c(Cl)cc2O)C1 ZINC001206575861 1091675287 /nfs/dbraw/zinc/67/52/87/1091675287.db2.gz ZYEKFXFENNYDSN-HNNXBMFYSA-N 2 2 300.805 3.136 20 10 DGCDLP C[NH2+][C@@]12CC[C@@]([NH2+]Cc3ccc(OC)c(Cl)c3O)(C1)CCC2 ZINC001276806198 1094993046 /nfs/dbraw/zinc/99/30/46/1094993046.db2.gz LCKHMZOWJZSTAQ-DLBZAZTESA-N 2 2 324.852 3.209 20 10 DGCDLP Oc1cc(Cl)c(Cl)cc1C[N@@H+]1CC[C@]2(C1)CCC[NH2+]C2 ZINC001222154418 1095461621 /nfs/dbraw/zinc/46/16/21/1095461621.db2.gz LGDHGEYSGUPMTD-OAHLLOKOSA-N 2 2 315.244 3.275 20 10 DGCDLP Oc1cc(Cl)c(Cl)cc1C[N@H+]1CC[C@]2(C1)CCC[NH2+]C2 ZINC001222154418 1095461624 /nfs/dbraw/zinc/46/16/24/1095461624.db2.gz LGDHGEYSGUPMTD-OAHLLOKOSA-N 2 2 315.244 3.275 20 10 DGCDLP CC(C)(C)c1ccc(C[N@@H+]2CC[C@]3(C2)CCCC[NH2+]3)c(O)c1 ZINC001222436781 1095613953 /nfs/dbraw/zinc/61/39/53/1095613953.db2.gz ZZZJOTPMIWFOET-IBGZPJMESA-N 2 2 302.462 3.408 20 10 DGCDLP CC(C)(C)c1ccc(C[N@H+]2CC[C@]3(C2)CCCC[NH2+]3)c(O)c1 ZINC001222436781 1095613962 /nfs/dbraw/zinc/61/39/62/1095613962.db2.gz ZZZJOTPMIWFOET-IBGZPJMESA-N 2 2 302.462 3.408 20 10 DGCDLP Oc1cc(C(F)(F)F)ccc1C[N@@H+]1CC[C@@]2(C1)CCCC[NH2+]2 ZINC001222436780 1095614884 /nfs/dbraw/zinc/61/48/84/1095614884.db2.gz ZZQKFXXLXWDDTJ-OAHLLOKOSA-N 2 2 314.351 3.129 20 10 DGCDLP Oc1cc(C(F)(F)F)ccc1C[N@H+]1CC[C@@]2(C1)CCCC[NH2+]2 ZINC001222436780 1095614888 /nfs/dbraw/zinc/61/48/88/1095614888.db2.gz ZZQKFXXLXWDDTJ-OAHLLOKOSA-N 2 2 314.351 3.129 20 10 DGCDLP Oc1c(Cl)cccc1C[NH+]1CCC(C2CC[NH2+]CC2)CC1 ZINC001235706695 1099137584 /nfs/dbraw/zinc/13/75/84/1099137584.db2.gz VTZIXWLFWBEXNI-UHFFFAOYSA-N 2 2 308.853 3.257 20 10 DGCDLP C[N@H+](Cc1cc(Cl)c(Cl)cc1O)[C@H]1CCCC[C@@H]1[NH3+] ZINC001236215024 1099471258 /nfs/dbraw/zinc/47/12/58/1099471258.db2.gz GZMPWERFYQSJSR-STQMWFEESA-N 2 2 303.233 3.401 20 10 DGCDLP C[N@@H+](Cc1cc(Cl)c(Cl)cc1O)[C@H]1CCCC[C@@H]1[NH3+] ZINC001236215024 1099471267 /nfs/dbraw/zinc/47/12/67/1099471267.db2.gz GZMPWERFYQSJSR-STQMWFEESA-N 2 2 303.233 3.401 20 10 DGCDLP CCN(CC)c1ccc(C[N@H+](C2CC2)[C@H]2CCC[NH2+]C2)cc1 ZINC001236238085 1099491912 /nfs/dbraw/zinc/49/19/12/1099491912.db2.gz YUZGXVIKFGOAGQ-IBGZPJMESA-N 2 2 301.478 3.249 20 10 DGCDLP CCN(CC)c1ccc(C[N@@H+](C2CC2)[C@H]2CCC[NH2+]C2)cc1 ZINC001236238085 1099491917 /nfs/dbraw/zinc/49/19/17/1099491917.db2.gz YUZGXVIKFGOAGQ-IBGZPJMESA-N 2 2 301.478 3.249 20 10 DGCDLP Oc1cc(Cl)c(F)cc1C[N@H+](C[C@H]1CCC[NH2+]C1)C1CC1 ZINC001236600761 1099697672 /nfs/dbraw/zinc/69/76/72/1099697672.db2.gz JBHMHZDZNAHLED-NSHDSACASA-N 2 2 312.816 3.149 20 10 DGCDLP Oc1cc(Cl)c(F)cc1C[N@@H+](C[C@H]1CCC[NH2+]C1)C1CC1 ZINC001236600761 1099697673 /nfs/dbraw/zinc/69/76/73/1099697673.db2.gz JBHMHZDZNAHLED-NSHDSACASA-N 2 2 312.816 3.149 20 10 DGCDLP C[C@H]1CC[N@H+](Cc2c(O)ccc(Cl)c2F)C[C@@H]1n1cc[nH+]c1 ZINC000191442923 432265556 /nfs/dbraw/zinc/26/55/56/432265556.db2.gz SJPKRNAHUGEQES-FZMZJTMJSA-N 2 2 323.799 3.464 20 10 DGCDLP C[C@H]1CC[N@@H+](Cc2c(O)ccc(Cl)c2F)C[C@@H]1n1cc[nH+]c1 ZINC000191442923 432265560 /nfs/dbraw/zinc/26/55/60/432265560.db2.gz SJPKRNAHUGEQES-FZMZJTMJSA-N 2 2 323.799 3.464 20 10 DGCDLP C[NH+](CCC[N@@H+](C)Cc1ccco1)Cc1cc(F)ccc1O ZINC000289913103 432979304 /nfs/dbraw/zinc/97/93/04/432979304.db2.gz VEEBBYIVNSYFTB-UHFFFAOYSA-N 2 2 306.381 3.078 20 10 DGCDLP C[NH+](CCC[N@H+](C)Cc1ccco1)Cc1cc(F)ccc1O ZINC000289913103 432979308 /nfs/dbraw/zinc/97/93/08/432979308.db2.gz VEEBBYIVNSYFTB-UHFFFAOYSA-N 2 2 306.381 3.078 20 10 DGCDLP C[NH+](CCC[N@H+](C)Cc1cc(F)ccc1O)Cc1ccco1 ZINC000289913103 432979310 /nfs/dbraw/zinc/97/93/10/432979310.db2.gz VEEBBYIVNSYFTB-UHFFFAOYSA-N 2 2 306.381 3.078 20 10 DGCDLP C[NH+](CCC[N@@H+](C)Cc1cc(F)ccc1O)Cc1ccco1 ZINC000289913103 432979314 /nfs/dbraw/zinc/97/93/14/432979314.db2.gz VEEBBYIVNSYFTB-UHFFFAOYSA-N 2 2 306.381 3.078 20 10 DGCDLP Cc1c[nH+]ccc1OC1CC[NH+](Cc2cc(F)ccc2O)CC1 ZINC000373236325 433136915 /nfs/dbraw/zinc/13/69/15/433136915.db2.gz HOLJGWWBKLBASR-UHFFFAOYSA-N 2 2 316.376 3.278 20 10 DGCDLP C[NH+]1CCC2(CCC[N@H+](Cc3cccc(Cl)c3O)C2)CC1 ZINC000375998236 433638497 /nfs/dbraw/zinc/63/84/97/433638497.db2.gz FSGWSRIYDHVWIZ-UHFFFAOYSA-N 2 2 308.853 3.353 20 10 DGCDLP C[NH+]1CCC2(CCC[N@@H+](Cc3cccc(Cl)c3O)C2)CC1 ZINC000375998236 433638505 /nfs/dbraw/zinc/63/85/05/433638505.db2.gz FSGWSRIYDHVWIZ-UHFFFAOYSA-N 2 2 308.853 3.353 20 10 DGCDLP C[C@H]1CC[N@H+](Cc2cc(Cl)c(F)cc2O)C[C@@H]1n1cc[nH+]c1 ZINC000294434610 434112115 /nfs/dbraw/zinc/11/21/15/434112115.db2.gz XNEGPKNLIXEQKY-NHYWBVRUSA-N 2 2 323.799 3.464 20 10 DGCDLP C[C@H]1CC[N@@H+](Cc2cc(Cl)c(F)cc2O)C[C@@H]1n1cc[nH+]c1 ZINC000294434610 434112124 /nfs/dbraw/zinc/11/21/24/434112124.db2.gz XNEGPKNLIXEQKY-NHYWBVRUSA-N 2 2 323.799 3.464 20 10 DGCDLP C[NH+](C)[C@@H]1CCC[N@H+](Cc2cc(Cl)c(F)cc2O)CC1 ZINC000294754299 434135045 /nfs/dbraw/zinc/13/50/45/434135045.db2.gz RPSANJLLEVVYJZ-GFCCVEGCSA-N 2 2 300.805 3.101 20 10 DGCDLP C[NH+](C)[C@@H]1CCC[N@@H+](Cc2cc(Cl)c(F)cc2O)CC1 ZINC000294754299 434135048 /nfs/dbraw/zinc/13/50/48/434135048.db2.gz RPSANJLLEVVYJZ-GFCCVEGCSA-N 2 2 300.805 3.101 20 10 DGCDLP Cn1cc[nH+]c1[C@@H]1CCC[N@H+](Cc2cccc(Cl)c2O)C1 ZINC000365821337 434310208 /nfs/dbraw/zinc/31/02/08/434310208.db2.gz PYOZXPUFEBSEFA-CYBMUJFWSA-N 2 2 305.809 3.159 20 10 DGCDLP Cn1cc[nH+]c1[C@@H]1CCC[N@@H+](Cc2cccc(Cl)c2O)C1 ZINC000365821337 434310218 /nfs/dbraw/zinc/31/02/18/434310218.db2.gz PYOZXPUFEBSEFA-CYBMUJFWSA-N 2 2 305.809 3.159 20 10 DGCDLP Oc1cc(F)c(Cl)cc1C[N@@H+]1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000295436027 434360129 /nfs/dbraw/zinc/36/01/29/434360129.db2.gz UDWAKAXUSWELQK-LBPRGKRZSA-N 2 2 312.816 3.102 20 10 DGCDLP Oc1cc(F)c(Cl)cc1C[N@H+]1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000295436027 434360140 /nfs/dbraw/zinc/36/01/40/434360140.db2.gz UDWAKAXUSWELQK-LBPRGKRZSA-N 2 2 312.816 3.102 20 10 DGCDLP CC[NH+]1CCC(CC[NH2+][C@@H](C)c2ccc(F)c(F)c2O)CC1 ZINC000187736112 333236979 /nfs/dbraw/zinc/23/69/79/333236979.db2.gz DEFHWJSQGGBNAS-LBPRGKRZSA-N 2 2 312.404 3.443 20 10 DGCDLP COc1ccc(O)c([C@@H](C)[NH2+]CC[N@H+](C)Cc2ccccc2)c1 ZINC000185111452 534202744 /nfs/dbraw/zinc/20/27/44/534202744.db2.gz FVDSHGSTAWKKTH-OAHLLOKOSA-N 2 2 314.429 3.183 20 10 DGCDLP COc1ccc(O)c([C@@H](C)[NH2+]CC[N@@H+](C)Cc2ccccc2)c1 ZINC000185111452 534202745 /nfs/dbraw/zinc/20/27/45/534202745.db2.gz FVDSHGSTAWKKTH-OAHLLOKOSA-N 2 2 314.429 3.183 20 10 DGCDLP Cc1ccc(O)c([C@@H](C)[NH2+][C@@H]2C[NH2+]CC[C@@H]2c2ccccc2)c1 ZINC000854223753 620785978 /nfs/dbraw/zinc/78/59/78/620785978.db2.gz VMWWGEYSUCXEEK-SZVBFZGTSA-N 2 2 310.441 3.497 20 10 DGCDLP CCCN(CCC)c1ccc(C[NH2+]C[C@H]2CCC[N@@H+]2C)cc1 ZINC000920415049 620799649 /nfs/dbraw/zinc/79/96/49/620799649.db2.gz DDFNRYFZRZEDIR-LJQANCHMSA-N 2 2 303.494 3.497 20 10 DGCDLP CCCN(CCC)c1ccc(C[NH2+]C[C@H]2CCC[N@H+]2C)cc1 ZINC000920415049 620799651 /nfs/dbraw/zinc/79/96/51/620799651.db2.gz DDFNRYFZRZEDIR-LJQANCHMSA-N 2 2 303.494 3.497 20 10 DGCDLP [NH3+][C@H]1CC[C@H](N(Cc2cc(F)ccc2O)c2cccc[nH+]2)CC1 ZINC000895110254 618538965 /nfs/dbraw/zinc/53/89/65/618538965.db2.gz FZGBPDICEDBDLU-WKILWMFISA-N 2 2 315.392 3.203 20 10 DGCDLP CCC1([NH+]2CCC2)CC[NH+](Cc2c(O)cccc2Cl)CC1 ZINC000895827906 618834322 /nfs/dbraw/zinc/83/43/22/618834322.db2.gz OQNQHQNEUYJHGT-UHFFFAOYSA-N 2 2 308.853 3.496 20 10 DGCDLP CCO[C@@H](C[NH2+][C@H](CC)c1cc(Cl)ccc1O)C[NH+](C)C ZINC000926959538 619252487 /nfs/dbraw/zinc/25/24/87/619252487.db2.gz JRQQXARSCDCGCF-DZGCQCFKSA-N 2 2 314.857 3.053 20 10 DGCDLP CCO[C@@H](C[NH2+][C@@H](CC)c1cc(Cl)ccc1O)C[NH+](C)C ZINC000926959559 619252585 /nfs/dbraw/zinc/25/25/85/619252585.db2.gz JRQQXARSCDCGCF-ZFWWWQNUSA-N 2 2 314.857 3.053 20 10 DGCDLP C[C@H]1C[C@@H]([NH2+][C@@H]2Cc3ccccc3[C@H]2[NH3+])c2c1c(F)ccc2O ZINC000902437012 619635915 /nfs/dbraw/zinc/63/59/15/619635915.db2.gz GHLKTPQPWANSFV-MIBCPZNCSA-N 2 2 312.388 3.294 20 10 DGCDLP CC[C@@H]([NH2+][C@@H]1C[C@@H]2CC[C@H]1[NH2+]2)c1ccc(C(F)(F)F)cc1O ZINC000902468995 619641882 /nfs/dbraw/zinc/64/18/82/619641882.db2.gz NJAWUNYXBFZARU-IGHBBLSQSA-N 2 2 314.351 3.345 20 10 DGCDLP C[C@@H]([NH2+][C@H](CC[NH+](C)C)c1cccnc1)c1cc(F)ccc1O ZINC000903381870 619769195 /nfs/dbraw/zinc/76/91/95/619769195.db2.gz ZJUPOCXANYVBII-CXAGYDPISA-N 2 2 317.408 3.270 20 10 DGCDLP c1cn(-c2ccccc2C[NH2+]Cc2ccc3c(c2)CCCO3)c[nH+]1 ZINC000921591554 620911452 /nfs/dbraw/zinc/91/14/52/620911452.db2.gz WIZPTHMHRMDZSF-UHFFFAOYSA-N 2 2 319.408 3.487 20 10 DGCDLP C[NH2+]c1ccc(NCc2ccc(N3CC[NH+](C)CC3)cc2)cc1 ZINC000863482226 621677412 /nfs/dbraw/zinc/67/74/12/621677412.db2.gz WOERILPGHIOPRZ-UHFFFAOYSA-N 2 2 310.445 3.092 20 10 DGCDLP [NH3+]C[C@@H]1C[N@H+](Cc2c(O)cccc2Cl)CC[C@H]1C(F)(F)F ZINC000863646293 621693220 /nfs/dbraw/zinc/69/32/20/621693220.db2.gz ISGYFGSFMYOJON-MWLCHTKSSA-N 2 2 322.758 3.005 20 10 DGCDLP [NH3+]C[C@@H]1C[N@@H+](Cc2c(O)cccc2Cl)CC[C@H]1C(F)(F)F ZINC000863646293 621693222 /nfs/dbraw/zinc/69/32/22/621693222.db2.gz ISGYFGSFMYOJON-MWLCHTKSSA-N 2 2 322.758 3.005 20 10 DGCDLP CCN(C)c1ccc([C@@H](C)[NH2+]CCCCn2cc[nH+]c2)cc1 ZINC000765257084 622254389 /nfs/dbraw/zinc/25/43/89/622254389.db2.gz HZBILNKMZOLRJJ-MRXNPFEDSA-N 2 2 300.450 3.470 20 10 DGCDLP CC1(C)C[NH2+]CC[C@@H]([NH2+]Cc2cc(Cl)cc(F)c2O)C1 ZINC000872252090 622867771 /nfs/dbraw/zinc/86/77/71/622867771.db2.gz OWQVUZCCGPFDHS-GFCCVEGCSA-N 2 2 300.805 3.053 20 10 DGCDLP Cc1cccc(O)c1C[NH+]1CCC(Oc2cc[nH+]cc2C)CC1 ZINC000877481685 623902943 /nfs/dbraw/zinc/90/29/43/623902943.db2.gz POMDETJIUSQIMJ-UHFFFAOYSA-N 2 2 312.413 3.447 20 10 DGCDLP CC[N@@H+]1CCC[C@H](C[NH2+]Cc2c(O)ccc(Cl)c2F)C1 ZINC000790961958 625723764 /nfs/dbraw/zinc/72/37/64/625723764.db2.gz FTCQARUBTIVHIR-LLVKDONJSA-N 2 2 300.805 3.006 20 10 DGCDLP CC[N@H+]1CCC[C@H](C[NH2+]Cc2c(O)ccc(Cl)c2F)C1 ZINC000790961958 625723772 /nfs/dbraw/zinc/72/37/72/625723772.db2.gz FTCQARUBTIVHIR-LLVKDONJSA-N 2 2 300.805 3.006 20 10 DGCDLP CC1CC[NH+](CCCC[NH2+]Cc2cc(F)cc(F)c2O)CC1 ZINC000882893273 625848462 /nfs/dbraw/zinc/84/84/62/625848462.db2.gz POJOCRXLURKQPB-UHFFFAOYSA-N 2 2 312.404 3.272 20 10 DGCDLP Cc1cc(Cl)cc([C@@H](C)[NH2+][C@@H]2CCn3cc[nH+]c3C2)c1O ZINC000808715531 626853351 /nfs/dbraw/zinc/85/33/51/626853351.db2.gz VLILYIHOQWRABP-DGCLKSJQSA-N 2 2 305.809 3.216 20 10 DGCDLP CC[N@@H+]1CC[C@H]2CC[C@@H](C1)[NH+]2Cc1ccc(N(C)C)c(C)c1 ZINC000815059836 627620614 /nfs/dbraw/zinc/62/06/14/627620614.db2.gz IBFDPUULYYSQCG-MSOLQXFVSA-N 2 2 301.478 3.120 20 10 DGCDLP CC[N@H+]1CC[C@H]2CC[C@@H](C1)[NH+]2Cc1ccc(N(C)C)c(C)c1 ZINC000815059836 627620617 /nfs/dbraw/zinc/62/06/17/627620617.db2.gz IBFDPUULYYSQCG-MSOLQXFVSA-N 2 2 301.478 3.120 20 10 DGCDLP CC[NH+]1CC[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccc(N(C)C)c(C)c1 ZINC000815059836 627620619 /nfs/dbraw/zinc/62/06/19/627620619.db2.gz IBFDPUULYYSQCG-MSOLQXFVSA-N 2 2 301.478 3.120 20 10 DGCDLP CC[NH+]1CC[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccc(N(C)C)c(C)c1 ZINC000815059836 627620621 /nfs/dbraw/zinc/62/06/21/627620621.db2.gz IBFDPUULYYSQCG-MSOLQXFVSA-N 2 2 301.478 3.120 20 10 DGCDLP C[C@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)c1cccc(C(F)(F)F)c1O ZINC000815578310 627686783 /nfs/dbraw/zinc/68/67/83/627686783.db2.gz LWGFLJHDTZDPHS-NWDGAFQWSA-N 2 2 316.367 3.403 20 10 DGCDLP C[C@H]([NH2+]C[C@H]1CCC[N@@H+](C)C1)c1cccc(C(F)(F)F)c1O ZINC000815578310 627686786 /nfs/dbraw/zinc/68/67/86/627686786.db2.gz LWGFLJHDTZDPHS-NWDGAFQWSA-N 2 2 316.367 3.403 20 10 DGCDLP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)c1cccc(C(F)(F)F)c1O ZINC000815578311 627686870 /nfs/dbraw/zinc/68/68/70/627686870.db2.gz LWGFLJHDTZDPHS-RYUDHWBXSA-N 2 2 316.367 3.403 20 10 DGCDLP C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](C)C1)c1cccc(C(F)(F)F)c1O ZINC000815578311 627686873 /nfs/dbraw/zinc/68/68/73/627686873.db2.gz LWGFLJHDTZDPHS-RYUDHWBXSA-N 2 2 316.367 3.403 20 10 DGCDLP CC[N@@H+]1CC[C@H]([NH+](C)Cc2cc(Cl)c(F)cc2O)C[C@H]1C ZINC000816515147 627800793 /nfs/dbraw/zinc/80/07/93/627800793.db2.gz QTDQMNAASIYZEI-YPMHNXCESA-N 2 2 314.832 3.489 20 10 DGCDLP CC[N@H+]1CC[C@H]([NH+](C)Cc2cc(Cl)c(F)cc2O)C[C@H]1C ZINC000816515147 627800794 /nfs/dbraw/zinc/80/07/94/627800794.db2.gz QTDQMNAASIYZEI-YPMHNXCESA-N 2 2 314.832 3.489 20 10 DGCDLP CC[NH+]1CC[C@H]([N@H+](C)Cc2cc(Cl)c(F)cc2O)C[C@H]1C ZINC000816515147 627800795 /nfs/dbraw/zinc/80/07/95/627800795.db2.gz QTDQMNAASIYZEI-YPMHNXCESA-N 2 2 314.832 3.489 20 10 DGCDLP CC[NH+]1CC[C@H]([N@@H+](C)Cc2cc(Cl)c(F)cc2O)C[C@H]1C ZINC000816515147 627800797 /nfs/dbraw/zinc/80/07/97/627800797.db2.gz QTDQMNAASIYZEI-YPMHNXCESA-N 2 2 314.832 3.489 20 10 DGCDLP CCC[NH+]1CCC(C[NH2+]Cc2cc(Cl)c(F)cc2O)CC1 ZINC000816548957 627806136 /nfs/dbraw/zinc/80/61/36/627806136.db2.gz YIRROYRXGIOCBM-UHFFFAOYSA-N 2 2 314.832 3.396 20 10 DGCDLP C[NH+]1CC[C@@H]2[C@@H](CCC[N@@H+]2Cc2cc(Cl)c(F)cc2O)C1 ZINC000816611921 627814396 /nfs/dbraw/zinc/81/43/96/627814396.db2.gz AJFHRZIIZQOHTK-XHDPSFHLSA-N 2 2 312.816 3.101 20 10 DGCDLP C[NH+]1CC[C@@H]2[C@@H](CCC[N@H+]2Cc2cc(Cl)c(F)cc2O)C1 ZINC000816611921 627814399 /nfs/dbraw/zinc/81/43/99/627814399.db2.gz AJFHRZIIZQOHTK-XHDPSFHLSA-N 2 2 312.816 3.101 20 10 DGCDLP Cc1ccc2c(c1)[C@@H]([NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1)CC2 ZINC000817938029 627966715 /nfs/dbraw/zinc/96/67/15/627966715.db2.gz BRQWZFFBYHFRBP-UXHICEINSA-N 2 2 309.457 3.338 20 10 DGCDLP Cc1ccc2c(c1)[C@H]([NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1)CC2 ZINC000817938031 627966842 /nfs/dbraw/zinc/96/68/42/627966842.db2.gz BRQWZFFBYHFRBP-WOJBJXKFSA-N 2 2 309.457 3.338 20 10 DGCDLP C[C@@H]([NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1)c1ccc(F)cc1 ZINC000817939097 627967470 /nfs/dbraw/zinc/96/74/70/627967470.db2.gz YVTNBBNCUWOFDW-FZKQIMNGSA-N 2 2 301.409 3.242 20 10 DGCDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+][C@@H]2CCc3c2cccc3F)cc1 ZINC000817938974 627967647 /nfs/dbraw/zinc/96/76/47/627967647.db2.gz WQVJFQPUHLHANZ-RBUKOAKNSA-N 2 2 313.420 3.169 20 10 DGCDLP Oc1ccccc1[C@@H](CCc1ccccc1)[NH2+][C@@H]1CCC[NH2+]C1 ZINC000817942105 627968988 /nfs/dbraw/zinc/96/89/88/627968988.db2.gz WTVRFSKNTMIUPH-IEBWSBKVSA-N 2 2 310.441 3.408 20 10 DGCDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+][C@H]2CCCNc3ccccc32)cc1 ZINC000817944336 627969371 /nfs/dbraw/zinc/96/93/71/627969371.db2.gz ZIAJYPZQWCDBEU-ICSRJNTNSA-N 2 2 324.472 3.289 20 10 DGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+][C@H](c2cccnc2)C2CCC2)cc1 ZINC000817943261 627969424 /nfs/dbraw/zinc/96/94/24/627969424.db2.gz SXJZCELRPOIATI-UXHICEINSA-N 2 2 324.472 3.278 20 10 DGCDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+][C@@H](c2ccccc2)C2CC2)cc1 ZINC000817942604 627970007 /nfs/dbraw/zinc/97/00/07/627970007.db2.gz PWBBQWVDUSEMOG-PMACEKPBSA-N 2 2 309.457 3.493 20 10 DGCDLP CC(C)[C@@H]([NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1)c1cccnc1 ZINC000817944145 627970088 /nfs/dbraw/zinc/97/00/88/627970088.db2.gz XOZWQGRAHZERDQ-RBUKOAKNSA-N 2 2 312.461 3.134 20 10 DGCDLP C[C@H]([NH2+]CC[NH2+]C1CC1)c1ccc(N2CCCCCC2)cc1 ZINC000817953582 627973099 /nfs/dbraw/zinc/97/30/99/627973099.db2.gz OPTZAKZKTDMQBR-INIZCTEOSA-N 2 2 301.478 3.470 20 10 DGCDLP C[C@H]([NH2+][C@@H]1C[NH2+]CC[C@H]1C)c1ccc(N2CCCCC2)c(F)c1 ZINC000817967209 627977470 /nfs/dbraw/zinc/97/74/70/627977470.db2.gz FOCKMFTUGGSIET-RVKKMQEKSA-N 2 2 319.468 3.465 20 10 DGCDLP CC[NH2+][C@H](C)C[NH2+][C@@H](CC)c1cc(Br)ccc1O ZINC000817972014 627979691 /nfs/dbraw/zinc/97/96/91/627979691.db2.gz JFTCEYRVLNORGP-MFKMUULPSA-N 2 2 315.255 3.193 20 10 DGCDLP C[C@H]([NH2+][C@@H]1CC[NH2+][C@H](C)C1)c1cc(Cl)c(Cl)cc1O ZINC000817971804 627980231 /nfs/dbraw/zinc/98/02/31/627980231.db2.gz QDQJFYTXGFMRHY-KXUCPTDWSA-N 2 2 303.233 3.490 20 10 DGCDLP C[C@@H]([NH2+][C@@H](C)CCC[NH3+])c1cc(Br)cc(F)c1O ZINC000817977955 627981944 /nfs/dbraw/zinc/98/19/44/627981944.db2.gz RZECQHZIVXWATG-DTWKUNHWSA-N 2 2 319.218 3.072 20 10 DGCDLP C[C@H]([NH2+][C@@H]1CCCC[NH2+]C1)c1ccc(N2CCCCC2)cc1 ZINC000817983509 627983084 /nfs/dbraw/zinc/98/30/84/627983084.db2.gz FPJVKDWWVBFBLY-FUHWJXTLSA-N 2 2 301.478 3.470 20 10 DGCDLP CN(C)c1ccc(/C=C/C[N@@H+]2CCC[C@@H](c3[nH]cc[nH+]3)C2)cc1 ZINC000835025807 629828150 /nfs/dbraw/zinc/82/81/50/629828150.db2.gz NPLVQYMPIUPLEF-NJELEJDNSA-N 2 2 310.445 3.369 20 10 DGCDLP CN(C)c1ccc(/C=C/C[N@H+]2CCC[C@@H](c3[nH]cc[nH+]3)C2)cc1 ZINC000835025807 629828154 /nfs/dbraw/zinc/82/81/54/629828154.db2.gz NPLVQYMPIUPLEF-NJELEJDNSA-N 2 2 310.445 3.369 20 10 DGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+][C@H]2CCC[C@@H](C3CC3)C2)cc1 ZINC000841045810 630401758 /nfs/dbraw/zinc/40/17/58/630401758.db2.gz QOHAQUJQWVHQDV-ZIFCJYIRSA-N 2 2 301.478 3.311 20 10 DGCDLP C[NH2+]Cc1ccccc1C[NH2+][C@@H](C)c1cc(F)cc(F)c1O ZINC000844922704 630982722 /nfs/dbraw/zinc/98/27/22/630982722.db2.gz CSNCIUUGNHYMJY-NSHDSACASA-N 2 2 306.356 3.241 20 10 DGCDLP C[NH2+]Cc1ccccc1C[NH2+][C@H](C)c1cc(F)cc(F)c1O ZINC000844922703 630982983 /nfs/dbraw/zinc/98/29/83/630982983.db2.gz CSNCIUUGNHYMJY-LLVKDONJSA-N 2 2 306.356 3.241 20 10 DGCDLP CC(C)C[N@H+](C)CCC[NH2+]Cc1cc(Cl)cc(F)c1O ZINC000845995828 631205088 /nfs/dbraw/zinc/20/50/88/631205088.db2.gz HDTLPPBSWIHMNV-UHFFFAOYSA-N 2 2 302.821 3.252 20 10 DGCDLP CC(C)C[N@@H+](C)CCC[NH2+]Cc1cc(Cl)cc(F)c1O ZINC000845995828 631205089 /nfs/dbraw/zinc/20/50/89/631205089.db2.gz HDTLPPBSWIHMNV-UHFFFAOYSA-N 2 2 302.821 3.252 20 10 DGCDLP COc1ccc(O)c([C@H](C)[NH2+][C@H]2CCC[N@@H+]3CCCC[C@H]23)c1 ZINC000848568357 631696727 /nfs/dbraw/zinc/69/67/27/631696727.db2.gz GORKFSLGNMHBTB-RRQGHBQHSA-N 2 2 304.434 3.068 20 10 DGCDLP COc1ccc(O)c([C@H](C)[NH2+][C@H]2CCC[N@H+]3CCCC[C@H]23)c1 ZINC000848568357 631696730 /nfs/dbraw/zinc/69/67/30/631696730.db2.gz GORKFSLGNMHBTB-RRQGHBQHSA-N 2 2 304.434 3.068 20 10 DGCDLP CN(C)c1ccc(/C=C/C[NH2+]C[C@@H]2CC[N@@H+]2C(C)(C)C)cc1 ZINC000850341800 632117942 /nfs/dbraw/zinc/11/79/42/632117942.db2.gz ATBVTELVDHCNJW-DKFQHHCZSA-N 2 2 301.478 3.228 20 10 DGCDLP CN(C)c1ccc(/C=C/C[NH2+]C[C@@H]2CC[N@H+]2C(C)(C)C)cc1 ZINC000850341800 632117946 /nfs/dbraw/zinc/11/79/46/632117946.db2.gz ATBVTELVDHCNJW-DKFQHHCZSA-N 2 2 301.478 3.228 20 10 DGCDLP Oc1ccc(Cl)cc1C[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000246867653 655536691 /nfs/dbraw/zinc/53/66/91/655536691.db2.gz SOPIYSCLJJLXOC-GUYCJALGSA-N 2 2 320.864 3.494 20 10 DGCDLP Oc1ccc(Cl)cc1C[N@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000246867653 655536692 /nfs/dbraw/zinc/53/66/92/655536692.db2.gz SOPIYSCLJJLXOC-GUYCJALGSA-N 2 2 320.864 3.494 20 10 DGCDLP Oc1ccc(Cl)cc1C[NH+]1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000246867653 655536693 /nfs/dbraw/zinc/53/66/93/655536693.db2.gz SOPIYSCLJJLXOC-GUYCJALGSA-N 2 2 320.864 3.494 20 10 DGCDLP Oc1ccc(Cl)cc1C[NH+]1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000246867653 655536695 /nfs/dbraw/zinc/53/66/95/655536695.db2.gz SOPIYSCLJJLXOC-GUYCJALGSA-N 2 2 320.864 3.494 20 10 DGCDLP CC[C@@H]([NH2+][C@H]1CC[N@H+](CC2CC2)C1)c1ccc(N(C)C)cc1 ZINC000157715061 659093413 /nfs/dbraw/zinc/09/34/13/659093413.db2.gz XFGLFFUEDXRNIC-PKOBYXMFSA-N 2 2 301.478 3.278 20 10 DGCDLP CC[C@@H]([NH2+][C@H]1CC[N@@H+](CC2CC2)C1)c1ccc(N(C)C)cc1 ZINC000157715061 659093417 /nfs/dbraw/zinc/09/34/17/659093417.db2.gz XFGLFFUEDXRNIC-PKOBYXMFSA-N 2 2 301.478 3.278 20 10 DGCDLP Cc1cc(O)c(C[NH+]2CCC([NH2+]CC3CC3)CC2)cc1Cl ZINC001579637939 1191983552 /nfs/dbraw/zinc/98/35/52/1191983552.db2.gz JSIALCWXOJKNAO-UHFFFAOYSA-N 2 2 308.853 3.318 20 10 DGCDLP CC(C)[NH+](CCC[NH2+]Cc1cc(F)cc(F)c1O)C(C)C ZINC001461267495 1182789977 /nfs/dbraw/zinc/78/99/77/1182789977.db2.gz KLBXRPKDCBEYFV-UHFFFAOYSA-N 2 2 300.393 3.269 20 10 DGCDLP CN(C)c1ccc(/C=C\C[NH2+]C[C@H]2CCCC[N@@H+]2C2CC2)cc1 ZINC001474137480 1183873707 /nfs/dbraw/zinc/87/37/07/1183873707.db2.gz FRXQDLGPWIGAFP-KKHYBRAUSA-N 2 2 313.489 3.372 20 10 DGCDLP CN(C)c1ccc(/C=C\C[NH2+]C[C@H]2CCCC[N@H+]2C2CC2)cc1 ZINC001474137480 1183873714 /nfs/dbraw/zinc/87/37/14/1183873714.db2.gz FRXQDLGPWIGAFP-KKHYBRAUSA-N 2 2 313.489 3.372 20 10 DGCDLP Cc1cccc(NC[C@@H]2CCC[N@@H+]2Cc2cccc(F)c2O)[nH+]1 ZINC001651773722 1195507461 /nfs/dbraw/zinc/50/74/61/1195507461.db2.gz PEKFMCNGEUMKDX-HNNXBMFYSA-N 2 2 315.392 3.311 20 10 DGCDLP Cc1cccc(NC[C@@H]2CCC[N@H+]2Cc2cccc(F)c2O)[nH+]1 ZINC001651773722 1195507464 /nfs/dbraw/zinc/50/74/64/1195507464.db2.gz PEKFMCNGEUMKDX-HNNXBMFYSA-N 2 2 315.392 3.311 20 10 DGCDLP Oc1cc(Cl)ccc1C[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC001657228495 1196120246 /nfs/dbraw/zinc/12/02/46/1196120246.db2.gz AKKNGVHGXDRTMM-DYVFJYSZSA-N 2 2 320.864 3.494 20 10 DGCDLP Oc1cc(Cl)ccc1C[N@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC001657228495 1196120256 /nfs/dbraw/zinc/12/02/56/1196120256.db2.gz AKKNGVHGXDRTMM-DYVFJYSZSA-N 2 2 320.864 3.494 20 10 DGCDLP Oc1cc(Cl)ccc1C[NH+]1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC001657228495 1196120260 /nfs/dbraw/zinc/12/02/60/1196120260.db2.gz AKKNGVHGXDRTMM-DYVFJYSZSA-N 2 2 320.864 3.494 20 10 DGCDLP Oc1cc(Cl)ccc1C[NH+]1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC001657228495 1196120264 /nfs/dbraw/zinc/12/02/64/1196120264.db2.gz AKKNGVHGXDRTMM-DYVFJYSZSA-N 2 2 320.864 3.494 20 10 DGCDLP Oc1ccc(Cl)c(F)c1C[NH2+]Cc1ccc2c[nH+]cn2c1 ZINC001657506886 1196149817 /nfs/dbraw/zinc/14/98/17/1196149817.db2.gz BJZWFWQPSDIEPV-UHFFFAOYSA-N 2 2 305.740 3.122 20 10 DGCDLP C[C@@H]1CC[N@H+](Cc2cc(Cl)c(Cl)cc2O)C[C@H]1C[NH3+] ZINC001205314551 1091180306 /nfs/dbraw/zinc/18/03/06/1091180306.db2.gz BRPWNWKAFLBRRZ-MWLCHTKSSA-N 2 2 303.233 3.116 20 10 DGCDLP C[C@@H]1CC[N@@H+](Cc2cc(Cl)c(Cl)cc2O)C[C@H]1C[NH3+] ZINC001205314551 1091180314 /nfs/dbraw/zinc/18/03/14/1091180314.db2.gz BRPWNWKAFLBRRZ-MWLCHTKSSA-N 2 2 303.233 3.116 20 10 DGCDLP C[C@]1(C[NH3+])CCCC[N@H+](Cc2cc(F)c(Cl)cc2O)C1 ZINC001206575864 1091675436 /nfs/dbraw/zinc/67/54/36/1091675436.db2.gz ZYEKFXFENNYDSN-OAHLLOKOSA-N 2 2 300.805 3.136 20 10 DGCDLP C[C@]1(C[NH3+])CCCC[N@@H+](Cc2cc(F)c(Cl)cc2O)C1 ZINC001206575864 1091675440 /nfs/dbraw/zinc/67/54/40/1091675440.db2.gz ZYEKFXFENNYDSN-OAHLLOKOSA-N 2 2 300.805 3.136 20 10 DGCDLP Cc1c(O)ccc(C[N@H+](C)Cc2ccc(-n3cc[nH+]c3)cc2)c1O ZINC001140747536 1091984741 /nfs/dbraw/zinc/98/47/41/1091984741.db2.gz DXMIDCNBDLDPKY-UHFFFAOYSA-N 2 2 323.396 3.224 20 10 DGCDLP Cc1c(O)ccc(C[N@@H+](C)Cc2ccc(-n3cc[nH+]c3)cc2)c1O ZINC001140747536 1091984751 /nfs/dbraw/zinc/98/47/51/1091984751.db2.gz DXMIDCNBDLDPKY-UHFFFAOYSA-N 2 2 323.396 3.224 20 10 DGCDLP Cc1c(O)ccc(C[N@H+](C2CCCC2)C2CC[NH+](C)CC2)c1O ZINC001140749786 1091984948 /nfs/dbraw/zinc/98/49/48/1091984948.db2.gz NAVMZNACDAXPBD-UHFFFAOYSA-N 2 2 318.461 3.245 20 10 DGCDLP Cc1c(O)ccc(C[N@@H+](C2CCCC2)C2CC[NH+](C)CC2)c1O ZINC001140749786 1091984955 /nfs/dbraw/zinc/98/49/55/1091984955.db2.gz NAVMZNACDAXPBD-UHFFFAOYSA-N 2 2 318.461 3.245 20 10 DGCDLP CC[NH+]1CCC([NH2+]Cc2cc(Cl)c3cccnc3c2O)CC1 ZINC001169230539 1092603265 /nfs/dbraw/zinc/60/32/65/1092603265.db2.gz DTTFNIRZAVSWAP-UHFFFAOYSA-N 2 2 319.836 3.168 20 10 DGCDLP CCc1ccc(C[NH+]2CC3(C2)CC[N@@H+](C2CCCC2)C3)c(O)c1 ZINC001276804905 1094975299 /nfs/dbraw/zinc/97/52/99/1094975299.db2.gz NPCSLIBDWOGMNT-UHFFFAOYSA-N 2 2 314.473 3.405 20 10 DGCDLP CCc1ccc(C[NH+]2CC3(C2)CC[N@H+](C2CCCC2)C3)c(O)c1 ZINC001276804905 1094975309 /nfs/dbraw/zinc/97/53/09/1094975309.db2.gz NPCSLIBDWOGMNT-UHFFFAOYSA-N 2 2 314.473 3.405 20 10 DGCDLP CC(C)(C)c1ccc(C[N@@H+]2CCC[C@@]3(CCC[NH2+]3)C2)c(O)c1 ZINC001222354819 1095569558 /nfs/dbraw/zinc/56/95/58/1095569558.db2.gz NWQITNUCCAJOHT-IBGZPJMESA-N 2 2 302.462 3.408 20 10 DGCDLP CC(C)(C)c1ccc(C[N@H+]2CCC[C@@]3(CCC[NH2+]3)C2)c(O)c1 ZINC001222354819 1095569566 /nfs/dbraw/zinc/56/95/66/1095569566.db2.gz NWQITNUCCAJOHT-IBGZPJMESA-N 2 2 302.462 3.408 20 10 DGCDLP Cc1cc(C[N@@H+]2CCC[C@@]3(CCCC[NH2+]3)C2)ccc1N(C)C ZINC001222390185 1095587346 /nfs/dbraw/zinc/58/73/46/1095587346.db2.gz MLKMWYMTLLGINL-IBGZPJMESA-N 2 2 301.478 3.169 20 10 DGCDLP Cc1cc(C[N@H+]2CCC[C@@]3(CCCC[NH2+]3)C2)ccc1N(C)C ZINC001222390185 1095587353 /nfs/dbraw/zinc/58/73/53/1095587353.db2.gz MLKMWYMTLLGINL-IBGZPJMESA-N 2 2 301.478 3.169 20 10 DGCDLP Oc1cc(C(F)(F)F)ccc1C[N@@H+]1CC[C@]2(C1)CCCC[NH2+]2 ZINC001222436779 1095614385 /nfs/dbraw/zinc/61/43/85/1095614385.db2.gz ZZQKFXXLXWDDTJ-HNNXBMFYSA-N 2 2 314.351 3.129 20 10 DGCDLP Oc1cc(C(F)(F)F)ccc1C[N@H+]1CC[C@]2(C1)CCCC[NH2+]2 ZINC001222436779 1095614393 /nfs/dbraw/zinc/61/43/93/1095614393.db2.gz ZZQKFXXLXWDDTJ-HNNXBMFYSA-N 2 2 314.351 3.129 20 10 DGCDLP CC[N@H+](CCn1cc[nH+]c1)Cc1cc(C(C)(C)C)ccc1O ZINC001233286820 1098276454 /nfs/dbraw/zinc/27/64/54/1098276454.db2.gz JUQKBXDXZBOXQI-UHFFFAOYSA-N 2 2 301.434 3.408 20 10 DGCDLP CC[N@@H+](CCn1cc[nH+]c1)Cc1cc(C(C)(C)C)ccc1O ZINC001233286820 1098276458 /nfs/dbraw/zinc/27/64/58/1098276458.db2.gz JUQKBXDXZBOXQI-UHFFFAOYSA-N 2 2 301.434 3.408 20 10 DGCDLP CCC[NH+]1CCC([NH2+]Cc2cc(Cl)cc(F)c2O)CC1 ZINC001177127988 1098474991 /nfs/dbraw/zinc/47/49/91/1098474991.db2.gz ZXDVQRCYAOWIPU-UHFFFAOYSA-N 2 2 300.805 3.149 20 10 DGCDLP Oc1cc(Cl)c(F)cc1C[N@@H+]1CCC[C@]2(CCC[NH2+]2)CC1 ZINC001235038905 1098766158 /nfs/dbraw/zinc/76/61/58/1098766158.db2.gz LAQXVGVSCHPFIR-MRXNPFEDSA-N 2 2 312.816 3.293 20 10 DGCDLP Oc1cc(Cl)c(F)cc1C[N@H+]1CCC[C@]2(CCC[NH2+]2)CC1 ZINC001235038905 1098766166 /nfs/dbraw/zinc/76/61/66/1098766166.db2.gz LAQXVGVSCHPFIR-MRXNPFEDSA-N 2 2 312.816 3.293 20 10 DGCDLP CCCCN(CCCC)c1ccc(C[N@@H+]2CC[C@H]([NH3+])C2)c(O)c1 ZINC001235361419 1098979272 /nfs/dbraw/zinc/97/92/72/1098979272.db2.gz GAESUKCTTJGYDP-KRWDZBQOSA-N 2 2 319.493 3.332 20 10 DGCDLP CCCCN(CCCC)c1ccc(C[N@H+]2CC[C@H]([NH3+])C2)c(O)c1 ZINC001235361419 1098979277 /nfs/dbraw/zinc/97/92/77/1098979277.db2.gz GAESUKCTTJGYDP-KRWDZBQOSA-N 2 2 319.493 3.332 20 10 DGCDLP CC[NH+](CC)CC[C@@H](C)[NH2+]Cc1cc(F)c(N(C)C)cc1F ZINC001179829183 1099224569 /nfs/dbraw/zinc/22/45/69/1099224569.db2.gz AFUQKHSMZVRSNT-CYBMUJFWSA-N 2 2 313.436 3.241 20 10 DGCDLP CN(C)c1ccc(C[N@@H+]2C[C@H]3CC[C@@H](C2)[NH2+]C3)c2ccccc21 ZINC001236059541 1099359369 /nfs/dbraw/zinc/35/93/69/1099359369.db2.gz JJPZBAVEBFQWHC-RDJZCZTQSA-N 2 2 309.457 3.090 20 10 DGCDLP CN(C)c1ccc(C[N@H+]2C[C@H]3CC[C@@H](C2)[NH2+]C3)c2ccccc21 ZINC001236059541 1099359380 /nfs/dbraw/zinc/35/93/80/1099359380.db2.gz JJPZBAVEBFQWHC-RDJZCZTQSA-N 2 2 309.457 3.090 20 10 DGCDLP CCOc1ccc(C[NH+]2CCC([NH+](CC)CC)CC2)c(O)c1 ZINC001237041112 1099938254 /nfs/dbraw/zinc/93/82/54/1099938254.db2.gz FCLPAXONYDJMRW-UHFFFAOYSA-N 2 2 306.450 3.097 20 10 DGCDLP C[NH+]1CCC2(C[NH+](Cc3c(O)ccc(Cl)c3Cl)C2)CC1 ZINC001237085341 1099963294 /nfs/dbraw/zinc/96/32/94/1099963294.db2.gz YEMPXCGHVLHZJM-UHFFFAOYSA-N 2 2 315.244 3.227 20 10 DGCDLP CN(C)c1ccc(C[NH+]2CCC3(CC2)[NH2+]Cc2ccccc23)cc1 ZINC001237359934 1100095092 /nfs/dbraw/zinc/09/50/92/1100095092.db2.gz SDZGAVCIOKNZFE-UHFFFAOYSA-N 2 2 321.468 3.347 20 10 DGCDLP Cc1cccc(NC[C@H]2CCC[N@@H+]2Cc2cc(F)ccc2O)[nH+]1 ZINC001320161983 1106909231 /nfs/dbraw/zinc/90/92/31/1106909231.db2.gz UVJUBZZVALQOAB-MRXNPFEDSA-N 2 2 315.392 3.311 20 10 DGCDLP Cc1cccc(NC[C@H]2CCC[N@H+]2Cc2cc(F)ccc2O)[nH+]1 ZINC001320161983 1106909241 /nfs/dbraw/zinc/90/92/41/1106909241.db2.gz UVJUBZZVALQOAB-MRXNPFEDSA-N 2 2 315.392 3.311 20 10 DGCDLP c1c[nH+]c([C@H]2CCC[N@@H+](Cc3ccc(N4CCCC4)cc3)C2)[nH]1 ZINC001319696397 1108598121 /nfs/dbraw/zinc/59/81/21/1108598121.db2.gz RVVMLFAULAQQLD-KRWDZBQOSA-N 2 2 310.445 3.390 20 10 DGCDLP c1c[nH+]c([C@H]2CCC[N@H+](Cc3ccc(N4CCCC4)cc3)C2)[nH]1 ZINC001319696397 1108598132 /nfs/dbraw/zinc/59/81/32/1108598132.db2.gz RVVMLFAULAQQLD-KRWDZBQOSA-N 2 2 310.445 3.390 20 10 DGCDLP CC[C@@H]([NH2+]CCc1cn2ccccc2[nH+]1)c1ccc(F)cc1O ZINC000285883005 131207361 /nfs/dbraw/zinc/20/73/61/131207361.db2.gz ZPMCFKMUDAPHFF-MRXNPFEDSA-N 2 2 313.376 3.462 20 10 DGCDLP CC[C@H]([NH2+]CCC[N@@H+]1CCCO[C@H](C)C1)c1ccc(F)cc1O ZINC000287534714 288040309 /nfs/dbraw/zinc/04/03/09/288040309.db2.gz PCOKPDIZORSUQK-PBHICJAKSA-N 2 2 324.440 3.073 20 10 DGCDLP CC[C@H]([NH2+]CCC[N@H+]1CCCO[C@H](C)C1)c1ccc(F)cc1O ZINC000287534714 288040311 /nfs/dbraw/zinc/04/03/11/288040311.db2.gz PCOKPDIZORSUQK-PBHICJAKSA-N 2 2 324.440 3.073 20 10 DGCDLP C[C@@H]([NH2+]CCCCNc1cccc[nH+]1)c1ccc(F)cc1O ZINC000185325442 432490823 /nfs/dbraw/zinc/49/08/23/432490823.db2.gz MRJZNWAGKMBTNI-CYBMUJFWSA-N 2 2 303.381 3.469 20 10 DGCDLP Oc1ccc(Cl)c(F)c1C[NH2+]Cc1c[nH+]c2n1CCCC2 ZINC000376757548 433814214 /nfs/dbraw/zinc/81/42/14/433814214.db2.gz IOVQHHYMNDYAEN-UHFFFAOYSA-N 2 2 309.772 3.007 20 10 DGCDLP C[C@@H]([NH2+]Cc1ccc(-n2cc[nH+]c2)nc1)c1ccc(N(C)C)cc1 ZINC000370670002 434615965 /nfs/dbraw/zinc/61/59/65/434615965.db2.gz UPENJIGDRSYCHO-OAHLLOKOSA-N 2 2 321.428 3.184 20 10 DGCDLP Oc1c(Cl)cccc1C[N@@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000180363377 526327705 /nfs/dbraw/zinc/32/77/05/526327705.db2.gz GYZIBCBBCWZYOV-HNNXBMFYSA-N 2 2 308.853 3.496 20 10 DGCDLP Oc1c(Cl)cccc1C[N@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000180363377 526327714 /nfs/dbraw/zinc/32/77/14/526327714.db2.gz GYZIBCBBCWZYOV-HNNXBMFYSA-N 2 2 308.853 3.496 20 10 DGCDLP C[C@H]([NH2+][C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1)c1ccccc1O ZINC000854225181 620785679 /nfs/dbraw/zinc/78/56/79/620785679.db2.gz YAGFIJNOUIIPDW-MORSLUCNSA-N 2 2 314.404 3.328 20 10 DGCDLP Cc1ccc(O)c(CN(c2cccc[nH+]2)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC000895112934 618541236 /nfs/dbraw/zinc/54/12/36/618541236.db2.gz ZECZQESSFUOCEY-QAQDUYKDSA-N 2 2 311.429 3.372 20 10 DGCDLP Cc1cc(O)c(C[N@@H+](C)C2C[C@H]3CC[C@@H](C2)[NH+]3C)c(Cl)c1 ZINC000840946989 618619851 /nfs/dbraw/zinc/61/98/51/618619851.db2.gz JDJAVQCIGUXCPQ-PBWFPOADSA-N 2 2 308.853 3.411 20 10 DGCDLP Cc1cc(O)c(C[N@H+](C)C2C[C@H]3CC[C@@H](C2)[NH+]3C)c(Cl)c1 ZINC000840946989 618619853 /nfs/dbraw/zinc/61/98/53/618619853.db2.gz JDJAVQCIGUXCPQ-PBWFPOADSA-N 2 2 308.853 3.411 20 10 DGCDLP Cc1cc(O)c(C[NH+](C)C2C[C@H]3CC[C@@H](C2)[N@H+]3C)c(Cl)c1 ZINC000840946989 618619854 /nfs/dbraw/zinc/61/98/54/618619854.db2.gz JDJAVQCIGUXCPQ-PBWFPOADSA-N 2 2 308.853 3.411 20 10 DGCDLP Cc1cc(O)c(C[NH+](C)C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c(Cl)c1 ZINC000840946989 618619858 /nfs/dbraw/zinc/61/98/58/618619858.db2.gz JDJAVQCIGUXCPQ-PBWFPOADSA-N 2 2 308.853 3.411 20 10 DGCDLP CCC1([NH+]2CCC2)CC[NH+](Cc2cc(Cl)ccc2O)CC1 ZINC000895827905 618834340 /nfs/dbraw/zinc/83/43/40/618834340.db2.gz OPJIRKFTRUOZGW-UHFFFAOYSA-N 2 2 308.853 3.496 20 10 DGCDLP Cc1cc(O)c(C[NH2+]CCC[NH2+]Cc2cccnc2)c(Cl)c1 ZINC000841042098 619243805 /nfs/dbraw/zinc/24/38/05/619243805.db2.gz KWEFKUNQWZOUGH-UHFFFAOYSA-N 2 2 319.836 3.019 20 10 DGCDLP [NH3+][C@@H]1c2ccccc2C[C@H]1[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000904460969 619923943 /nfs/dbraw/zinc/92/39/43/619923943.db2.gz CMTHBLYEXVKRLT-NHCUHLMSSA-N 2 2 321.468 3.391 20 10 DGCDLP C[C@@H]([NH2+]C[C@H](C)C[NH+]1CCCCC1)c1cc(F)cc(F)c1O ZINC000756435032 621638127 /nfs/dbraw/zinc/63/81/27/621638127.db2.gz SXCLZDLLVZQCQL-QWHCGFSZSA-N 2 2 312.404 3.443 20 10 DGCDLP CCC[N@H+](C)C[C@H]1CC[NH+](Cc2ccc(N(C)C)c(F)c2)C1 ZINC000769506120 622535320 /nfs/dbraw/zinc/53/53/20/622535320.db2.gz ATVQBAWNTNGSMX-MRXNPFEDSA-N 2 2 307.457 3.055 20 10 DGCDLP CCC[N@@H+](C)C[C@H]1CC[NH+](Cc2ccc(N(C)C)c(F)c2)C1 ZINC000769506120 622535322 /nfs/dbraw/zinc/53/53/22/622535322.db2.gz ATVQBAWNTNGSMX-MRXNPFEDSA-N 2 2 307.457 3.055 20 10 DGCDLP CCC[NH+](C)C[C@H]1CC[N@H+](Cc2ccc(N(C)C)c(F)c2)C1 ZINC000769506120 622535323 /nfs/dbraw/zinc/53/53/23/622535323.db2.gz ATVQBAWNTNGSMX-MRXNPFEDSA-N 2 2 307.457 3.055 20 10 DGCDLP CCC[NH+](C)C[C@H]1CC[N@@H+](Cc2ccc(N(C)C)c(F)c2)C1 ZINC000769506120 622535327 /nfs/dbraw/zinc/53/53/27/622535327.db2.gz ATVQBAWNTNGSMX-MRXNPFEDSA-N 2 2 307.457 3.055 20 10 DGCDLP CCN(C)c1ccc(C[N@@H+]2[C@@H]3CC[C@H]2C[NH+](CC)CC3)cc1 ZINC000773754318 623068076 /nfs/dbraw/zinc/06/80/76/623068076.db2.gz MIKYRJMJOXOXNE-MOPGFXCFSA-N 2 2 301.478 3.201 20 10 DGCDLP CCN(C)c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[NH+](CC)CC3)cc1 ZINC000773754318 623068083 /nfs/dbraw/zinc/06/80/83/623068083.db2.gz MIKYRJMJOXOXNE-MOPGFXCFSA-N 2 2 301.478 3.201 20 10 DGCDLP CCN(C)c1ccc(C[NH+]2[C@@H]3CC[C@H]2C[N@H+](CC)CC3)cc1 ZINC000773754318 623068089 /nfs/dbraw/zinc/06/80/89/623068089.db2.gz MIKYRJMJOXOXNE-MOPGFXCFSA-N 2 2 301.478 3.201 20 10 DGCDLP CCN(C)c1ccc(C[NH+]2[C@@H]3CC[C@H]2C[N@@H+](CC)CC3)cc1 ZINC000773754318 623068096 /nfs/dbraw/zinc/06/80/96/623068096.db2.gz MIKYRJMJOXOXNE-MOPGFXCFSA-N 2 2 301.478 3.201 20 10 DGCDLP C[C@H]([NH2+]CC[C@@H]([NH3+])Cc1ccccc1)c1cc(F)cc(F)c1O ZINC000873235259 623086158 /nfs/dbraw/zinc/08/61/58/623086158.db2.gz MXXLIQPANHCAPB-SWLSCSKDSA-N 2 2 320.383 3.281 20 10 DGCDLP Oc1c(F)cc(Cl)cc1C[NH2+]C1CC[NH+](C2CCC2)CC1 ZINC000776061971 623370139 /nfs/dbraw/zinc/37/01/39/623370139.db2.gz ACZNBJIFNBMZLP-UHFFFAOYSA-N 2 2 312.816 3.291 20 10 DGCDLP C[C@H]([NH2+][C@@H]1CCn2cc[nH+]c2C1)c1cc2c(cc1O)CCCC2 ZINC000779065654 623726826 /nfs/dbraw/zinc/72/68/26/623726826.db2.gz NIIHTIUEYCAFNR-XJKSGUPXSA-N 2 2 311.429 3.133 20 10 DGCDLP CCc1ccc(NCc2ccc(N3CC[NH+](C)CC3)cc2)[nH+]c1 ZINC000883385240 626668667 /nfs/dbraw/zinc/66/86/67/626668667.db2.gz IFJNRGHNCBGFTD-UHFFFAOYSA-N 2 2 310.445 3.008 20 10 DGCDLP CCC[N@H+](Cc1ncc(C[NH+](C)C)s1)Cc1ccccc1O ZINC000809556186 626920218 /nfs/dbraw/zinc/92/02/18/626920218.db2.gz DFLOLSFDOZUCLX-UHFFFAOYSA-N 2 2 319.474 3.323 20 10 DGCDLP CCC[N@@H+](Cc1ncc(C[NH+](C)C)s1)Cc1ccccc1O ZINC000809556186 626920222 /nfs/dbraw/zinc/92/02/22/626920222.db2.gz DFLOLSFDOZUCLX-UHFFFAOYSA-N 2 2 319.474 3.323 20 10 DGCDLP C[C@@H](C[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1O)C[NH+](C)C ZINC000815627811 627692824 /nfs/dbraw/zinc/69/28/24/627692824.db2.gz KEFQACVOZNQIIL-QWRGUYRKSA-N 2 2 304.356 3.259 20 10 DGCDLP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2cc(Cl)c(F)cc2O)[C@@H](C)C1 ZINC000816514726 627800100 /nfs/dbraw/zinc/80/01/00/627800100.db2.gz FXVVOTZUBYVTHP-XHDPSFHLSA-N 2 2 314.832 3.347 20 10 DGCDLP CC[N@H+]1CC[C@@H]([NH+](C)Cc2cc(Cl)c(F)cc2O)[C@@H](C)C1 ZINC000816514726 627800104 /nfs/dbraw/zinc/80/01/04/627800104.db2.gz FXVVOTZUBYVTHP-XHDPSFHLSA-N 2 2 314.832 3.347 20 10 DGCDLP CC[NH+]1CC[C@@H]([N@H+](C)Cc2cc(Cl)c(F)cc2O)[C@@H](C)C1 ZINC000816514726 627800107 /nfs/dbraw/zinc/80/01/07/627800107.db2.gz FXVVOTZUBYVTHP-XHDPSFHLSA-N 2 2 314.832 3.347 20 10 DGCDLP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2cc(Cl)c(F)cc2O)[C@@H](C)C1 ZINC000816514726 627800110 /nfs/dbraw/zinc/80/01/10/627800110.db2.gz FXVVOTZUBYVTHP-XHDPSFHLSA-N 2 2 314.832 3.347 20 10 DGCDLP CC[NH+]1CCC(C[NH2+]Cc2cc(Cl)c(F)cc2O)CC1 ZINC000816548485 627806174 /nfs/dbraw/zinc/80/61/74/627806174.db2.gz JHUZFUGBXDJXIC-UHFFFAOYSA-N 2 2 300.805 3.006 20 10 DGCDLP Cc1cccc2c1CC[C@@H]2[NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000817938381 627966455 /nfs/dbraw/zinc/96/64/55/627966455.db2.gz JQZDRKURRBBHRH-PMACEKPBSA-N 2 2 309.457 3.338 20 10 DGCDLP C[C@@H]([NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1)c1cc(F)cc(F)c1 ZINC000817938567 627966802 /nfs/dbraw/zinc/96/68/02/627966802.db2.gz NGKWQHKPIXQQLN-XIKOKIGWSA-N 2 2 319.399 3.381 20 10 DGCDLP Cc1nc(C)c([C@@H](C)[NH2+]C[C@H]([NH3+])c2ccc(N(C)C)cc2)s1 ZINC000817938656 627967695 /nfs/dbraw/zinc/96/76/95/627967695.db2.gz OYUOHGYPLIACFH-BZNIZROVSA-N 2 2 318.490 3.177 20 10 DGCDLP Cc1cc([C@H](C)[NH2+]C[C@H]([NH3+])c2ccc(N(C)C)cc2)cs1 ZINC000817940001 627967809 /nfs/dbraw/zinc/96/78/09/627967809.db2.gz DSRDFWRRSXIWIV-GUYCJALGSA-N 2 2 303.475 3.473 20 10 DGCDLP Oc1ccccc1[C@H](CCc1ccccc1)[NH2+]CC[NH2+]C1CC1 ZINC000817953354 627973424 /nfs/dbraw/zinc/97/34/24/627973424.db2.gz LDRPMVIVCWTVBI-IBGZPJMESA-N 2 2 310.441 3.408 20 10 DGCDLP C[C@H]([NH2+][C@H]1CC[NH2+][C@H](C)C1)c1cc(Cl)c(Cl)cc1O ZINC000817971806 627979748 /nfs/dbraw/zinc/97/97/48/627979748.db2.gz QDQJFYTXGFMRHY-UTLUCORTSA-N 2 2 303.233 3.490 20 10 DGCDLP CC[NH2+][C@H](C)C[NH2+][C@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000817972074 627980333 /nfs/dbraw/zinc/98/03/33/627980333.db2.gz JOAFMCDLEPTMFD-HUUCEWRRSA-N 2 2 307.457 3.465 20 10 DGCDLP C[C@@H]([NH2+]CCC[NH2+]C1CC1)c1cc(Cl)c(Cl)cc1O ZINC000817984423 627983066 /nfs/dbraw/zinc/98/30/66/627983066.db2.gz SLBKMVSDDADFRI-SECBINFHSA-N 2 2 303.233 3.492 20 10 DGCDLP Cc1cc(O)c(C[N@@H+]2CCC[C@@H](c3[nH]cc[nH+]3)C2)cc1Cl ZINC000824596177 628675352 /nfs/dbraw/zinc/67/53/52/628675352.db2.gz CDOPXJUNSOYEHH-GFCCVEGCSA-N 2 2 305.809 3.457 20 10 DGCDLP Cc1cc(O)c(C[N@H+]2CCC[C@@H](c3[nH]cc[nH+]3)C2)cc1Cl ZINC000824596177 628675355 /nfs/dbraw/zinc/67/53/55/628675355.db2.gz CDOPXJUNSOYEHH-GFCCVEGCSA-N 2 2 305.809 3.457 20 10 DGCDLP Cc1cc(O)c(C[NH+]2CC[C@]3(C2)CCC[N@@H+](C)C3)cc1Cl ZINC000826016397 628820396 /nfs/dbraw/zinc/82/03/96/628820396.db2.gz IMOMJDUYBQRFGW-QGZVFWFLSA-N 2 2 308.853 3.272 20 10 DGCDLP Cc1cc(O)c(C[NH+]2CC[C@]3(C2)CCC[N@H+](C)C3)cc1Cl ZINC000826016397 628820397 /nfs/dbraw/zinc/82/03/97/628820397.db2.gz IMOMJDUYBQRFGW-QGZVFWFLSA-N 2 2 308.853 3.272 20 10 DGCDLP Cc1cc(O)c(C[N@H+]2CC[C@]3(C2)CCC[NH+](C)C3)cc1Cl ZINC000826016397 628820399 /nfs/dbraw/zinc/82/03/99/628820399.db2.gz IMOMJDUYBQRFGW-QGZVFWFLSA-N 2 2 308.853 3.272 20 10 DGCDLP Cc1cc(O)c(C[N@@H+]2CC[C@]3(C2)CCC[NH+](C)C3)cc1Cl ZINC000826016397 628820401 /nfs/dbraw/zinc/82/04/01/628820401.db2.gz IMOMJDUYBQRFGW-QGZVFWFLSA-N 2 2 308.853 3.272 20 10 DGCDLP Oc1c(Cl)cccc1C[NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1 ZINC000827951071 629007206 /nfs/dbraw/zinc/00/72/06/629007206.db2.gz VLJRXFPOQNLYHO-AWEZNQCLSA-N 2 2 308.853 3.257 20 10 DGCDLP Oc1c(Cl)cccc1C[NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC000827951071 629007208 /nfs/dbraw/zinc/00/72/08/629007208.db2.gz VLJRXFPOQNLYHO-AWEZNQCLSA-N 2 2 308.853 3.257 20 10 DGCDLP CN(C)c1ccc(/C=C/C[NH+]2CCC(n3cc[nH+]c3)CC2)cc1 ZINC000835027314 629828833 /nfs/dbraw/zinc/82/88/33/629828833.db2.gz LIRIRFGWZOYKDB-ONEGZZNKSA-N 2 2 310.445 3.299 20 10 DGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+][C@H]2CCCC[C@H]2C2CC2)cc1 ZINC000841045303 630400994 /nfs/dbraw/zinc/40/09/94/630400994.db2.gz JRVQKYCZJGECGW-OTWHNJEPSA-N 2 2 301.478 3.311 20 10 DGCDLP C[C@@H](CCc1ccccc1)[NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000841044572 630401074 /nfs/dbraw/zinc/40/10/74/630401074.db2.gz DIJWMNZSZNUVFA-JXFKEZNVSA-N 2 2 311.473 3.363 20 10 DGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+]Cc2cc3ccccc3o2)cc1 ZINC000841043945 630401348 /nfs/dbraw/zinc/40/13/48/630401348.db2.gz RQJSAQXTBANUKZ-GOSISDBHSA-N 2 2 309.413 3.288 20 10 DGCDLP C[C@H]1CCC[N@H+](Cc2c(O)ccc(Cl)c2F)[C@@H]1CC[NH3+] ZINC000844900685 630970442 /nfs/dbraw/zinc/97/04/42/630970442.db2.gz CQEYFWAGPMEDNQ-GXFFZTMASA-N 2 2 300.805 3.134 20 10 DGCDLP C[C@@H]([NH2+][C@H](Cn1cc[nH+]c1)C(C)(C)C)c1cc(F)ccc1O ZINC000317536499 656628776 /nfs/dbraw/zinc/62/87/76/656628776.db2.gz KXOWZZOBFOXUKX-MLGOLLRUSA-N 2 2 305.397 3.493 20 10 DGCDLP CS[C@@H]1CCC[C@@H]([NH2+]C[C@@H]([NH3+])c2ccc(N(C)C)cc2)C1 ZINC001579370393 1191974669 /nfs/dbraw/zinc/97/46/69/1191974669.db2.gz QWCLZAFMKXYESQ-DJIMGWMZSA-N 2 2 307.507 3.016 20 10 DGCDLP Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]Cc1cc(N(C)C)cc[nH+]1 ZINC001331995170 1178332370 /nfs/dbraw/zinc/33/23/70/1178332370.db2.gz BNRCRKQYIVRKHD-CZUORRHYSA-N 2 2 311.429 3.500 20 10 DGCDLP C[C@H](C[NH2+]Cc1cc(Cl)cc(F)c1O)C[NH+]1CCCCC1 ZINC001461084056 1182765253 /nfs/dbraw/zinc/76/52/53/1182765253.db2.gz FGGRNXLIILPIKC-GFCCVEGCSA-N 2 2 314.832 3.396 20 10 DGCDLP CN(C)c1ccc(/C=C\C[NH+]2CCC(c3c[nH+]cn3C)CC2)cc1 ZINC001462666429 1182983394 /nfs/dbraw/zinc/98/33/94/1182983394.db2.gz KMTNCSZBWUPIQR-PLNGDYQASA-N 2 2 324.472 3.379 20 10 DGCDLP Cn1c[nH+]cc1C1CC[NH+](Cc2ccc(Cl)cc2O)CC1 ZINC001660238075 1196460867 /nfs/dbraw/zinc/46/08/67/1196460867.db2.gz GMPLMEZQMHCEST-UHFFFAOYSA-N 2 2 305.809 3.159 20 10 DGCDLP C[C@@H](C[NH2+]Cc1cc(Cl)cc(F)c1O)C[NH+]1CCCC1 ZINC001648832650 1081937769 /nfs/dbraw/zinc/93/77/69/1081937769.db2.gz GJDZCAULWREZIF-NSHDSACASA-N 2 2 300.805 3.006 20 10 DGCDLP Nc1ccc[nH+]c1N1CCCC2=C[C@H]3C[C@H](C[N@@H+]4CCCC[C@H]34)[C@@H]21 ZINC001155628735 1089193062 /nfs/dbraw/zinc/19/30/62/1089193062.db2.gz DYNXYLPLWYNAJG-QFHJOOASSA-N 2 2 324.472 3.063 20 10 DGCDLP Nc1ccc[nH+]c1N1CCCC2=C[C@H]3C[C@H](C[N@H+]4CCCC[C@H]34)[C@@H]21 ZINC001155628735 1089193068 /nfs/dbraw/zinc/19/30/68/1089193068.db2.gz DYNXYLPLWYNAJG-QFHJOOASSA-N 2 2 324.472 3.063 20 10 DGCDLP CCN(CC)c1ccc(C[N@@H+]2C[C@H]3CCC[NH+](C)[C@H]3C2)cc1 ZINC001203946853 1090848421 /nfs/dbraw/zinc/84/84/21/1090848421.db2.gz YHACHVVVABBPJI-MJGOQNOKSA-N 2 2 301.478 3.059 20 10 DGCDLP CCN(CC)c1ccc(C[N@H+]2C[C@H]3CCC[NH+](C)[C@H]3C2)cc1 ZINC001203946853 1090848427 /nfs/dbraw/zinc/84/84/27/1090848427.db2.gz YHACHVVVABBPJI-MJGOQNOKSA-N 2 2 301.478 3.059 20 10 DGCDLP CCN(CC)c1ccc(C[NH+]2C[C@H]3CCC[N@H+](C)[C@H]3C2)cc1 ZINC001203946853 1090848435 /nfs/dbraw/zinc/84/84/35/1090848435.db2.gz YHACHVVVABBPJI-MJGOQNOKSA-N 2 2 301.478 3.059 20 10 DGCDLP CCN(CC)c1ccc(C[NH+]2C[C@H]3CCC[N@@H+](C)[C@H]3C2)cc1 ZINC001203946853 1090848439 /nfs/dbraw/zinc/84/84/39/1090848439.db2.gz YHACHVVVABBPJI-MJGOQNOKSA-N 2 2 301.478 3.059 20 10 DGCDLP C[C@]1([NH3+])CCC[N@H+](Cc2cccc(C(F)(F)F)c2O)CC1 ZINC001205289392 1091167089 /nfs/dbraw/zinc/16/70/89/1091167089.db2.gz XOMKIRDRVNXIHN-AWEZNQCLSA-N 2 2 302.340 3.114 20 10 DGCDLP C[C@]1([NH3+])CCC[N@@H+](Cc2cccc(C(F)(F)F)c2O)CC1 ZINC001205289392 1091167095 /nfs/dbraw/zinc/16/70/95/1091167095.db2.gz XOMKIRDRVNXIHN-AWEZNQCLSA-N 2 2 302.340 3.114 20 10 DGCDLP C[C@@H]1CC[C@@H](C[NH3+])[N@H+](Cc2ccc3c(c2O)C=CC(C)(C)O3)C1 ZINC001205853336 1091379140 /nfs/dbraw/zinc/37/91/40/1091379140.db2.gz IAJDBOPJTLHIHW-HIFRSBDPSA-N 2 2 316.445 3.136 20 10 DGCDLP C[C@@H]1CC[C@@H](C[NH3+])[N@@H+](Cc2ccc3c(c2O)C=CC(C)(C)O3)C1 ZINC001205853336 1091379152 /nfs/dbraw/zinc/37/91/52/1091379152.db2.gz IAJDBOPJTLHIHW-HIFRSBDPSA-N 2 2 316.445 3.136 20 10 DGCDLP C[NH+]1CCN(c2ccc(C[N@@H+]3CCCCC(F)(F)C3)cc2)CC1 ZINC001139404528 1091548133 /nfs/dbraw/zinc/54/81/33/1091548133.db2.gz MRCNFOYLJWRIPE-UHFFFAOYSA-N 2 2 323.431 3.060 20 10 DGCDLP C[NH+]1CCN(c2ccc(C[N@H+]3CCCCC(F)(F)C3)cc2)CC1 ZINC001139404528 1091548144 /nfs/dbraw/zinc/54/81/44/1091548144.db2.gz MRCNFOYLJWRIPE-UHFFFAOYSA-N 2 2 323.431 3.060 20 10 DGCDLP C[C@H]1CC[C@@H](C[NH3+])C[N@H+]1Cc1c(O)ccc(Cl)c1Cl ZINC001206810558 1091748842 /nfs/dbraw/zinc/74/88/42/1091748842.db2.gz NYFFQMSYQRGLKF-UWVGGRQHSA-N 2 2 303.233 3.258 20 10 DGCDLP Oc1ccc(Cl)c(Cl)c1C[N@@H+]1CC[C@]2(C1)CCC[NH2+]C2 ZINC001222154741 1095463061 /nfs/dbraw/zinc/46/30/61/1095463061.db2.gz QCKOHOPLOPRVBZ-OAHLLOKOSA-N 2 2 315.244 3.275 20 10 DGCDLP Oc1ccc(Cl)c(Cl)c1C[N@H+]1CC[C@]2(C1)CCC[NH2+]C2 ZINC001222154741 1095463065 /nfs/dbraw/zinc/46/30/65/1095463065.db2.gz QCKOHOPLOPRVBZ-OAHLLOKOSA-N 2 2 315.244 3.275 20 10 DGCDLP CC[NH+]1CCC([N@H+](C)Cc2ccc(C(F)(F)F)cc2O)CC1 ZINC001233454354 1098340581 /nfs/dbraw/zinc/34/05/81/1098340581.db2.gz RJHHDJLOZBLFQN-UHFFFAOYSA-N 2 2 316.367 3.327 20 10 DGCDLP CC[NH+]1CCC([N@@H+](C)Cc2ccc(C(F)(F)F)cc2O)CC1 ZINC001233454354 1098340587 /nfs/dbraw/zinc/34/05/87/1098340587.db2.gz RJHHDJLOZBLFQN-UHFFFAOYSA-N 2 2 316.367 3.327 20 10 DGCDLP C[N@H+](Cc1cc(Cl)c(Cl)cc1O)[C@@H]1CCCC[C@H]1[NH3+] ZINC001236215019 1099472881 /nfs/dbraw/zinc/47/28/81/1099472881.db2.gz GZMPWERFYQSJSR-CHWSQXEVSA-N 2 2 303.233 3.401 20 10 DGCDLP C[N@@H+](Cc1cc(Cl)c(Cl)cc1O)[C@@H]1CCCC[C@H]1[NH3+] ZINC001236215019 1099472886 /nfs/dbraw/zinc/47/28/86/1099472886.db2.gz GZMPWERFYQSJSR-CHWSQXEVSA-N 2 2 303.233 3.401 20 10 DGCDLP CC(C)[N@H+](Cc1cc(C(F)(F)F)ccc1O)[C@@H]1CCC[NH2+]C1 ZINC001236470862 1099630233 /nfs/dbraw/zinc/63/02/33/1099630233.db2.gz RHAPSGDKBKJBBA-CQSZACIVSA-N 2 2 316.367 3.373 20 10 DGCDLP CC(C)[N@@H+](Cc1cc(C(F)(F)F)ccc1O)[C@@H]1CCC[NH2+]C1 ZINC001236470862 1099630237 /nfs/dbraw/zinc/63/02/37/1099630237.db2.gz RHAPSGDKBKJBBA-CQSZACIVSA-N 2 2 316.367 3.373 20 10 DGCDLP C[C@@]1(C[NH3+])CCC[N@H+](Cc2cc(Cl)c(Cl)cc2O)C1 ZINC001237083217 1099961934 /nfs/dbraw/zinc/96/19/34/1099961934.db2.gz XPLAJQZDROACPE-AWEZNQCLSA-N 2 2 303.233 3.260 20 10 DGCDLP C[C@@]1(C[NH3+])CCC[N@@H+](Cc2cc(Cl)c(Cl)cc2O)C1 ZINC001237083217 1099961945 /nfs/dbraw/zinc/96/19/45/1099961945.db2.gz XPLAJQZDROACPE-AWEZNQCLSA-N 2 2 303.233 3.260 20 10 DGCDLP COc1cc(Cl)cc(C[N@H+](C2CCC2)[C@H]2CCC[NH2+]C2)c1O ZINC001237156572 1100005014 /nfs/dbraw/zinc/00/50/14/1100005014.db2.gz ONRRAGQOMMXSFE-HNNXBMFYSA-N 2 2 324.852 3.161 20 10 DGCDLP COc1cc(Cl)cc(C[N@@H+](C2CCC2)[C@H]2CCC[NH2+]C2)c1O ZINC001237156572 1100005023 /nfs/dbraw/zinc/00/50/23/1100005023.db2.gz ONRRAGQOMMXSFE-HNNXBMFYSA-N 2 2 324.852 3.161 20 10 DGCDLP CCc1cccc(C[N@@H+]2CCC[C@H](Cc3[nH+]ccn3C)C2)c1O ZINC001261559659 1107465191 /nfs/dbraw/zinc/46/51/91/1107465191.db2.gz VFPFZZRWSXDZHQ-OAHLLOKOSA-N 2 2 313.445 3.143 20 10 DGCDLP CCc1cccc(C[N@H+]2CCC[C@H](Cc3[nH+]ccn3C)C2)c1O ZINC001261559659 1107465197 /nfs/dbraw/zinc/46/51/97/1107465197.db2.gz VFPFZZRWSXDZHQ-OAHLLOKOSA-N 2 2 313.445 3.143 20 10 DGCDLP CCc1cccc(C[NH+]2CCC(Nc3cccc[nH+]3)CC2)c1O ZINC001262374634 1107703255 /nfs/dbraw/zinc/70/32/55/1107703255.db2.gz LFUQKYBLISNANL-UHFFFAOYSA-N 2 2 311.429 3.426 20 10 DGCDLP CCN(C)c1ccc(C[NH+]2CCC(c3c[nH+]cn3C)CC2)cc1 ZINC001308167184 1111388912 /nfs/dbraw/zinc/38/89/12/1111388912.db2.gz OCLCZZVYVDRZQQ-UHFFFAOYSA-N 2 2 312.461 3.256 20 10 DGCDLP CC1CC[NH+](CCC[NH2+]Cc2cc(Cl)cc(F)c2O)CC1 ZINC001308184296 1111392750 /nfs/dbraw/zinc/39/27/50/1111392750.db2.gz DVMOXUMKYBQUOQ-UHFFFAOYSA-N 2 2 314.832 3.396 20 10 DGCDLP C[C@H]([NH2+]CCCCNc1cccc[nH+]1)c1ccc(F)cc1O ZINC000185325422 432490803 /nfs/dbraw/zinc/49/08/03/432490803.db2.gz MRJZNWAGKMBTNI-ZDUSSCGKSA-N 2 2 303.381 3.469 20 10 DGCDLP Cn1cc[nH+]c1[C@@H]1CCC[N@H+](Cc2cc(Cl)ccc2O)C1 ZINC000373230617 433137859 /nfs/dbraw/zinc/13/78/59/433137859.db2.gz NQUGLRLGNCMCIM-GFCCVEGCSA-N 2 2 305.809 3.159 20 10 DGCDLP Cn1cc[nH+]c1[C@@H]1CCC[N@@H+](Cc2cc(Cl)ccc2O)C1 ZINC000373230617 433137868 /nfs/dbraw/zinc/13/78/68/433137868.db2.gz NQUGLRLGNCMCIM-GFCCVEGCSA-N 2 2 305.809 3.159 20 10 DGCDLP Oc1cc(F)c(Cl)cc1C[N@@H+]1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000295374511 434331170 /nfs/dbraw/zinc/33/11/70/434331170.db2.gz OPOCFXSGHRVVQA-SNVBAGLBSA-N 2 2 309.772 3.287 20 10 DGCDLP Oc1cc(F)c(Cl)cc1C[N@H+]1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000295374511 434331178 /nfs/dbraw/zinc/33/11/78/434331178.db2.gz OPOCFXSGHRVVQA-SNVBAGLBSA-N 2 2 309.772 3.287 20 10 DGCDLP C[C@H]([NH2+]Cc1ccc(-n2cc[nH+]c2)nc1)c1ccc(N(C)C)cc1 ZINC000370670001 434615580 /nfs/dbraw/zinc/61/55/80/434615580.db2.gz UPENJIGDRSYCHO-HNNXBMFYSA-N 2 2 321.428 3.184 20 10 DGCDLP Oc1c(Cl)cccc1C[N@@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000180363398 526325401 /nfs/dbraw/zinc/32/54/01/526325401.db2.gz GYZIBCBBCWZYOV-OAHLLOKOSA-N 2 2 308.853 3.496 20 10 DGCDLP Oc1c(Cl)cccc1C[N@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000180363398 526325406 /nfs/dbraw/zinc/32/54/06/526325406.db2.gz GYZIBCBBCWZYOV-OAHLLOKOSA-N 2 2 308.853 3.496 20 10 DGCDLP CC[C@@H]([NH2+][C@@H]1C[NH2+]C[C@H]1C)c1ccc(C(F)(F)F)cc1O ZINC000925784390 618619527 /nfs/dbraw/zinc/61/95/27/618619527.db2.gz NDNVRQLQWMHCIV-OASPWFOLSA-N 2 2 302.340 3.060 20 10 DGCDLP CN(C)c1ccc(/C=C/C[NH+]2CCC([NH2+]C3CCC3)CC2)cc1 ZINC000897982938 619203142 /nfs/dbraw/zinc/20/31/42/619203142.db2.gz RZDFJJKGWWVIRC-SNAWJCMRSA-N 2 2 313.489 3.372 20 10 DGCDLP C[C@@H]1[NH2+]CCC[C@@H]1[NH2+]Cc1ccc(N(C)C)cc1C(F)(F)F ZINC000841062776 619250174 /nfs/dbraw/zinc/25/01/74/619250174.db2.gz FHUBJJAYWYLIQA-NHYWBVRUSA-N 2 2 315.383 3.002 20 10 DGCDLP c1cn(-c2ccc(C[NH2+]Cc3ccc4c(c3)CCCO4)cc2)c[nH+]1 ZINC000921603383 620913176 /nfs/dbraw/zinc/91/31/76/620913176.db2.gz GMPKNNMOLPUJGV-UHFFFAOYSA-N 2 2 319.408 3.487 20 10 DGCDLP COc1cccc([C@H](C)[NH2+]C[C@H]2CC[N@@H+]2C2CCCC2)c1O ZINC000858531720 621202153 /nfs/dbraw/zinc/20/21/53/621202153.db2.gz JLUUDQDWUBRQFY-DZGCQCFKSA-N 2 2 304.434 3.068 20 10 DGCDLP COc1cccc([C@H](C)[NH2+]C[C@H]2CC[N@H+]2C2CCCC2)c1O ZINC000858531720 621202155 /nfs/dbraw/zinc/20/21/55/621202155.db2.gz JLUUDQDWUBRQFY-DZGCQCFKSA-N 2 2 304.434 3.068 20 10 DGCDLP Oc1c(Cl)cccc1C[NH2+][C@H]1CCCCC12CC[NH2+]CC2 ZINC000873232624 623085236 /nfs/dbraw/zinc/08/52/36/623085236.db2.gz JEVICFLSOZGGLP-HNNXBMFYSA-N 2 2 308.853 3.448 20 10 DGCDLP Cc1[nH+]ccn1C[C@H](C)C[NH2+]Cc1cc(Cl)cc(F)c1O ZINC000775905164 623348618 /nfs/dbraw/zinc/34/86/18/623348618.db2.gz HXDZERJLUNULSZ-SNVBAGLBSA-N 2 2 311.788 3.116 20 10 DGCDLP C[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2Cc2c(O)ccc(Cl)c2F)C1 ZINC000809767489 626949574 /nfs/dbraw/zinc/94/95/74/626949574.db2.gz MTDJHSJZKAGEMF-BXUZGUMPSA-N 2 2 312.816 3.101 20 10 DGCDLP C[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2Cc2c(O)ccc(Cl)c2F)C1 ZINC000809767489 626949577 /nfs/dbraw/zinc/94/95/77/626949577.db2.gz MTDJHSJZKAGEMF-BXUZGUMPSA-N 2 2 312.816 3.101 20 10 DGCDLP C[NH+]1CC[C@@H]2[C@H](CCC[N@@H+]2Cc2c(O)ccc(Cl)c2F)C1 ZINC000809767489 626949583 /nfs/dbraw/zinc/94/95/83/626949583.db2.gz MTDJHSJZKAGEMF-BXUZGUMPSA-N 2 2 312.816 3.101 20 10 DGCDLP C[NH+]1CC[C@@H]2[C@H](CCC[N@H+]2Cc2c(O)ccc(Cl)c2F)C1 ZINC000809767489 626949587 /nfs/dbraw/zinc/94/95/87/626949587.db2.gz MTDJHSJZKAGEMF-BXUZGUMPSA-N 2 2 312.816 3.101 20 10 DGCDLP Oc1ccc(F)cc1C[NH2+]Cc1ccccc1Cn1cc[nH+]c1 ZINC000809793885 626955109 /nfs/dbraw/zinc/95/51/09/626955109.db2.gz QTERKOLUPVYPFX-UHFFFAOYSA-N 2 2 311.360 3.066 20 10 DGCDLP C[N@@H+]1CCC[C@@H]2C[NH+](Cc3cc(Cl)c(F)cc3O)CC[C@H]21 ZINC000816521529 627801172 /nfs/dbraw/zinc/80/11/72/627801172.db2.gz ROVSMCVWMRVMPK-IAQYHMDHSA-N 2 2 312.816 3.101 20 10 DGCDLP C[N@H+]1CCC[C@@H]2C[NH+](Cc3cc(Cl)c(F)cc3O)CC[C@H]21 ZINC000816521529 627801175 /nfs/dbraw/zinc/80/11/75/627801175.db2.gz ROVSMCVWMRVMPK-IAQYHMDHSA-N 2 2 312.816 3.101 20 10 DGCDLP CC(C)[N@@H+]1CCC[C@H](C[NH2+]Cc2cc(Cl)c(F)cc2O)C1 ZINC000816548365 627806179 /nfs/dbraw/zinc/80/61/79/627806179.db2.gz FLWQCTCVCVGBEW-GFCCVEGCSA-N 2 2 314.832 3.395 20 10 DGCDLP CC(C)[N@H+]1CCC[C@H](C[NH2+]Cc2cc(Cl)c(F)cc2O)C1 ZINC000816548365 627806181 /nfs/dbraw/zinc/80/61/81/627806181.db2.gz FLWQCTCVCVGBEW-GFCCVEGCSA-N 2 2 314.832 3.395 20 10 DGCDLP COc1cccc([C@@H](C)[NH2+]C[C@H]([NH3+])c2ccc(N(C)C)cc2)c1 ZINC000817939034 627967758 /nfs/dbraw/zinc/96/77/58/627967758.db2.gz XZISWMMIWWMLIE-KUHUBIRLSA-N 2 2 313.445 3.112 20 10 DGCDLP CC[C@@H]([NH2+][C@@H]1CCC[NH2+]C1)c1ccc(C(F)(F)F)cc1O ZINC000817941892 627968320 /nfs/dbraw/zinc/96/83/20/627968320.db2.gz SVYIAVYWXXFMHL-DGCLKSJQSA-N 2 2 302.340 3.204 20 10 DGCDLP CC[C@H]([NH2+]CCC[NH2+]Cc1cccnc1)c1ccc(F)cc1O ZINC000817942027 627968424 /nfs/dbraw/zinc/96/84/24/627968424.db2.gz XBNRZFGILVDEAG-KRWDZBQOSA-N 2 2 317.408 3.147 20 10 DGCDLP CCC[C@@H]([NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1)c1cccnc1 ZINC000817942911 627969593 /nfs/dbraw/zinc/96/95/93/627969593.db2.gz RMZKZJRKYOUDFF-RBUKOAKNSA-N 2 2 312.461 3.278 20 10 DGCDLP C[C@@H]1C[C@H]([NH2+]C[C@@H]([NH3+])c2ccccc2)c2c1c(F)ccc2O ZINC000817954046 627973228 /nfs/dbraw/zinc/97/32/28/627973228.db2.gz AQXNPEUONVZDKW-DFBGVHRSSA-N 2 2 300.377 3.369 20 10 DGCDLP C[C@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)c1cc(F)cc(F)c1O ZINC000817967666 627977852 /nfs/dbraw/zinc/97/78/52/627977852.db2.gz AGXAPKNRHYPUNV-JTQLQIEISA-N 2 2 304.340 3.124 20 10 DGCDLP C[C@H]([NH2+][C@H]1C[NH2+]CC[C@@H]1C)c1ccc(N2CCCCC2)cc1 ZINC000817968056 627978647 /nfs/dbraw/zinc/97/86/47/627978647.db2.gz NXOALRWHXLIBRV-BXWFABGCSA-N 2 2 301.478 3.326 20 10 DGCDLP CN(C)c1ccc(/C=C\C[NH2+]C(C)(C)C[NH+]2CCCC2)cc1 ZINC000835054884 629838672 /nfs/dbraw/zinc/83/86/72/629838672.db2.gz MQOYRMLTKRFXGQ-FPLPWBNLSA-N 2 2 301.478 3.230 20 10 DGCDLP Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@H]1C[C@@H](C)[N@@H+](C2CC2)C1 ZINC000840893389 630373985 /nfs/dbraw/zinc/37/39/85/630373985.db2.gz IYDKLYWBNNTDJG-JZXOWHBKSA-N 2 2 315.505 3.207 20 10 DGCDLP Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@H]1C[C@@H](C)[N@H+](C2CC2)C1 ZINC000840893389 630373987 /nfs/dbraw/zinc/37/39/87/630373987.db2.gz IYDKLYWBNNTDJG-JZXOWHBKSA-N 2 2 315.505 3.207 20 10 DGCDLP [NH3+]C1(C[NH2+]Cc2cc(Cl)cc(F)c2O)CCCCCC1 ZINC000841044138 630401196 /nfs/dbraw/zinc/40/11/96/630401196.db2.gz WPABQWJUIRLGPI-UHFFFAOYSA-N 2 2 300.805 3.326 20 10 DGCDLP C[C@H](Cc1ccsc1)[NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000841044732 630401231 /nfs/dbraw/zinc/40/12/31/630401231.db2.gz FKMSMFDWWMHEBS-CXAGYDPISA-N 2 2 303.475 3.035 20 10 DGCDLP c1cc(N2CCCC2)ccc1C[NH2+][C@@H]1CCC[N@@H+]2CCCC[C@@H]12 ZINC000848575880 631701056 /nfs/dbraw/zinc/70/10/56/631701056.db2.gz XMVZTKJLJUCHBS-UXHICEINSA-N 2 2 313.489 3.393 20 10 DGCDLP c1cc(N2CCCC2)ccc1C[NH2+][C@@H]1CCC[N@H+]2CCCC[C@@H]12 ZINC000848575880 631701059 /nfs/dbraw/zinc/70/10/59/631701059.db2.gz XMVZTKJLJUCHBS-UXHICEINSA-N 2 2 313.489 3.393 20 10 DGCDLP C[C@@H]([NH2+]CCCCNc1cccc[nH+]1)c1cc(F)ccc1O ZINC000185325989 660216038 /nfs/dbraw/zinc/21/60/38/660216038.db2.gz SPNUXJLRXUXGCH-CYBMUJFWSA-N 2 2 303.381 3.469 20 10 DGCDLP C[C@H]([NH2+]CCCCNc1cccc[nH+]1)c1cc(F)ccc1O ZINC000185325973 656125558 /nfs/dbraw/zinc/12/55/58/656125558.db2.gz SPNUXJLRXUXGCH-ZDUSSCGKSA-N 2 2 303.381 3.469 20 10 DGCDLP CCN(CC)c1ccc(C[NH2+]C[C@H](C)Cn2cc[nH+]c2)cc1 ZINC000067500720 657586516 /nfs/dbraw/zinc/58/65/16/657586516.db2.gz BOPMCXGCIFKKLT-INIZCTEOSA-N 2 2 300.450 3.155 20 10 DGCDLP Cc1ccc(O)c2c1[C@@H](C)C[C@H]2[NH2+]Cc1cc(N(C)C)cc[nH+]1 ZINC001331995173 1178332621 /nfs/dbraw/zinc/33/26/21/1178332621.db2.gz BNRCRKQYIVRKHD-XJKSGUPXSA-N 2 2 311.429 3.500 20 10 DGCDLP C[C@@H]([NH2+]Cc1cc(F)c(F)cc1O)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC001474435229 1183922338 /nfs/dbraw/zinc/92/23/38/1183922338.db2.gz BPTWHYDWBVUBFO-OLZOCXBDSA-N 2 2 324.415 3.413 20 10 DGCDLP C[C@@H]([NH2+]Cc1cc(F)c(F)cc1O)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC001474435229 1183922341 /nfs/dbraw/zinc/92/23/41/1183922341.db2.gz BPTWHYDWBVUBFO-OLZOCXBDSA-N 2 2 324.415 3.413 20 10 DGCDLP CCN(CC)c1ccc(C[NH2+][C@H]2CC[N@@H+]3CCCC[C@H]23)cc1F ZINC001560271561 1189303548 /nfs/dbraw/zinc/30/35/48/1189303548.db2.gz PKEYFUQBOMKIAV-PKOBYXMFSA-N 2 2 319.468 3.388 20 10 DGCDLP CCN(CC)c1ccc(C[NH2+][C@H]2CC[N@H+]3CCCC[C@H]23)cc1F ZINC001560271561 1189303552 /nfs/dbraw/zinc/30/35/52/1189303552.db2.gz PKEYFUQBOMKIAV-PKOBYXMFSA-N 2 2 319.468 3.388 20 10 DGCDLP CC(C)C[C@@H](C[NH+](C)C)[NH2+]C/C=C\c1ccc(N(C)C)cc1 ZINC001560612051 1189348254 /nfs/dbraw/zinc/34/82/54/1189348254.db2.gz VHCWHTIPSXRPRD-ZEVQVBBLSA-N 2 2 303.494 3.332 20 10 DGCDLP Cn1cc[nH+]c1C[C@H]1CCC[N@H+](Cc2ccc(Cl)cc2O)C1 ZINC001652177062 1195557256 /nfs/dbraw/zinc/55/72/56/1195557256.db2.gz OISZTHIDOBRXBG-CYBMUJFWSA-N 2 2 319.836 3.234 20 10 DGCDLP Cn1cc[nH+]c1C[C@H]1CCC[N@@H+](Cc2ccc(Cl)cc2O)C1 ZINC001652177062 1195557258 /nfs/dbraw/zinc/55/72/58/1195557258.db2.gz OISZTHIDOBRXBG-CYBMUJFWSA-N 2 2 319.836 3.234 20 10 DGCDLP Cc1cc(NCc2ccc(N3CC[NH+](C)CC3)cc2)c[nH+]c1C ZINC001167434504 1082114176 /nfs/dbraw/zinc/11/41/76/1082114176.db2.gz NFAZJCQOZGMOKL-UHFFFAOYSA-N 2 2 310.445 3.062 20 10 DGCDLP C[C@H]1[C@@H](C[NH3+])CCC[N@@H+]1Cc1cc(Cl)c(Cl)cc1O ZINC001205912749 1091407513 /nfs/dbraw/zinc/40/75/13/1091407513.db2.gz BYDKIBXPMFETHV-VHSXEESVSA-N 2 2 303.233 3.258 20 10 DGCDLP C[C@H]1[C@@H](C[NH3+])CCC[N@H+]1Cc1cc(Cl)c(Cl)cc1O ZINC001205912749 1091407518 /nfs/dbraw/zinc/40/75/18/1091407518.db2.gz BYDKIBXPMFETHV-VHSXEESVSA-N 2 2 303.233 3.258 20 10 DGCDLP [NH3+]C[C@@H]1CCCC[N@H+](Cc2cc(Cl)c(Cl)cc2O)C1 ZINC001206641425 1092901433 /nfs/dbraw/zinc/90/14/33/1092901433.db2.gz XDPZJTQPRLZDJR-JTQLQIEISA-N 2 2 303.233 3.260 20 10 DGCDLP [NH3+]C[C@@H]1CCCC[N@@H+](Cc2cc(Cl)c(Cl)cc2O)C1 ZINC001206641425 1092901448 /nfs/dbraw/zinc/90/14/48/1092901448.db2.gz XDPZJTQPRLZDJR-JTQLQIEISA-N 2 2 303.233 3.260 20 10 DGCDLP Oc1cc(Cl)c(Cl)cc1C[N@@H+]1CC[C@@]2(C1)CCC[NH2+]C2 ZINC001222154417 1095460380 /nfs/dbraw/zinc/46/03/80/1095460380.db2.gz LGDHGEYSGUPMTD-HNNXBMFYSA-N 2 2 315.244 3.275 20 10 DGCDLP Oc1cc(Cl)c(Cl)cc1C[N@H+]1CC[C@@]2(C1)CCC[NH2+]C2 ZINC001222154417 1095460392 /nfs/dbraw/zinc/46/03/92/1095460392.db2.gz LGDHGEYSGUPMTD-HNNXBMFYSA-N 2 2 315.244 3.275 20 10 DGCDLP Oc1cccc(F)c1C[NH+]1CCC2(CCC[N@@H+]2CC2CC2)CC1 ZINC001137834941 1095756742 /nfs/dbraw/zinc/75/67/42/1095756742.db2.gz ZZGZVKBSKFQSLQ-UHFFFAOYSA-N 2 2 318.436 3.372 20 10 DGCDLP Oc1cccc(F)c1C[NH+]1CCC2(CCC[N@H+]2CC2CC2)CC1 ZINC001137834941 1095756753 /nfs/dbraw/zinc/75/67/53/1095756753.db2.gz ZZGZVKBSKFQSLQ-UHFFFAOYSA-N 2 2 318.436 3.372 20 10 DGCDLP Oc1cccc(F)c1C[N@@H+]1CCCC[C@@H]1CC[NH+]1CCCC1 ZINC001137837813 1095758650 /nfs/dbraw/zinc/75/86/50/1095758650.db2.gz VRAMWDOLAONRPT-OAHLLOKOSA-N 2 2 306.425 3.372 20 10 DGCDLP Oc1cccc(F)c1C[N@H+]1CCCC[C@@H]1CC[NH+]1CCCC1 ZINC001137837813 1095758669 /nfs/dbraw/zinc/75/86/69/1095758669.db2.gz VRAMWDOLAONRPT-OAHLLOKOSA-N 2 2 306.425 3.372 20 10 DGCDLP c1cc(N2CCCC2)ccc1C[NH2+]C[C@H]1CC[N@@H+]1C1CCCC1 ZINC001118805951 1096080956 /nfs/dbraw/zinc/08/09/56/1096080956.db2.gz MDVFDRMNHYTYRK-HXUWFJFHSA-N 2 2 313.489 3.393 20 10 DGCDLP c1cc(N2CCCC2)ccc1C[NH2+]C[C@H]1CC[N@H+]1C1CCCC1 ZINC001118805951 1096080967 /nfs/dbraw/zinc/08/09/67/1096080967.db2.gz MDVFDRMNHYTYRK-HXUWFJFHSA-N 2 2 313.489 3.393 20 10 DGCDLP Cc1cc(C[N@@H+]2CC[C@@H]3C[NH2+]C[C@@H]3C2)c(C)n1-c1ccccc1 ZINC001235193448 1098870952 /nfs/dbraw/zinc/87/09/52/1098870952.db2.gz LTKXIIOTKJSOHR-IEBWSBKVSA-N 2 2 309.457 3.135 20 10 DGCDLP Cc1cc(C[N@H+]2CC[C@@H]3C[NH2+]C[C@@H]3C2)c(C)n1-c1ccccc1 ZINC001235193448 1098870957 /nfs/dbraw/zinc/87/09/57/1098870957.db2.gz LTKXIIOTKJSOHR-IEBWSBKVSA-N 2 2 309.457 3.135 20 10 DGCDLP C[N@@H+]1CCC[C@H]2C[NH+](Cc3ccc(C(C)(C)C)cc3O)C[C@@H]21 ZINC001235678091 1099121724 /nfs/dbraw/zinc/12/17/24/1099121724.db2.gz ADYPRGVBONWUPI-YOEHRIQHSA-N 2 2 302.462 3.216 20 10 DGCDLP C[N@H+]1CCC[C@H]2C[NH+](Cc3ccc(C(C)(C)C)cc3O)C[C@@H]21 ZINC001235678091 1099121732 /nfs/dbraw/zinc/12/17/32/1099121732.db2.gz ADYPRGVBONWUPI-YOEHRIQHSA-N 2 2 302.462 3.216 20 10 DGCDLP C[NH+]1CCC[C@H]2C[N@H+](Cc3ccc(C(C)(C)C)cc3O)C[C@@H]21 ZINC001235678091 1099121738 /nfs/dbraw/zinc/12/17/38/1099121738.db2.gz ADYPRGVBONWUPI-YOEHRIQHSA-N 2 2 302.462 3.216 20 10 DGCDLP C[NH+]1CCC[C@H]2C[N@@H+](Cc3ccc(C(C)(C)C)cc3O)C[C@@H]21 ZINC001235678091 1099121741 /nfs/dbraw/zinc/12/17/41/1099121741.db2.gz ADYPRGVBONWUPI-YOEHRIQHSA-N 2 2 302.462 3.216 20 10 DGCDLP CC[NH2+]C1CC[NH+](Cc2ccc(N(CC)CC)cc2OC)CC1 ZINC001235726949 1099149468 /nfs/dbraw/zinc/14/94/68/1099149468.db2.gz SENUAKBKXGINJR-UHFFFAOYSA-N 2 2 319.493 3.115 20 10 DGCDLP C[N@H+](Cc1ccc(N2CCCCC2)cc1)[C@]1(C)CCC[NH2+]C1 ZINC001236207162 1099463792 /nfs/dbraw/zinc/46/37/92/1099463792.db2.gz MQQMQAPSDDQPPX-LJQANCHMSA-N 2 2 301.478 3.251 20 10 DGCDLP C[N@@H+](Cc1ccc(N2CCCCC2)cc1)[C@]1(C)CCC[NH2+]C1 ZINC001236207162 1099463799 /nfs/dbraw/zinc/46/37/99/1099463799.db2.gz MQQMQAPSDDQPPX-LJQANCHMSA-N 2 2 301.478 3.251 20 10 DGCDLP Oc1c(F)cccc1C[N@H+](C[C@@H]1CCC[NH2+]C1)C1CCCC1 ZINC001236372737 1099558180 /nfs/dbraw/zinc/55/81/80/1099558180.db2.gz DGOLJMRYLVFNHN-CQSZACIVSA-N 2 2 306.425 3.276 20 10 DGCDLP Oc1c(F)cccc1C[N@@H+](C[C@@H]1CCC[NH2+]C1)C1CCCC1 ZINC001236372737 1099558188 /nfs/dbraw/zinc/55/81/88/1099558188.db2.gz DGOLJMRYLVFNHN-CQSZACIVSA-N 2 2 306.425 3.276 20 10 DGCDLP Cc1cc(O)c(C[N@H+](C2CCC2)[C@H]2CCC[NH2+]C2)cc1Cl ZINC001237157721 1100007138 /nfs/dbraw/zinc/00/71/38/1100007138.db2.gz VMUQVRDXXAMVBV-HNNXBMFYSA-N 2 2 308.853 3.461 20 10 DGCDLP Cc1cc(O)c(C[N@@H+](C2CCC2)[C@H]2CCC[NH2+]C2)cc1Cl ZINC001237157721 1100007142 /nfs/dbraw/zinc/00/71/42/1100007142.db2.gz VMUQVRDXXAMVBV-HNNXBMFYSA-N 2 2 308.853 3.461 20 10 DGCDLP Cc1cc(Cl)cc(C[N@H+](C2CCC2)[C@@H]2CCC[NH2+]C2)c1O ZINC001237161361 1100008749 /nfs/dbraw/zinc/00/87/49/1100008749.db2.gz OMNJRCWIEWMVNU-MRXNPFEDSA-N 2 2 308.853 3.461 20 10 DGCDLP Cc1cc(Cl)cc(C[N@@H+](C2CCC2)[C@@H]2CCC[NH2+]C2)c1O ZINC001237161361 1100008757 /nfs/dbraw/zinc/00/87/57/1100008757.db2.gz OMNJRCWIEWMVNU-MRXNPFEDSA-N 2 2 308.853 3.461 20 10 DGCDLP [NH3+][C@@H]1C[N@H+](Cc2ccc(N3CCCC3)cc2)C[C@H]1c1ccccc1 ZINC001326517589 1103352936 /nfs/dbraw/zinc/35/29/36/1103352936.db2.gz HFNOKPDLSNLELS-LEWJYISDSA-N 2 2 321.468 3.214 20 10 DGCDLP [NH3+][C@@H]1C[N@@H+](Cc2ccc(N3CCCC3)cc2)C[C@H]1c1ccccc1 ZINC001326517589 1103352951 /nfs/dbraw/zinc/35/29/51/1103352951.db2.gz HFNOKPDLSNLELS-LEWJYISDSA-N 2 2 321.468 3.214 20 10 DGCDLP Oc1ccc(F)cc1C[N@@H+]1CCCC2(C[NH+](C3CCCC3)C2)C1 ZINC001275912631 1104952663 /nfs/dbraw/zinc/95/26/63/1104952663.db2.gz DLDVEAPWTHZFGH-UHFFFAOYSA-N 2 2 318.436 3.372 20 10 DGCDLP Oc1ccc(F)cc1C[N@H+]1CCCC2(C[NH+](C3CCCC3)C2)C1 ZINC001275912631 1104952671 /nfs/dbraw/zinc/95/26/71/1104952671.db2.gz DLDVEAPWTHZFGH-UHFFFAOYSA-N 2 2 318.436 3.372 20 10 DGCDLP C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccc(N(C)C)cc1Cl ZINC001276155828 1105032872 /nfs/dbraw/zinc/03/28/72/1105032872.db2.gz KPBPHRYGXRQRIE-VHRNVKJDSA-N 2 2 307.869 3.121 20 10 DGCDLP C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccc(N(C)C)cc1Cl ZINC001276155828 1105032878 /nfs/dbraw/zinc/03/28/78/1105032878.db2.gz KPBPHRYGXRQRIE-VHRNVKJDSA-N 2 2 307.869 3.121 20 10 DGCDLP C[C@H](CC[NH+](C)C)[NH2+][C@H](C)c1ccc(Br)cc1O ZINC000273560497 130136848 /nfs/dbraw/zinc/13/68/48/130136848.db2.gz IARBIMPISYMTLC-GHMZBOCLSA-N 2 2 315.255 3.146 20 10 DGCDLP CC[C@H]([NH2+]C[C@H](C)Cn1cc[nH+]c1C)c1ccc(F)cc1O ZINC000286277439 131228033 /nfs/dbraw/zinc/22/80/33/131228033.db2.gz VPBYOVMTPDWHKJ-LRDDRELGSA-N 2 2 305.397 3.413 20 10 DGCDLP CN(C)c1ccc(C[NH2+]Cc2ccccc2Cn2cc[nH+]c2)cc1 ZINC000030651674 400331359 /nfs/dbraw/zinc/33/13/59/400331359.db2.gz BPONYXQUKFKWOO-UHFFFAOYSA-N 2 2 320.440 3.287 20 10 DGCDLP C[C@@H]1CC[N@H+](Cc2c(O)cccc2Cl)C[C@H]1n1cc[nH+]c1 ZINC000271228099 432357604 /nfs/dbraw/zinc/35/76/04/432357604.db2.gz BFMFKLMMCFFXLN-IUODEOHRSA-N 2 2 305.809 3.325 20 10 DGCDLP C[C@@H]1CC[N@@H+](Cc2c(O)cccc2Cl)C[C@H]1n1cc[nH+]c1 ZINC000271228099 432357608 /nfs/dbraw/zinc/35/76/08/432357608.db2.gz BFMFKLMMCFFXLN-IUODEOHRSA-N 2 2 305.809 3.325 20 10 DGCDLP C[C@@H]1CC[N@H+](Cc2ccc(N(C)C)c(F)c2)C[C@H]1n1cc[nH+]c1 ZINC000271265736 432365180 /nfs/dbraw/zinc/36/51/80/432365180.db2.gz LTOQGRRFMNFXFV-RDTXWAMCSA-N 2 2 316.424 3.171 20 10 DGCDLP C[C@@H]1CC[N@@H+](Cc2ccc(N(C)C)c(F)c2)C[C@H]1n1cc[nH+]c1 ZINC000271265736 432365182 /nfs/dbraw/zinc/36/51/82/432365182.db2.gz LTOQGRRFMNFXFV-RDTXWAMCSA-N 2 2 316.424 3.171 20 10 DGCDLP C[C@H]([NH2+]Cc1c[nH+]c2n1CCCC2)c1cc(Cl)ccc1O ZINC000375273257 433407554 /nfs/dbraw/zinc/40/75/54/433407554.db2.gz YUNKWZLMLPCCGJ-NSHDSACASA-N 2 2 305.809 3.429 20 10 DGCDLP C[C@H]1CC[N@H+](Cc2cc(Cl)c(F)cc2O)C[C@H]1n1cc[nH+]c1 ZINC000294434617 434111968 /nfs/dbraw/zinc/11/19/68/434111968.db2.gz XNEGPKNLIXEQKY-XHDPSFHLSA-N 2 2 323.799 3.464 20 10 DGCDLP C[C@H]1CC[N@@H+](Cc2cc(Cl)c(F)cc2O)C[C@H]1n1cc[nH+]c1 ZINC000294434617 434111976 /nfs/dbraw/zinc/11/19/76/434111976.db2.gz XNEGPKNLIXEQKY-XHDPSFHLSA-N 2 2 323.799 3.464 20 10 DGCDLP c1[nH+]c2n(c1C[NH2+]Cc1ccc(N3CCCCC3)cc1)CCCC2 ZINC000370263248 434609075 /nfs/dbraw/zinc/60/90/75/434609075.db2.gz VZRAQMVWRJJAEA-UHFFFAOYSA-N 2 2 324.472 3.500 20 10 DGCDLP CC[NH+]1CCC(CC[NH2+][C@H](C)c2ccc(F)c(F)c2O)CC1 ZINC000187736132 333236827 /nfs/dbraw/zinc/23/68/27/333236827.db2.gz DEFHWJSQGGBNAS-GFCCVEGCSA-N 2 2 312.404 3.443 20 10 DGCDLP C[N@H+](CCCn1cc[nH+]c1)Cc1ccc(N2CCCCC2)cc1 ZINC000182668252 522802027 /nfs/dbraw/zinc/80/20/27/522802027.db2.gz BDZJBERRRAECDN-UHFFFAOYSA-N 2 2 312.461 3.396 20 10 DGCDLP C[N@@H+](CCCn1cc[nH+]c1)Cc1ccc(N2CCCCC2)cc1 ZINC000182668252 522802038 /nfs/dbraw/zinc/80/20/38/522802038.db2.gz BDZJBERRRAECDN-UHFFFAOYSA-N 2 2 312.461 3.396 20 10 DGCDLP C[C@H]([NH2+]CC12CC(C1)C[NH2+]2)c1ccc(N2CCCCC2)c(F)c1 ZINC000854228496 620786634 /nfs/dbraw/zinc/78/66/34/620786634.db2.gz XIBQRINYXTYEBN-XVTSOASTSA-N 2 2 317.452 3.219 20 10 DGCDLP c1csc(SCCC[NH2+][C@H]2CCC[N@@H+]3CCCC[C@@H]23)n1 ZINC000925102150 618505744 /nfs/dbraw/zinc/50/57/44/618505744.db2.gz LMRJYJARLVUHTB-KBPBESRZSA-N 2 2 311.520 3.232 20 10 DGCDLP c1csc(SCCC[NH2+][C@H]2CCC[N@H+]3CCCC[C@@H]23)n1 ZINC000925102150 618505746 /nfs/dbraw/zinc/50/57/46/618505746.db2.gz LMRJYJARLVUHTB-KBPBESRZSA-N 2 2 311.520 3.232 20 10 DGCDLP CCO[C@H](C[NH2+][C@H](CC)c1cc(Cl)ccc1O)C[NH+](C)C ZINC000926959557 619252704 /nfs/dbraw/zinc/25/27/04/619252704.db2.gz JRQQXARSCDCGCF-UKRRQHHQSA-N 2 2 314.857 3.053 20 10 DGCDLP Cc1ccc(O)c([C@@H](C)[NH2+][C@@H](CC[NH+](C)C)c2cccnc2)c1 ZINC000903378469 619768490 /nfs/dbraw/zinc/76/84/90/619768490.db2.gz CJPAQOLGAMFNJI-QAPCUYQASA-N 2 2 313.445 3.439 20 10 DGCDLP Cc1cc(O)c(C[NH2+][C@H](CC[NH+](C)C)c2cccnc2)cc1C ZINC000922628837 621069548 /nfs/dbraw/zinc/06/95/48/621069548.db2.gz URRURQAZZUKDQY-GOSISDBHSA-N 2 2 313.445 3.187 20 10 DGCDLP Cc1cc(N(C)C)ccc1C[NH2+]C[C@@H]1CC[N@@H+]1C1CCCC1 ZINC000862522836 621596331 /nfs/dbraw/zinc/59/63/31/621596331.db2.gz IVQRLKZJBZAJFZ-IBGZPJMESA-N 2 2 301.478 3.168 20 10 DGCDLP Cc1cc(N(C)C)ccc1C[NH2+]C[C@@H]1CC[N@H+]1C1CCCC1 ZINC000862522836 621596332 /nfs/dbraw/zinc/59/63/32/621596332.db2.gz IVQRLKZJBZAJFZ-IBGZPJMESA-N 2 2 301.478 3.168 20 10 DGCDLP CCN(CC)c1ccc(C[NH2+][C@@H]2CC[NH2+]C23CCC3)cc1F ZINC000863483289 621677356 /nfs/dbraw/zinc/67/73/56/621677356.db2.gz USAXMLZRMMLMIS-QGZVFWFLSA-N 2 2 305.441 3.046 20 10 DGCDLP C[C@@H]([NH2+][C@H]1CC[C@@H](C)[NH2+]C1)c1ccc(N2CCCCC2)cc1 ZINC000863545396 621682556 /nfs/dbraw/zinc/68/25/56/621682556.db2.gz QRLUIVGEWXFPEZ-NUJGCVRESA-N 2 2 301.478 3.468 20 10 DGCDLP C[NH+]1CCC2(CCC[N@@H+]2Cc2cc(Cl)cc(F)c2O)CC1 ZINC000789559848 625526260 /nfs/dbraw/zinc/52/62/60/625526260.db2.gz YMAHEPWESQVZEE-UHFFFAOYSA-N 2 2 312.816 3.245 20 10 DGCDLP C[NH+]1CCC2(CCC[N@H+]2Cc2cc(Cl)cc(F)c2O)CC1 ZINC000789559848 625526264 /nfs/dbraw/zinc/52/62/64/625526264.db2.gz YMAHEPWESQVZEE-UHFFFAOYSA-N 2 2 312.816 3.245 20 10 DGCDLP C[C@@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1cc(F)cc(F)c1O ZINC000774498025 623151789 /nfs/dbraw/zinc/15/17/89/623151789.db2.gz PVWYOWUOVUFYMB-LLVKDONJSA-N 2 2 310.388 3.195 20 10 DGCDLP C[C@@H]([NH2+][C@H]1CCn2cc[nH+]c2C1)c1cc2c(cc1O)CCCC2 ZINC000779065650 623726639 /nfs/dbraw/zinc/72/66/39/623726639.db2.gz NIIHTIUEYCAFNR-CJNGLKHVSA-N 2 2 311.429 3.133 20 10 DGCDLP C[C@H]([NH2+]Cc1cc(F)cc(F)c1O)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000883085168 625922081 /nfs/dbraw/zinc/92/20/81/625922081.db2.gz KGOKKKSHFVCPSP-QWHCGFSZSA-N 2 2 324.415 3.413 20 10 DGCDLP C[C@H]([NH2+]Cc1cc(F)cc(F)c1O)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000883085168 625922082 /nfs/dbraw/zinc/92/20/82/625922082.db2.gz KGOKKKSHFVCPSP-QWHCGFSZSA-N 2 2 324.415 3.413 20 10 DGCDLP Oc1cccc(Cl)c1C[N@@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000131165488 625958902 /nfs/dbraw/zinc/95/89/02/625958902.db2.gz OCLUALDBOSNEFW-CQSZACIVSA-N 2 2 308.853 3.353 20 10 DGCDLP Oc1cccc(Cl)c1C[N@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000131165488 625958908 /nfs/dbraw/zinc/95/89/08/625958908.db2.gz OCLUALDBOSNEFW-CQSZACIVSA-N 2 2 308.853 3.353 20 10 DGCDLP C[C@@H]([NH2+]Cc1ncc(C[NH+](C)C)s1)c1ccc(N(C)C)cc1 ZINC000796351074 626041503 /nfs/dbraw/zinc/04/15/03/626041503.db2.gz DUXCMCRKKYHGIO-CYBMUJFWSA-N 2 2 318.490 3.122 20 10 DGCDLP CC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)c2cccc(C(F)(F)F)c2O)C1 ZINC000815560715 627684894 /nfs/dbraw/zinc/68/48/94/627684894.db2.gz NYFNUEYFTAZFIK-NEPJUHHUSA-N 2 2 316.367 3.403 20 10 DGCDLP CC[N@H+]1CC[C@@H](C[NH2+][C@H](C)c2cccc(C(F)(F)F)c2O)C1 ZINC000815560715 627684896 /nfs/dbraw/zinc/68/48/96/627684896.db2.gz NYFNUEYFTAZFIK-NEPJUHHUSA-N 2 2 316.367 3.403 20 10 DGCDLP CC[NH+]1CCC(CC[NH2+]Cc2cc(Cl)c(F)cc2O)CC1 ZINC000816554049 627806836 /nfs/dbraw/zinc/80/68/36/627806836.db2.gz NPUPWGOMTJQIJD-UHFFFAOYSA-N 2 2 314.832 3.396 20 10 DGCDLP Cc1cccc2c1CC[C@H]2[NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000817938384 627966326 /nfs/dbraw/zinc/96/63/26/627966326.db2.gz JQZDRKURRBBHRH-WOJBJXKFSA-N 2 2 309.457 3.338 20 10 DGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+][C@@H]2CCc3ccc(F)cc32)cc1 ZINC000817938856 627967339 /nfs/dbraw/zinc/96/73/39/627967339.db2.gz UOKSLRNVTCGJMM-RTBURBONSA-N 2 2 313.420 3.169 20 10 DGCDLP C[C@H]([NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1)c1ccnc(Cl)c1 ZINC000817939891 627967627 /nfs/dbraw/zinc/96/76/27/627967627.db2.gz CZZLFMAMADQPMA-LRDDRELGSA-N 2 2 318.852 3.152 20 10 DGCDLP CC[C@H](Cc1cccs1)[NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000817941124 627968689 /nfs/dbraw/zinc/96/86/89/627968689.db2.gz JCZHDNYUFDHOLB-QAPCUYQASA-N 2 2 317.502 3.425 20 10 DGCDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+][C@H](c2cccnc2)C2CCC2)cc1 ZINC000817943260 627969338 /nfs/dbraw/zinc/96/93/38/627969338.db2.gz SXJZCELRPOIATI-PMACEKPBSA-N 2 2 324.472 3.278 20 10 DGCDLP COc1ccsc1[C@H](C)[NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000817943866 627969994 /nfs/dbraw/zinc/96/99/94/627969994.db2.gz WEHKLBRCWVTNDS-WFASDCNBSA-N 2 2 319.474 3.173 20 10 DGCDLP CCC[NH2+]CC[NH2+][C@@H](C)c1cc(Br)cc(C)c1O ZINC000817962020 627976930 /nfs/dbraw/zinc/97/69/30/627976930.db2.gz GMVNETSROCEKOH-NSHDSACASA-N 2 2 315.255 3.113 20 10 DGCDLP C[C@H]([NH2+][C@H]1C[NH2+]CC[C@H]1C)c1ccc(N2CCCCC2)cc1 ZINC000817968058 627978829 /nfs/dbraw/zinc/97/88/29/627978829.db2.gz NXOALRWHXLIBRV-GJYPPUQNSA-N 2 2 301.478 3.326 20 10 DGCDLP C[C@@H]([NH2+][C@H]1CC[NH2+][C@H](C)C1)c1cccc(C(F)(F)F)c1O ZINC000817970893 627979598 /nfs/dbraw/zinc/97/95/98/627979598.db2.gz GVZLGZJOHYTVPK-MXWKQRLJSA-N 2 2 302.340 3.202 20 10 DGCDLP CN(C)c1ccc(/C=C\C[NH2+]CCCNc2cccc[nH+]2)cc1 ZINC000835043742 629833841 /nfs/dbraw/zinc/83/38/41/629833841.db2.gz BUGOQBNGBAPLQR-ALCCZGGFSA-N 2 2 310.445 3.253 20 10 DGCDLP C[C@H]([NH3+])c1ccc(C[NH2+]Cc2cc(Cl)cc(F)c2O)cc1 ZINC000841028968 630398394 /nfs/dbraw/zinc/39/83/94/630398394.db2.gz KCUVPVRIQTYWIJ-JTQLQIEISA-N 2 2 308.784 3.494 20 10 DGCDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+]Cc2ccccc2C2CC2)cc1 ZINC000841044659 630401438 /nfs/dbraw/zinc/40/14/38/630401438.db2.gz DZOWQIYQHKNBHW-FQEVSTJZSA-N 2 2 309.457 3.420 20 10 DGCDLP C[C@@H](CCCC(F)(F)F)[NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000841045536 630401746 /nfs/dbraw/zinc/40/17/46/630401746.db2.gz MKZQKWLUGHQZAA-WFASDCNBSA-N 2 2 317.399 3.463 20 10 DGCDLP Oc1c(Cl)cccc1C[N@@H+]1CCC[C@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000843126298 630616680 /nfs/dbraw/zinc/61/66/80/630616680.db2.gz ICKNULNJBMIEQK-KGLIPLIRSA-N 2 2 308.853 3.257 20 10 DGCDLP Oc1c(Cl)cccc1C[N@H+]1CCC[C@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000843126298 630616682 /nfs/dbraw/zinc/61/66/82/630616682.db2.gz ICKNULNJBMIEQK-KGLIPLIRSA-N 2 2 308.853 3.257 20 10 DGCDLP c1cc(N2CCCCC2)ccc1C[NH2+][C@H]1CC[NH2+]C12CCCC2 ZINC000843129120 630617501 /nfs/dbraw/zinc/61/75/01/630617501.db2.gz RMSRXANBNZKGCW-IBGZPJMESA-N 2 2 313.489 3.441 20 10 DGCDLP COc1cccc([C@H](C)[NH2+][C@H](Cn2cc[nH+]c2)C(C)(C)C)c1O ZINC000846145036 631211778 /nfs/dbraw/zinc/21/17/78/631211778.db2.gz ODWLNABXYFYLIZ-XJKSGUPXSA-N 2 2 317.433 3.363 20 10 DGCDLP Cc1cc(C[N@@H+]2CCCC[C@@H]2C[NH3+])ccc1N1CCCCC1 ZINC001579598448 1191981851 /nfs/dbraw/zinc/98/18/51/1191981851.db2.gz WJNNDCONEWFKEP-GOSISDBHSA-N 2 2 301.478 3.299 20 10 DGCDLP Cc1cc(C[N@H+]2CCCC[C@@H]2C[NH3+])ccc1N1CCCCC1 ZINC001579598448 1191981853 /nfs/dbraw/zinc/98/18/53/1191981853.db2.gz WJNNDCONEWFKEP-GOSISDBHSA-N 2 2 301.478 3.299 20 10 DGCDLP Oc1c(F)cc(Cl)cc1C[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC001461068377 1182762672 /nfs/dbraw/zinc/76/26/72/1182762672.db2.gz UHEBNBMLPGWWJN-UHFFFAOYSA-N 2 2 312.816 3.149 20 10 DGCDLP CC(C)(C)[C@H](Cn1cc[nH+]c1)[NH2+]Cc1ccc2c(c1)CCCO2 ZINC001461087244 1182766390 /nfs/dbraw/zinc/76/63/90/1182766390.db2.gz QIUJWMSFCTWUOF-SFHVURJKSA-N 2 2 313.445 3.413 20 10 DGCDLP Cc1[nH+]ccn1CCCC[NH2+]Cc1cc(Cl)cc(F)c1O ZINC001461231064 1182783771 /nfs/dbraw/zinc/78/37/71/1182783771.db2.gz LPMNSTHNOMLFON-UHFFFAOYSA-N 2 2 311.788 3.260 20 10 DGCDLP C[NH+](C)[C@@H]1CCC[C@@H]([NH2+]Cc2cc(Cl)cc(F)c2O)C1 ZINC001647040760 1195242635 /nfs/dbraw/zinc/24/26/35/1195242635.db2.gz WVMARBMLLVYZSB-CHWSQXEVSA-N 2 2 300.805 3.147 20 10 DGCDLP Oc1cc(F)c(F)cc1C[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC001657230456 1196120427 /nfs/dbraw/zinc/12/04/27/1196120427.db2.gz ZZDBQLOLUXCZOS-SJKOYZFVSA-N 2 2 322.399 3.119 20 10 DGCDLP Oc1cc(F)c(F)cc1C[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC001657230456 1196120431 /nfs/dbraw/zinc/12/04/31/1196120431.db2.gz ZZDBQLOLUXCZOS-SJKOYZFVSA-N 2 2 322.399 3.119 20 10 DGCDLP Oc1cc(F)c(F)cc1C[NH+]1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC001657230456 1196120434 /nfs/dbraw/zinc/12/04/34/1196120434.db2.gz ZZDBQLOLUXCZOS-SJKOYZFVSA-N 2 2 322.399 3.119 20 10 DGCDLP Oc1cc(F)c(F)cc1C[NH+]1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC001657230456 1196120436 /nfs/dbraw/zinc/12/04/36/1196120436.db2.gz ZZDBQLOLUXCZOS-SJKOYZFVSA-N 2 2 322.399 3.119 20 10 DGCDLP CC[NH+](CC)CC[C@H](C)[NH2+]Cc1cc(Cl)c(F)cc1O ZINC001660261738 1196463405 /nfs/dbraw/zinc/46/34/05/1196463405.db2.gz HPWDKKAWZKDILO-NSHDSACASA-N 2 2 302.821 3.395 20 10 DGCDLP Cn1c[nH+]cc1-c1cccc(N2CCCc3ccc(C[NH3+])nc32)c1 ZINC001169590895 1081600478 /nfs/dbraw/zinc/60/04/78/1081600478.db2.gz POPXAGWEYXQWEW-UHFFFAOYSA-N 2 2 319.412 3.025 20 10 DGCDLP CCN(CC)c1ccc(C[N@H+]2C[C@H]3[C@H](C2)CCC[NH+]3C)cc1 ZINC001203946850 1090848126 /nfs/dbraw/zinc/84/81/26/1090848126.db2.gz YHACHVVVABBPJI-HKUYNNGSSA-N 2 2 301.478 3.059 20 10 DGCDLP CCN(CC)c1ccc(C[N@@H+]2C[C@H]3[C@H](C2)CCC[NH+]3C)cc1 ZINC001203946850 1090848131 /nfs/dbraw/zinc/84/81/31/1090848131.db2.gz YHACHVVVABBPJI-HKUYNNGSSA-N 2 2 301.478 3.059 20 10 DGCDLP CCN(CC)c1ccc(C[NH+]2C[C@H]3[C@H](C2)CCC[N@@H+]3C)cc1 ZINC001203946850 1090848137 /nfs/dbraw/zinc/84/81/37/1090848137.db2.gz YHACHVVVABBPJI-HKUYNNGSSA-N 2 2 301.478 3.059 20 10 DGCDLP CCN(CC)c1ccc(C[NH+]2C[C@H]3[C@H](C2)CCC[N@H+]3C)cc1 ZINC001203946850 1090848144 /nfs/dbraw/zinc/84/81/44/1090848144.db2.gz YHACHVVVABBPJI-HKUYNNGSSA-N 2 2 301.478 3.059 20 10 DGCDLP C[N@@H+]1CCC[C@@H]2C[NH+](Cc3ccc(N4CCCCC4)cc3)C[C@H]21 ZINC001138220676 1091119466 /nfs/dbraw/zinc/11/94/66/1091119466.db2.gz MAMSWYIXGVPVLI-UYAOXDASSA-N 2 2 313.489 3.203 20 10 DGCDLP C[N@H+]1CCC[C@@H]2C[NH+](Cc3ccc(N4CCCCC4)cc3)C[C@H]21 ZINC001138220676 1091119470 /nfs/dbraw/zinc/11/94/70/1091119470.db2.gz MAMSWYIXGVPVLI-UYAOXDASSA-N 2 2 313.489 3.203 20 10 DGCDLP C[NH+]1CCC[C@@H]2C[N@H+](Cc3ccc(N4CCCCC4)cc3)C[C@H]21 ZINC001138220676 1091119476 /nfs/dbraw/zinc/11/94/76/1091119476.db2.gz MAMSWYIXGVPVLI-UYAOXDASSA-N 2 2 313.489 3.203 20 10 DGCDLP C[NH+]1CCC[C@@H]2C[N@@H+](Cc3ccc(N4CCCCC4)cc3)C[C@H]21 ZINC001138220676 1091119478 /nfs/dbraw/zinc/11/94/78/1091119478.db2.gz MAMSWYIXGVPVLI-UYAOXDASSA-N 2 2 313.489 3.203 20 10 DGCDLP COc1ccc2ccc(O)c(C[N@@H+]3C[C@@H](C)CC[C@H]3C[NH3+])c2c1 ZINC001205842027 1091375390 /nfs/dbraw/zinc/37/53/90/1091375390.db2.gz MCDSCPSZOVBWGZ-ZFWWWQNUSA-N 2 2 314.429 3.113 20 10 DGCDLP COc1ccc2ccc(O)c(C[N@H+]3C[C@@H](C)CC[C@H]3C[NH3+])c2c1 ZINC001205842027 1091375403 /nfs/dbraw/zinc/37/54/03/1091375403.db2.gz MCDSCPSZOVBWGZ-ZFWWWQNUSA-N 2 2 314.429 3.113 20 10 DGCDLP C[C@H]1CC[C@@H](C[NH3+])[N@H+](Cc2ccc3c(c2O)C=CC(C)(C)O3)C1 ZINC001205853342 1091379650 /nfs/dbraw/zinc/37/96/50/1091379650.db2.gz IAJDBOPJTLHIHW-ZFWWWQNUSA-N 2 2 316.445 3.136 20 10 DGCDLP C[C@H]1CC[C@@H](C[NH3+])[N@@H+](Cc2ccc3c(c2O)C=CC(C)(C)O3)C1 ZINC001205853342 1091379657 /nfs/dbraw/zinc/37/96/57/1091379657.db2.gz IAJDBOPJTLHIHW-ZFWWWQNUSA-N 2 2 316.445 3.136 20 10 DGCDLP Cc1ccc(C)c(C[N@H+]2CC[C@H](Oc3cc[nH+]cc3C)C2)c1O ZINC001140185033 1091795575 /nfs/dbraw/zinc/79/55/75/1091795575.db2.gz OPHGXQKUZBNVEJ-INIZCTEOSA-N 2 2 312.413 3.366 20 10 DGCDLP Cc1ccc(C)c(C[N@@H+]2CC[C@H](Oc3cc[nH+]cc3C)C2)c1O ZINC001140185033 1091795579 /nfs/dbraw/zinc/79/55/79/1091795579.db2.gz OPHGXQKUZBNVEJ-INIZCTEOSA-N 2 2 312.413 3.366 20 10 DGCDLP C[N@@H+]1CCC[C@]2(CCC[NH+](Cc3cc(Cl)c(O)cc3O)C2)C1 ZINC001276617072 1092662418 /nfs/dbraw/zinc/66/24/18/1092662418.db2.gz NLPIRAUNTDAVMK-KRWDZBQOSA-N 2 2 324.852 3.059 20 10 DGCDLP C[N@H+]1CCC[C@]2(CCC[NH+](Cc3cc(Cl)c(O)cc3O)C2)C1 ZINC001276617072 1092662422 /nfs/dbraw/zinc/66/24/22/1092662422.db2.gz NLPIRAUNTDAVMK-KRWDZBQOSA-N 2 2 324.852 3.059 20 10 DGCDLP C[NH+]1CCC[C@]2(CCC[N@H+](Cc3cc(Cl)c(O)cc3O)C2)C1 ZINC001276617072 1092662427 /nfs/dbraw/zinc/66/24/27/1092662427.db2.gz NLPIRAUNTDAVMK-KRWDZBQOSA-N 2 2 324.852 3.059 20 10 DGCDLP C[NH+]1CCC[C@]2(CCC[N@@H+](Cc3cc(Cl)c(O)cc3O)C2)C1 ZINC001276617072 1092662431 /nfs/dbraw/zinc/66/24/31/1092662431.db2.gz NLPIRAUNTDAVMK-KRWDZBQOSA-N 2 2 324.852 3.059 20 10 DGCDLP CC[N@@H+](Cc1ccc(N)cc1)CC1CCN(c2cccc[nH+]2)CC1 ZINC001120371390 1094416914 /nfs/dbraw/zinc/41/69/14/1094416914.db2.gz XKTYYGLUMUVAHG-UHFFFAOYSA-N 2 2 324.472 3.402 20 10 DGCDLP CC[N@H+](Cc1ccc(N)cc1)CC1CCN(c2cccc[nH+]2)CC1 ZINC001120371390 1094416920 /nfs/dbraw/zinc/41/69/20/1094416920.db2.gz XKTYYGLUMUVAHG-UHFFFAOYSA-N 2 2 324.472 3.402 20 10 DGCDLP CN(C)c1ccc(C[N@@H+]2CC[C@]23CCC[NH2+]C3)c2ccccc21 ZINC001222191625 1095483931 /nfs/dbraw/zinc/48/39/31/1095483931.db2.gz NYXLSJPRCGPQPP-FQEVSTJZSA-N 2 2 309.457 3.234 20 10 DGCDLP CN(C)c1ccc(C[N@H+]2CC[C@]23CCC[NH2+]C3)c2ccccc21 ZINC001222191625 1095483935 /nfs/dbraw/zinc/48/39/35/1095483935.db2.gz NYXLSJPRCGPQPP-FQEVSTJZSA-N 2 2 309.457 3.234 20 10 DGCDLP CN(C)c1ccc(C[N@@H+]2CCC[C@]3(CCC[NH2+]C3)C2)c(Cl)c1 ZINC001222271029 1095523095 /nfs/dbraw/zinc/52/30/95/1095523095.db2.gz BTPIIRBEIDKHCP-SFHVURJKSA-N 2 2 321.896 3.372 20 10 DGCDLP CN(C)c1ccc(C[N@H+]2CCC[C@]3(CCC[NH2+]C3)C2)c(Cl)c1 ZINC001222271029 1095523104 /nfs/dbraw/zinc/52/31/04/1095523104.db2.gz BTPIIRBEIDKHCP-SFHVURJKSA-N 2 2 321.896 3.372 20 10 DGCDLP Cc1ccc(C)n1-c1ccc(C[N@@H+]2CCC[C@]3(CC[NH2+]3)C2)cc1 ZINC001222282298 1095528329 /nfs/dbraw/zinc/52/83/29/1095528329.db2.gz ILXOTERHUJYJTJ-FQEVSTJZSA-N 2 2 309.457 3.422 20 10 DGCDLP Cc1ccc(C)n1-c1ccc(C[N@H+]2CCC[C@]3(CC[NH2+]3)C2)cc1 ZINC001222282298 1095528335 /nfs/dbraw/zinc/52/83/35/1095528335.db2.gz ILXOTERHUJYJTJ-FQEVSTJZSA-N 2 2 309.457 3.422 20 10 DGCDLP CC(C)(C)c1cccc(C[N@@H+]2CC[C@@]3(C2)CCCC[NH2+]3)c1O ZINC001222426321 1095607491 /nfs/dbraw/zinc/60/74/91/1095607491.db2.gz APPFBPDBZVRNCX-LJQANCHMSA-N 2 2 302.462 3.408 20 10 DGCDLP CC(C)(C)c1cccc(C[N@H+]2CC[C@@]3(C2)CCCC[NH2+]3)c1O ZINC001222426321 1095607497 /nfs/dbraw/zinc/60/74/97/1095607497.db2.gz APPFBPDBZVRNCX-LJQANCHMSA-N 2 2 302.462 3.408 20 10 DGCDLP Oc1cccc(F)c1C[N@@H+]1CCCC[C@H]1CC[NH+]1CCCC1 ZINC001137837812 1095759066 /nfs/dbraw/zinc/75/90/66/1095759066.db2.gz VRAMWDOLAONRPT-HNNXBMFYSA-N 2 2 306.425 3.372 20 10 DGCDLP Oc1cccc(F)c1C[N@H+]1CCCC[C@H]1CC[NH+]1CCCC1 ZINC001137837812 1095759078 /nfs/dbraw/zinc/75/90/78/1095759078.db2.gz VRAMWDOLAONRPT-HNNXBMFYSA-N 2 2 306.425 3.372 20 10 DGCDLP CC[N@H+](C)C1CC[NH+](Cc2ccc(C(F)(F)F)cc2O)CC1 ZINC001233455404 1098339432 /nfs/dbraw/zinc/33/94/32/1098339432.db2.gz JMFVKSZDXSSZQV-UHFFFAOYSA-N 2 2 316.367 3.327 20 10 DGCDLP CC[N@@H+](C)C1CC[NH+](Cc2ccc(C(F)(F)F)cc2O)CC1 ZINC001233455404 1098339438 /nfs/dbraw/zinc/33/94/38/1098339438.db2.gz JMFVKSZDXSSZQV-UHFFFAOYSA-N 2 2 316.367 3.327 20 10 DGCDLP Cc1cc(C[NH+]2CCC3(CC[NH2+]3)CC2)c(C)n1-c1ccccc1 ZINC001235107228 1098808547 /nfs/dbraw/zinc/80/85/47/1098808547.db2.gz ZCUZLACVAPVPLX-UHFFFAOYSA-N 2 2 309.457 3.422 20 10 DGCDLP CC(C)(C)c1cccc(C[N@@H+]2CCCC[C@]23CC[NH2+]C3)c1O ZINC001235118681 1098817511 /nfs/dbraw/zinc/81/75/11/1098817511.db2.gz GWDXXRDZCCQWJR-LJQANCHMSA-N 2 2 302.462 3.408 20 10 DGCDLP CC(C)(C)c1cccc(C[N@H+]2CCCC[C@]23CC[NH2+]C3)c1O ZINC001235118681 1098817519 /nfs/dbraw/zinc/81/75/19/1098817519.db2.gz GWDXXRDZCCQWJR-LJQANCHMSA-N 2 2 302.462 3.408 20 10 DGCDLP CC(C)[N@H+](Cc1cc(F)c(Cl)cc1O)[C@@H]1CCC[NH2+]C1 ZINC001236471013 1099631412 /nfs/dbraw/zinc/63/14/12/1099631412.db2.gz UUBXOGNESDVTNW-GFCCVEGCSA-N 2 2 300.805 3.147 20 10 DGCDLP CC(C)[N@@H+](Cc1cc(F)c(Cl)cc1O)[C@@H]1CCC[NH2+]C1 ZINC001236471013 1099631413 /nfs/dbraw/zinc/63/14/13/1099631413.db2.gz UUBXOGNESDVTNW-GFCCVEGCSA-N 2 2 300.805 3.147 20 10 DGCDLP C[N@H+](CCC[NH2+]Cc1cc(F)cc(F)c1O)C1CCCCC1 ZINC001198918105 1102026076 /nfs/dbraw/zinc/02/60/76/1102026076.db2.gz HJWVGZDTEXZIIB-UHFFFAOYSA-N 2 2 312.404 3.415 20 10 DGCDLP C[N@@H+](CCC[NH2+]Cc1cc(F)cc(F)c1O)C1CCCCC1 ZINC001198918105 1102026091 /nfs/dbraw/zinc/02/60/91/1102026091.db2.gz HJWVGZDTEXZIIB-UHFFFAOYSA-N 2 2 312.404 3.415 20 10 DGCDLP Oc1ccccc1C[N@@H+]1CCCC2(C[NH+](C3CCCC3)C2)C1 ZINC001275267651 1104698548 /nfs/dbraw/zinc/69/85/48/1104698548.db2.gz VAZWDXPXNLZBHH-UHFFFAOYSA-N 2 2 300.446 3.233 20 10 DGCDLP Oc1ccccc1C[N@H+]1CCCC2(C[NH+](C3CCCC3)C2)C1 ZINC001275267651 1104698551 /nfs/dbraw/zinc/69/85/51/1104698551.db2.gz VAZWDXPXNLZBHH-UHFFFAOYSA-N 2 2 300.446 3.233 20 10 DGCDLP C[N@H+]1C[C@@H]2C[NH+](Cc3cc(Cl)c(C(C)(C)C)cc3O)C[C@@H]2C1 ZINC001248883702 1105186840 /nfs/dbraw/zinc/18/68/40/1105186840.db2.gz NUORRZIUDOHEQS-OKILXGFUSA-N 2 2 322.880 3.337 20 10 DGCDLP C[N@@H+]1C[C@@H]2C[NH+](Cc3cc(Cl)c(C(C)(C)C)cc3O)C[C@@H]2C1 ZINC001248883702 1105186842 /nfs/dbraw/zinc/18/68/42/1105186842.db2.gz NUORRZIUDOHEQS-OKILXGFUSA-N 2 2 322.880 3.337 20 10 DGCDLP C[NH+]1C[C@@H]2C[N@@H+](Cc3cc(Cl)c(C(C)(C)C)cc3O)C[C@@H]2C1 ZINC001248883702 1105186843 /nfs/dbraw/zinc/18/68/43/1105186843.db2.gz NUORRZIUDOHEQS-OKILXGFUSA-N 2 2 322.880 3.337 20 10 DGCDLP C[NH+]1C[C@@H]2C[N@H+](Cc3cc(Cl)c(C(C)(C)C)cc3O)C[C@@H]2C1 ZINC001248883702 1105186846 /nfs/dbraw/zinc/18/68/46/1105186846.db2.gz NUORRZIUDOHEQS-OKILXGFUSA-N 2 2 322.880 3.337 20 10 DGCDLP CC[C@@H](C)[NH2+][C@H](c1ccccc1O)[C@H]([NH3+])c1ccccc1O ZINC001257431304 1106587519 /nfs/dbraw/zinc/58/75/19/1106587519.db2.gz CFGQHZTZHITSTR-NXOUGTEYSA-N 2 2 300.402 3.227 20 10 DGCDLP Oc1ccc(Cl)c(F)c1C[N@@H+]1CC[C@H](C[NH+]2CCCC2)C1 ZINC000191389763 432259725 /nfs/dbraw/zinc/25/97/25/432259725.db2.gz IRKKYLMLLRCUKV-GFCCVEGCSA-N 2 2 312.816 3.102 20 10 DGCDLP Oc1ccc(Cl)c(F)c1C[N@H+]1CC[C@H](C[NH+]2CCCC2)C1 ZINC000191389763 432259731 /nfs/dbraw/zinc/25/97/31/432259731.db2.gz IRKKYLMLLRCUKV-GFCCVEGCSA-N 2 2 312.816 3.102 20 10 DGCDLP Cc1[nH+]ccn1-c1ccc(C[NH2+][C@H](C)c2ccc(C)cc2O)cn1 ZINC000185084409 432464739 /nfs/dbraw/zinc/46/47/39/432464739.db2.gz IEMGAEFDVVNSLT-CQSZACIVSA-N 2 2 322.412 3.441 20 10 DGCDLP C[C@H]([NH2+]CCn1cc[nH+]c1)c1ccc(N2CCCCC2)c(F)c1 ZINC000155646956 432565891 /nfs/dbraw/zinc/56/58/91/432565891.db2.gz RIMIJVPHAMWWCC-HNNXBMFYSA-N 2 2 316.424 3.363 20 10 DGCDLP C[C@H]([NH2+]C1CC[NH+](C2CCC2)CC1)c1ccc(F)c(F)c1O ZINC000276854496 432826666 /nfs/dbraw/zinc/82/66/66/432826666.db2.gz BKAFASQAGRGBFN-NSHDSACASA-N 2 2 310.388 3.338 20 10 DGCDLP CCN(CC)c1ccc(C[N@@H+]2CC[C@H](c3[nH+]ccn3C)C2)cc1 ZINC000377890932 434027952 /nfs/dbraw/zinc/02/79/52/434027952.db2.gz ZFVBOWAFVDHUGH-KRWDZBQOSA-N 2 2 312.461 3.256 20 10 DGCDLP CCN(CC)c1ccc(C[N@H+]2CC[C@H](c3[nH+]ccn3C)C2)cc1 ZINC000377890932 434027955 /nfs/dbraw/zinc/02/79/55/434027955.db2.gz ZFVBOWAFVDHUGH-KRWDZBQOSA-N 2 2 312.461 3.256 20 10 DGCDLP Cc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(-n3cc[nH+]c3)nc2)c1 ZINC000363853944 434169272 /nfs/dbraw/zinc/16/92/72/434169272.db2.gz LFFDFASGSTXYKI-CQSZACIVSA-N 2 2 308.385 3.132 20 10 DGCDLP Oc1ccc(Cl)c(F)c1C[N@@H+]1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000365260153 434296954 /nfs/dbraw/zinc/29/69/54/434296954.db2.gz SNJAXTBBISBYLG-SNVBAGLBSA-N 2 2 309.772 3.287 20 10 DGCDLP Oc1ccc(Cl)c(F)c1C[N@H+]1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000365260153 434296962 /nfs/dbraw/zinc/29/69/62/434296962.db2.gz SNJAXTBBISBYLG-SNVBAGLBSA-N 2 2 309.772 3.287 20 10 DGCDLP CC(C)[NH2+]C1CC[NH+](Cc2cc(Cl)c(F)cc2O)CC1 ZINC000295455788 434371271 /nfs/dbraw/zinc/37/12/71/434371271.db2.gz VOECEKUVIYXJCW-UHFFFAOYSA-N 2 2 300.805 3.147 20 10 DGCDLP Oc1ccc(-c2ccccc2)cc1C[NH2+][C@@H]1CC[N@@H+](C2CC2)C1 ZINC000729681963 575260513 /nfs/dbraw/zinc/26/05/13/575260513.db2.gz PJSAIXDMOVJPPK-GOSISDBHSA-N 2 2 308.425 3.386 20 10 DGCDLP Oc1ccc(-c2ccccc2)cc1C[NH2+][C@@H]1CC[N@H+](C2CC2)C1 ZINC000729681963 575260516 /nfs/dbraw/zinc/26/05/16/575260516.db2.gz PJSAIXDMOVJPPK-GOSISDBHSA-N 2 2 308.425 3.386 20 10 DGCDLP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2cc(F)cc(C(C)=O)c2O)C[C@@H]1C ZINC000750827074 575753898 /nfs/dbraw/zinc/75/38/98/575753898.db2.gz VJTVNYCWBRCLNJ-BLLLJJGKSA-N 2 2 322.424 3.039 20 10 DGCDLP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2cc(F)cc(C(C)=O)c2O)C[C@@H]1C ZINC000750827074 575753906 /nfs/dbraw/zinc/75/39/06/575753906.db2.gz VJTVNYCWBRCLNJ-BLLLJJGKSA-N 2 2 322.424 3.039 20 10 DGCDLP C[C@@H](Cn1cc[nH+]c1)[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000725847035 575929032 /nfs/dbraw/zinc/92/90/32/575929032.db2.gz BGLXTMRFFXWTJA-HNNXBMFYSA-N 2 2 307.397 3.434 20 10 DGCDLP Cc1ccc([C@@H](C)[NH2+][C@@H]2C[NH2+]CC[C@@H]2c2ccccc2)c(O)c1 ZINC000854222964 620785642 /nfs/dbraw/zinc/78/56/42/620785642.db2.gz PQQNJNXDSQAFCT-ATZDWAIDSA-N 2 2 310.441 3.497 20 10 DGCDLP C[N@@H+]1CCC[C@@H](CC[NH2+]Cc2cc(Cl)cc(F)c2O)C1 ZINC000839180119 621343490 /nfs/dbraw/zinc/34/34/90/621343490.db2.gz CIRKRLQYXCJHKG-NSHDSACASA-N 2 2 300.805 3.006 20 10 DGCDLP C[N@H+]1CCC[C@@H](CC[NH2+]Cc2cc(Cl)cc(F)c2O)C1 ZINC000839180119 621343492 /nfs/dbraw/zinc/34/34/92/621343492.db2.gz CIRKRLQYXCJHKG-NSHDSACASA-N 2 2 300.805 3.006 20 10 DGCDLP C[N@@H+]1CCCC[C@H](C[NH2+]Cc2cc(Cl)c(F)cc2O)C1 ZINC000862483861 621594208 /nfs/dbraw/zinc/59/42/08/621594208.db2.gz ZQRIMQVMVWJUNF-LLVKDONJSA-N 2 2 300.805 3.006 20 10 DGCDLP C[N@H+]1CCCC[C@H](C[NH2+]Cc2cc(Cl)c(F)cc2O)C1 ZINC000862483861 621594211 /nfs/dbraw/zinc/59/42/11/621594211.db2.gz ZQRIMQVMVWJUNF-LLVKDONJSA-N 2 2 300.805 3.006 20 10 DGCDLP Oc1cccc(Cl)c1C[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000770374310 622625650 /nfs/dbraw/zinc/62/56/50/622625650.db2.gz LDASYKSYUJFNBL-GUYCJALGSA-N 2 2 320.864 3.494 20 10 DGCDLP Oc1cccc(Cl)c1C[N@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000770374310 622625652 /nfs/dbraw/zinc/62/56/52/622625652.db2.gz LDASYKSYUJFNBL-GUYCJALGSA-N 2 2 320.864 3.494 20 10 DGCDLP Oc1cccc(Cl)c1C[NH+]1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000770374310 622625654 /nfs/dbraw/zinc/62/56/54/622625654.db2.gz LDASYKSYUJFNBL-GUYCJALGSA-N 2 2 320.864 3.494 20 10 DGCDLP Oc1cccc(Cl)c1C[NH+]1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000770374310 622625657 /nfs/dbraw/zinc/62/56/57/622625657.db2.gz LDASYKSYUJFNBL-GUYCJALGSA-N 2 2 320.864 3.494 20 10 DGCDLP C[C@@H]([NH2+]CC[C@H]([NH3+])Cc1ccccc1)c1cc(F)cc(F)c1O ZINC000873235255 623085485 /nfs/dbraw/zinc/08/54/85/623085485.db2.gz MXXLIQPANHCAPB-DOMZBBRYSA-N 2 2 320.383 3.281 20 10 DGCDLP CC[C@@H]([NH2+][C@@H]1CCn2cc[nH+]c2C1)c1cc(Cl)ccc1O ZINC000779067358 623726467 /nfs/dbraw/zinc/72/64/67/623726467.db2.gz VZBNVDPYQWIEHB-TZMCWYRMSA-N 2 2 305.809 3.298 20 10 DGCDLP C[C@H]([NH2+]CC(C)(C)C[NH+]1CCCC1)c1cc(F)cc(F)c1O ZINC000790749128 625692107 /nfs/dbraw/zinc/69/21/07/625692107.db2.gz CUOZHEIQSXJFHJ-LBPRGKRZSA-N 2 2 312.404 3.443 20 10 DGCDLP CC1([NH+]2CCCC2)CC[NH+](Cc2cc(Cl)ccc2O)CC1 ZINC000877674532 623988032 /nfs/dbraw/zinc/98/80/32/623988032.db2.gz RJCCEHBHUXMLQN-UHFFFAOYSA-N 2 2 308.853 3.496 20 10 DGCDLP CC[N@@H+]1CCC[C@@H](C[NH2+]Cc2c(O)ccc(Cl)c2F)C1 ZINC000790961960 625723297 /nfs/dbraw/zinc/72/32/97/625723297.db2.gz FTCQARUBTIVHIR-NSHDSACASA-N 2 2 300.805 3.006 20 10 DGCDLP CC[N@H+]1CCC[C@@H](C[NH2+]Cc2c(O)ccc(Cl)c2F)C1 ZINC000790961960 625723302 /nfs/dbraw/zinc/72/33/02/625723302.db2.gz FTCQARUBTIVHIR-NSHDSACASA-N 2 2 300.805 3.006 20 10 DGCDLP CC[C@@H]([NH2+]CCn1cc[nH+]c1)c1ccc(C(F)(F)F)cc1O ZINC000810207394 626988283 /nfs/dbraw/zinc/98/82/83/626988283.db2.gz HSTOAVSLWYBBMZ-CYBMUJFWSA-N 2 2 313.323 3.348 20 10 DGCDLP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)c2cccc(C(F)(F)F)c2O)C1 ZINC000815560717 627684651 /nfs/dbraw/zinc/68/46/51/627684651.db2.gz NYFNUEYFTAZFIK-RYUDHWBXSA-N 2 2 316.367 3.403 20 10 DGCDLP CC[N@H+]1CC[C@@H](C[NH2+][C@@H](C)c2cccc(C(F)(F)F)c2O)C1 ZINC000815560717 627684652 /nfs/dbraw/zinc/68/46/52/627684652.db2.gz NYFNUEYFTAZFIK-RYUDHWBXSA-N 2 2 316.367 3.403 20 10 DGCDLP C[NH+](C)[C@@H]1CCC[C@@H]([NH2+]Cc2cc(Cl)c(F)cc2O)C1 ZINC000816554814 627806753 /nfs/dbraw/zinc/80/67/53/627806753.db2.gz JRVSQAMWKUHYON-VXGBXAGGSA-N 2 2 300.805 3.147 20 10 DGCDLP CC(=O)c1cc(Cl)cc(C[N@@H+]2C[C@H](C[NH3+])[C@@H](C)C[C@H]2C)c1O ZINC000817880394 627952791 /nfs/dbraw/zinc/95/27/91/627952791.db2.gz RNAHNRIXWXZKJN-WDMOLILDSA-N 2 2 324.852 3.053 20 10 DGCDLP CC(=O)c1cc(Cl)cc(C[N@H+]2C[C@H](C[NH3+])[C@@H](C)C[C@H]2C)c1O ZINC000817880394 627952794 /nfs/dbraw/zinc/95/27/94/627952794.db2.gz RNAHNRIXWXZKJN-WDMOLILDSA-N 2 2 324.852 3.053 20 10 DGCDLP CCN(CC)c1ccc(C[NH2+][C@H](C)c2c[nH+]ccc2N)cc1F ZINC000817903340 627957021 /nfs/dbraw/zinc/95/70/21/627957021.db2.gz NPEJWSRMRJFGOL-CYBMUJFWSA-N 2 2 316.424 3.330 20 10 DGCDLP COc1ccc([C@@H](C)[NH2+]C[C@H]([NH3+])c2ccc(N(C)C)cc2)cc1 ZINC000817938361 627966870 /nfs/dbraw/zinc/96/68/70/627966870.db2.gz JKJVGUQYRRGWMK-KUHUBIRLSA-N 2 2 313.445 3.112 20 10 DGCDLP C[C@@H](Cc1cccs1)[NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000817939070 627967655 /nfs/dbraw/zinc/96/76/55/627967655.db2.gz YLZMUOQPXMPCND-GUYCJALGSA-N 2 2 303.475 3.035 20 10 DGCDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+]C2CCc3ccccc3CC2)cc1 ZINC000817940716 627968920 /nfs/dbraw/zinc/96/89/20/627968920.db2.gz HJTCROYALJSPAM-NRFANRHFSA-N 2 2 323.484 3.290 20 10 DGCDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+][C@@H]2CCCc3ccccc3C2)cc1 ZINC000817944199 627970063 /nfs/dbraw/zinc/97/00/63/627970063.db2.gz YCPSLDQOALGBIK-CTNGQTDRSA-N 2 2 323.484 3.290 20 10 DGCDLP C[C@@H]([NH2+][C@@H]1CCCC[C@H]1[NH3+])c1ccc(Br)cc1O ZINC000818616373 628043640 /nfs/dbraw/zinc/04/36/40/628043640.db2.gz VOMAPTCWEKMQDU-OASPWFOLSA-N 2 2 313.239 3.075 20 10 DGCDLP CN(C)c1ccc(/C=C\C[NH+]2CCC(c3[nH]cc[nH+]3)CC2)cc1 ZINC000835029327 629828898 /nfs/dbraw/zinc/82/88/98/629828898.db2.gz WPBVOLOFWNDCDX-ARJAWSKDSA-N 2 2 310.445 3.369 20 10 DGCDLP Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@@H]1C[N@@H+](C2CC2)C[C@@H]1C ZINC000840893875 630373700 /nfs/dbraw/zinc/37/37/00/630373700.db2.gz NNWVPLKOMUJRQN-TWOQFEAHSA-N 2 2 315.505 3.064 20 10 DGCDLP Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@@H]1C[N@H+](C2CC2)C[C@@H]1C ZINC000840893875 630373703 /nfs/dbraw/zinc/37/37/03/630373703.db2.gz NNWVPLKOMUJRQN-TWOQFEAHSA-N 2 2 315.505 3.064 20 10 DGCDLP CSc1ccc(C[NH2+]C[C@H]([NH3+])c2ccc(N(C)C)cc2)cc1 ZINC000841041199 630400703 /nfs/dbraw/zinc/40/07/03/630400703.db2.gz BTVGJMUXMMZAST-SFHVURJKSA-N 2 2 315.486 3.264 20 10 DGCDLP CC(C)c1ncc(C[NH2+]C[C@@H]([NH3+])c2ccc(N(C)C)cc2)s1 ZINC000841042115 630400767 /nfs/dbraw/zinc/40/07/67/630400767.db2.gz HWNORQVSCXFPGS-MRXNPFEDSA-N 2 2 318.490 3.122 20 10 DGCDLP C[C@H](C[NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1)Cc1ccccc1 ZINC000841046057 630401807 /nfs/dbraw/zinc/40/18/07/630401807.db2.gz VKGYTXBKICKYAK-JXFKEZNVSA-N 2 2 311.473 3.221 20 10 DGCDLP Cc1ccc(O)c(C[N@H+](Cc2ccccc2)[C@H]2CCC[NH2+]C2)c1 ZINC000843052924 630609111 /nfs/dbraw/zinc/60/91/11/630609111.db2.gz OYMKUZRKUDRVIO-IBGZPJMESA-N 2 2 310.441 3.455 20 10 DGCDLP Cc1ccc(O)c(C[N@@H+](Cc2ccccc2)[C@H]2CCC[NH2+]C2)c1 ZINC000843052924 630609112 /nfs/dbraw/zinc/60/91/12/630609112.db2.gz OYMKUZRKUDRVIO-IBGZPJMESA-N 2 2 310.441 3.455 20 10 DGCDLP Oc1c(Cl)cccc1C[N@@H+]1CCC[C@H]([C@H]2CCC[NH2+]C2)C1 ZINC000843126297 630616539 /nfs/dbraw/zinc/61/65/39/630616539.db2.gz ICKNULNJBMIEQK-KBPBESRZSA-N 2 2 308.853 3.257 20 10 DGCDLP Oc1c(Cl)cccc1C[N@H+]1CCC[C@H]([C@H]2CCC[NH2+]C2)C1 ZINC000843126297 630616541 /nfs/dbraw/zinc/61/65/41/630616541.db2.gz ICKNULNJBMIEQK-KBPBESRZSA-N 2 2 308.853 3.257 20 10 DGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+]Cc2cccc3c2CCC3)cc1 ZINC000844901743 630970766 /nfs/dbraw/zinc/97/07/66/630970766.db2.gz JTSXMHBMZIUBGG-HXUWFJFHSA-N 2 2 309.457 3.031 20 10 DGCDLP CN(C)c1ccc(/C=C/C[NH2+][C@@H]2CCC[N@@H+]3CCCC[C@H]23)cc1 ZINC000848574127 631700498 /nfs/dbraw/zinc/70/04/98/631700498.db2.gz AAJHLSQTOZKVGQ-IGLJKTCPSA-N 2 2 313.489 3.372 20 10 DGCDLP CN(C)c1ccc(/C=C/C[NH2+][C@@H]2CCC[N@H+]3CCCC[C@H]23)cc1 ZINC000848574127 631700502 /nfs/dbraw/zinc/70/05/02/631700502.db2.gz AAJHLSQTOZKVGQ-IGLJKTCPSA-N 2 2 313.489 3.372 20 10 DGCDLP C[C@@H]([NH2+]CC[NH+]1CCCC1)c1ccc(N2CCCCC2)cc1 ZINC000178311161 656043594 /nfs/dbraw/zinc/04/35/94/656043594.db2.gz AVJKINBZLAQLLQ-QGZVFWFLSA-N 2 2 301.478 3.423 20 10 DGCDLP COc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(-n3cc[nH+]c3)cc2)c1 ZINC000182417128 660052370 /nfs/dbraw/zinc/05/23/70/660052370.db2.gz FZTWYPWNHCIAJL-CQSZACIVSA-N 2 2 323.396 3.437 20 10 DGCDLP [NH3+]C[C@@]12C[N@H+](Cc3c(O)ccc(Cl)c3F)C[C@H]1CCCC2 ZINC001580256856 1192016769 /nfs/dbraw/zinc/01/67/69/1192016769.db2.gz YNHAUXUQZFHCCC-BZNIZROVSA-N 2 2 312.816 3.136 20 10 DGCDLP [NH3+]C[C@@]12C[N@@H+](Cc3c(O)ccc(Cl)c3F)C[C@H]1CCCC2 ZINC001580256856 1192016771 /nfs/dbraw/zinc/01/67/71/1192016771.db2.gz YNHAUXUQZFHCCC-BZNIZROVSA-N 2 2 312.816 3.136 20 10 DGCDLP C[C@@H](C[NH+](C)C)[C@@H]1CCCC[N@@H+]1Cc1cc(F)cc(F)c1O ZINC001462463391 1182956484 /nfs/dbraw/zinc/95/64/84/1182956484.db2.gz VBQKJLZCGOHQJM-LRDDRELGSA-N 2 2 312.404 3.223 20 10 DGCDLP C[C@@H](C[NH+](C)C)[C@@H]1CCCC[N@H+]1Cc1cc(F)cc(F)c1O ZINC001462463391 1182956489 /nfs/dbraw/zinc/95/64/89/1182956489.db2.gz VBQKJLZCGOHQJM-LRDDRELGSA-N 2 2 312.404 3.223 20 10 DGCDLP CC[NH+]1CCC(C[NH2+]Cc2cc(Cl)cc(F)c2O)CC1 ZINC001661343343 1196596301 /nfs/dbraw/zinc/59/63/01/1196596301.db2.gz SCCKLGOICURDDM-UHFFFAOYSA-N 2 2 300.805 3.006 20 10 DGCDLP c1cc(N2CCCCC2)ccc1C[NH+]1CCC([NH+]2CCC2)CC1 ZINC001138222405 1091119755 /nfs/dbraw/zinc/11/97/55/1091119755.db2.gz WLIZPAWJVOVYHT-UHFFFAOYSA-N 2 2 313.489 3.347 20 10 DGCDLP CCN(CC)c1ccc(C[N@@H+]2C[C@H](C)CC[C@H]2C[NH3+])c(OC)c1 ZINC001205817755 1091364683 /nfs/dbraw/zinc/36/46/83/1091364683.db2.gz QVTJELFZFYCFNG-QAPCUYQASA-N 2 2 319.493 3.101 20 10 DGCDLP CCN(CC)c1ccc(C[N@H+]2C[C@H](C)CC[C@H]2C[NH3+])c(OC)c1 ZINC001205817755 1091364695 /nfs/dbraw/zinc/36/46/95/1091364695.db2.gz QVTJELFZFYCFNG-QAPCUYQASA-N 2 2 319.493 3.101 20 10 DGCDLP CC(C)(C)c1cccc(C[N@@H+]2CCC[C@]3(CCC[NH2+]3)C2)c1O ZINC001222354218 1095570256 /nfs/dbraw/zinc/57/02/56/1095570256.db2.gz LCHPRYKESGPYFI-LJQANCHMSA-N 2 2 302.462 3.408 20 10 DGCDLP CC(C)(C)c1cccc(C[N@H+]2CCC[C@]3(CCC[NH2+]3)C2)c1O ZINC001222354218 1095570266 /nfs/dbraw/zinc/57/02/66/1095570266.db2.gz LCHPRYKESGPYFI-LJQANCHMSA-N 2 2 302.462 3.408 20 10 DGCDLP CCC[N@H+](CCC[NH+](C)C)Cc1cc(Cl)c(OC)cc1O ZINC001232271664 1097988745 /nfs/dbraw/zinc/98/87/45/1097988745.db2.gz ZLHIFSMEXCDXDQ-UHFFFAOYSA-N 2 2 314.857 3.218 20 10 DGCDLP CCC[N@@H+](CCC[NH+](C)C)Cc1cc(Cl)c(OC)cc1O ZINC001232271664 1097988750 /nfs/dbraw/zinc/98/87/50/1097988750.db2.gz ZLHIFSMEXCDXDQ-UHFFFAOYSA-N 2 2 314.857 3.218 20 10 DGCDLP CC[N@H+](CCC[NH+](C)C)Cc1ccc(C(F)(F)F)cc1O ZINC001233455640 1098342025 /nfs/dbraw/zinc/34/20/25/1098342025.db2.gz SLEOLCYFZKHPEX-UHFFFAOYSA-N 2 2 304.356 3.185 20 10 DGCDLP CC[N@@H+](CCC[NH+](C)C)Cc1ccc(C(F)(F)F)cc1O ZINC001233455640 1098342030 /nfs/dbraw/zinc/34/20/30/1098342030.db2.gz SLEOLCYFZKHPEX-UHFFFAOYSA-N 2 2 304.356 3.185 20 10 DGCDLP Oc1ccc(Cl)c(Cl)c1C[N@@H+]1CCCC12CC[NH2+]CC2 ZINC001235143949 1098832991 /nfs/dbraw/zinc/83/29/91/1098832991.db2.gz HFWJGBOXUMIKGX-UHFFFAOYSA-N 2 2 315.244 3.417 20 10 DGCDLP Oc1ccc(Cl)c(Cl)c1C[N@H+]1CCCC12CC[NH2+]CC2 ZINC001235143949 1098833004 /nfs/dbraw/zinc/83/30/04/1098833004.db2.gz HFWJGBOXUMIKGX-UHFFFAOYSA-N 2 2 315.244 3.417 20 10 DGCDLP CN1CCCc2cc(C[N@@H+]3CCCC[C@@]34CCC[NH2+]C4)ccc21 ZINC001235167246 1098848613 /nfs/dbraw/zinc/84/86/13/1098848613.db2.gz GQTVJVIMFTWTOV-FQEVSTJZSA-N 2 2 313.489 3.177 20 10 DGCDLP CN1CCCc2cc(C[N@H+]3CCCC[C@@]34CCC[NH2+]C4)ccc21 ZINC001235167246 1098848623 /nfs/dbraw/zinc/84/86/23/1098848623.db2.gz GQTVJVIMFTWTOV-FQEVSTJZSA-N 2 2 313.489 3.177 20 10 DGCDLP C[N@@H+]1CCC[C@@H]2C[NH+](Cc3ccc(C(C)(C)C)cc3O)C[C@@H]21 ZINC001235678081 1099119930 /nfs/dbraw/zinc/11/99/30/1099119930.db2.gz ADYPRGVBONWUPI-PBHICJAKSA-N 2 2 302.462 3.216 20 10 DGCDLP C[N@H+]1CCC[C@@H]2C[NH+](Cc3ccc(C(C)(C)C)cc3O)C[C@@H]21 ZINC001235678081 1099119937 /nfs/dbraw/zinc/11/99/37/1099119937.db2.gz ADYPRGVBONWUPI-PBHICJAKSA-N 2 2 302.462 3.216 20 10 DGCDLP CCN(CC)c1ccc(C[N@H+](C2CC2)[C@@H]2CCC[NH2+]C2)cc1 ZINC001236238086 1099491856 /nfs/dbraw/zinc/49/18/56/1099491856.db2.gz YUZGXVIKFGOAGQ-LJQANCHMSA-N 2 2 301.478 3.249 20 10 DGCDLP CCN(CC)c1ccc(C[N@@H+](C2CC2)[C@@H]2CCC[NH2+]C2)cc1 ZINC001236238086 1099491865 /nfs/dbraw/zinc/49/18/65/1099491865.db2.gz YUZGXVIKFGOAGQ-LJQANCHMSA-N 2 2 301.478 3.249 20 10 DGCDLP CC(C)(C)c1ccc(C[N@H+](C2CC2)[C@H]2CCC[NH2+]C2)c(O)c1 ZINC001236240516 1099495079 /nfs/dbraw/zinc/49/50/79/1099495079.db2.gz MQDRTMPREIKNOK-KRWDZBQOSA-N 2 2 302.462 3.406 20 10 DGCDLP CC(C)(C)c1ccc(C[N@@H+](C2CC2)[C@H]2CCC[NH2+]C2)c(O)c1 ZINC001236240516 1099495086 /nfs/dbraw/zinc/49/50/86/1099495086.db2.gz MQDRTMPREIKNOK-KRWDZBQOSA-N 2 2 302.462 3.406 20 10 DGCDLP C[NH+]1CC2(C1)CC[NH+](Cc1cc(Cl)c(Cl)cc1O)CC2 ZINC001236795346 1099791182 /nfs/dbraw/zinc/79/11/82/1099791182.db2.gz CJZCNAWFBOIXEZ-UHFFFAOYSA-N 2 2 315.244 3.227 20 10 DGCDLP [NH3+]C[C@@H]1Cc2ccccc2C[N@@H+]1Cc1c(O)ccc2ccccc21 ZINC001237026992 1099931492 /nfs/dbraw/zinc/93/14/92/1099931492.db2.gz CSEGEZDHVATNEK-SFHVURJKSA-N 2 2 318.420 3.431 20 10 DGCDLP [NH3+]C[C@@H]1Cc2ccccc2C[N@H+]1Cc1c(O)ccc2ccccc21 ZINC001237026992 1099931505 /nfs/dbraw/zinc/93/15/05/1099931505.db2.gz CSEGEZDHVATNEK-SFHVURJKSA-N 2 2 318.420 3.431 20 10 DGCDLP C[N@@H+]1CCC[C@@]2(CCC[NH+](Cc3ccc(Cl)cc3O)C2)C1 ZINC001275267828 1104698499 /nfs/dbraw/zinc/69/84/99/1104698499.db2.gz YFLJOHPIRDTVLY-QGZVFWFLSA-N 2 2 308.853 3.353 20 10 DGCDLP C[N@H+]1CCC[C@@]2(CCC[NH+](Cc3ccc(Cl)cc3O)C2)C1 ZINC001275267828 1104698502 /nfs/dbraw/zinc/69/85/02/1104698502.db2.gz YFLJOHPIRDTVLY-QGZVFWFLSA-N 2 2 308.853 3.353 20 10 DGCDLP C[NH+]1CCC[C@@]2(CCC[N@H+](Cc3ccc(Cl)cc3O)C2)C1 ZINC001275267828 1104698506 /nfs/dbraw/zinc/69/85/06/1104698506.db2.gz YFLJOHPIRDTVLY-QGZVFWFLSA-N 2 2 308.853 3.353 20 10 DGCDLP C[NH+]1CCC[C@@]2(CCC[N@@H+](Cc3ccc(Cl)cc3O)C2)C1 ZINC001275267828 1104698508 /nfs/dbraw/zinc/69/85/08/1104698508.db2.gz YFLJOHPIRDTVLY-QGZVFWFLSA-N 2 2 308.853 3.353 20 10 DGCDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+]Cc2ccc3c(c2)CCC3)cc1 ZINC001261370832 1107420826 /nfs/dbraw/zinc/42/08/26/1107420826.db2.gz WBNKSXBJEDZJDP-FQEVSTJZSA-N 2 2 309.457 3.031 20 10 DGCDLP C[C@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1ccc(F)c(F)c1O ZINC000278420782 299286585 /nfs/dbraw/zinc/28/65/85/299286585.db2.gz INWNBUCAHVPLGD-NSHDSACASA-N 2 2 310.388 3.195 20 10 DGCDLP C[C@@H]1CC[N@H+](Cc2ccc(N(C)C)c(F)c2)C[C@@H]1n1cc[nH+]c1 ZINC000271265729 432364907 /nfs/dbraw/zinc/36/49/07/432364907.db2.gz LTOQGRRFMNFXFV-KDOFPFPSSA-N 2 2 316.424 3.171 20 10 DGCDLP C[C@@H]1CC[N@@H+](Cc2ccc(N(C)C)c(F)c2)C[C@@H]1n1cc[nH+]c1 ZINC000271265729 432364911 /nfs/dbraw/zinc/36/49/11/432364911.db2.gz LTOQGRRFMNFXFV-KDOFPFPSSA-N 2 2 316.424 3.171 20 10 DGCDLP C[C@H]1CC[N@H+](Cc2ccc(N(C)C)c(F)c2)C[C@H]1n1cc[nH+]c1 ZINC000271265726 432365156 /nfs/dbraw/zinc/36/51/56/432365156.db2.gz LTOQGRRFMNFXFV-KBXCAEBGSA-N 2 2 316.424 3.171 20 10 DGCDLP C[C@H]1CC[N@@H+](Cc2ccc(N(C)C)c(F)c2)C[C@H]1n1cc[nH+]c1 ZINC000271265726 432365160 /nfs/dbraw/zinc/36/51/60/432365160.db2.gz LTOQGRRFMNFXFV-KBXCAEBGSA-N 2 2 316.424 3.171 20 10 DGCDLP Cc1cc(Br)cc([C@H](C)[NH2+]CCn2cc[nH+]c2)c1O ZINC000186926785 432637846 /nfs/dbraw/zinc/63/78/46/432637846.db2.gz IBWBBUYQEMNUBH-NSHDSACASA-N 2 2 324.222 3.010 20 10 DGCDLP C[NH+](C)[C@H]1CCC[N@H+](Cc2cc(Cl)c(F)cc2O)CC1 ZINC000294754312 434132865 /nfs/dbraw/zinc/13/28/65/434132865.db2.gz RPSANJLLEVVYJZ-LBPRGKRZSA-N 2 2 300.805 3.101 20 10 DGCDLP C[NH+](C)[C@H]1CCC[N@@H+](Cc2cc(Cl)c(F)cc2O)CC1 ZINC000294754312 434132872 /nfs/dbraw/zinc/13/28/72/434132872.db2.gz RPSANJLLEVVYJZ-LBPRGKRZSA-N 2 2 300.805 3.101 20 10 DGCDLP Cc1cccc(C[NH2+]CCCc2[nH+]c3ccccc3n2C)c1O ZINC000181346565 524433125 /nfs/dbraw/zinc/43/31/25/524433125.db2.gz UVDFLIRFWVNELW-UHFFFAOYSA-N 2 2 309.413 3.310 20 10 DGCDLP c1csc(SCCC[NH2+][C@@H]2CCC[N@@H+]3CCCC[C@@H]23)n1 ZINC000925102151 618505674 /nfs/dbraw/zinc/50/56/74/618505674.db2.gz LMRJYJARLVUHTB-KGLIPLIRSA-N 2 2 311.520 3.232 20 10 DGCDLP c1csc(SCCC[NH2+][C@@H]2CCC[N@H+]3CCCC[C@@H]23)n1 ZINC000925102151 618505678 /nfs/dbraw/zinc/50/56/78/618505678.db2.gz LMRJYJARLVUHTB-KGLIPLIRSA-N 2 2 311.520 3.232 20 10 DGCDLP Oc1cccc(F)c1C[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000896637496 618939825 /nfs/dbraw/zinc/93/98/25/618939825.db2.gz NQQCKWCUMDBXQY-UHFFFAOYSA-N 2 2 306.425 3.418 20 10 DGCDLP Cc1ccccc1C[C@@H](C)[NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000841041753 619243264 /nfs/dbraw/zinc/24/32/64/619243264.db2.gz BHCCLTBHSFSHTQ-UZLBHIALSA-N 2 2 311.473 3.282 20 10 DGCDLP CC[C@H]([NH2+][C@@H]1C[C@H]2CC[C@@H]1[NH2+]2)c1ccc(C(F)(F)F)cc1O ZINC000902466828 619641871 /nfs/dbraw/zinc/64/18/71/619641871.db2.gz NJAWUNYXBFZARU-VZZFWQQMSA-N 2 2 314.351 3.345 20 10 DGCDLP C[C@H]([NH2+][C@H](CC[NH+](C)C)c1cccnc1)c1ccc(F)cc1O ZINC000903380778 619768579 /nfs/dbraw/zinc/76/85/79/619768579.db2.gz PHVRYSKDKFLXLE-SUMWQHHRSA-N 2 2 317.408 3.270 20 10 DGCDLP C[N@@H+]1CCCC[C@H](C[NH2+]Cc2c(O)ccc(Cl)c2F)C1 ZINC000858245034 621167647 /nfs/dbraw/zinc/16/76/47/621167647.db2.gz BADONDJGYYXMJF-LLVKDONJSA-N 2 2 300.805 3.006 20 10 DGCDLP C[N@H+]1CCCC[C@H](C[NH2+]Cc2c(O)ccc(Cl)c2F)C1 ZINC000858245034 621167650 /nfs/dbraw/zinc/16/76/50/621167650.db2.gz BADONDJGYYXMJF-LLVKDONJSA-N 2 2 300.805 3.006 20 10 DGCDLP C[N@@H+]1CCC[C@H](CC[NH2+]Cc2cc(Cl)c(F)cc2O)C1 ZINC000839183274 621344767 /nfs/dbraw/zinc/34/47/67/621344767.db2.gz VSHJUWCNJOMSPY-LLVKDONJSA-N 2 2 300.805 3.006 20 10 DGCDLP C[N@H+]1CCC[C@H](CC[NH2+]Cc2cc(Cl)c(F)cc2O)C1 ZINC000839183274 621344769 /nfs/dbraw/zinc/34/47/69/621344769.db2.gz VSHJUWCNJOMSPY-LLVKDONJSA-N 2 2 300.805 3.006 20 10 DGCDLP C[N@@H+]1CCCC[C@@H](C[NH2+]Cc2cc(Cl)c(F)cc2O)C1 ZINC000862483862 621594322 /nfs/dbraw/zinc/59/43/22/621594322.db2.gz ZQRIMQVMVWJUNF-NSHDSACASA-N 2 2 300.805 3.006 20 10 DGCDLP C[N@H+]1CCCC[C@@H](C[NH2+]Cc2cc(Cl)c(F)cc2O)C1 ZINC000862483862 621594323 /nfs/dbraw/zinc/59/43/23/621594323.db2.gz ZQRIMQVMVWJUNF-NSHDSACASA-N 2 2 300.805 3.006 20 10 DGCDLP Cc1cc(N(C)C)ccc1C[NH2+]C[C@H]1CC[N@@H+]1C1CCCC1 ZINC000862522837 621596452 /nfs/dbraw/zinc/59/64/52/621596452.db2.gz IVQRLKZJBZAJFZ-LJQANCHMSA-N 2 2 301.478 3.168 20 10 DGCDLP Cc1cc(N(C)C)ccc1C[NH2+]C[C@H]1CC[N@H+]1C1CCCC1 ZINC000862522837 621596454 /nfs/dbraw/zinc/59/64/54/621596454.db2.gz IVQRLKZJBZAJFZ-LJQANCHMSA-N 2 2 301.478 3.168 20 10 DGCDLP CC[N@@H+]1CCC[C@@H]1C[NH2+][C@H](C)c1cc2c(cc1O)CCCC2 ZINC000756356366 621630618 /nfs/dbraw/zinc/63/06/18/621630618.db2.gz AKJRDKCWBPVHNR-RHSMWYFYSA-N 2 2 302.462 3.406 20 10 DGCDLP CC[N@H+]1CCC[C@@H]1C[NH2+][C@H](C)c1cc2c(cc1O)CCCC2 ZINC000756356366 621630619 /nfs/dbraw/zinc/63/06/19/621630619.db2.gz AKJRDKCWBPVHNR-RHSMWYFYSA-N 2 2 302.462 3.406 20 10 DGCDLP C[C@H](C[NH2+][C@@H](C)c1cc(F)cc(F)c1O)C[NH+]1CCCCC1 ZINC000756435031 621638261 /nfs/dbraw/zinc/63/82/61/621638261.db2.gz SXCLZDLLVZQCQL-OLZOCXBDSA-N 2 2 312.404 3.443 20 10 DGCDLP Cc1[nH+]ccn1C[C@H](C)C[NH2+][C@H](C)c1cc(F)cc(F)c1O ZINC000756534207 621645991 /nfs/dbraw/zinc/64/59/91/621645991.db2.gz LFNQTEYWQHQTOV-GHMZBOCLSA-N 2 2 309.360 3.162 20 10 DGCDLP [NH3+]C[C@H]1C[N@H+](Cc2c(O)cccc2Cl)CC[C@H]1C(F)(F)F ZINC000863646291 621693284 /nfs/dbraw/zinc/69/32/84/621693284.db2.gz ISGYFGSFMYOJON-GXSJLCMTSA-N 2 2 322.758 3.005 20 10 DGCDLP [NH3+]C[C@H]1C[N@@H+](Cc2c(O)cccc2Cl)CC[C@H]1C(F)(F)F ZINC000863646291 621693286 /nfs/dbraw/zinc/69/32/86/621693286.db2.gz ISGYFGSFMYOJON-GXSJLCMTSA-N 2 2 322.758 3.005 20 10 DGCDLP Oc1cccc(Cl)c1C[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000770374308 622625598 /nfs/dbraw/zinc/62/55/98/622625598.db2.gz LDASYKSYUJFNBL-CXAGYDPISA-N 2 2 320.864 3.494 20 10 DGCDLP Oc1cccc(Cl)c1C[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000770374308 622625602 /nfs/dbraw/zinc/62/56/02/622625602.db2.gz LDASYKSYUJFNBL-CXAGYDPISA-N 2 2 320.864 3.494 20 10 DGCDLP Oc1cccc(Cl)c1C[NH+]1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000770374308 622625604 /nfs/dbraw/zinc/62/56/04/622625604.db2.gz LDASYKSYUJFNBL-CXAGYDPISA-N 2 2 320.864 3.494 20 10 DGCDLP Oc1cccc(Cl)c1C[NH+]1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000770374308 622625606 /nfs/dbraw/zinc/62/56/06/622625606.db2.gz LDASYKSYUJFNBL-CXAGYDPISA-N 2 2 320.864 3.494 20 10 DGCDLP Oc1cccc(Cl)c1C[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000770374309 622626319 /nfs/dbraw/zinc/62/63/19/622626319.db2.gz LDASYKSYUJFNBL-DYVFJYSZSA-N 2 2 320.864 3.494 20 10 DGCDLP Oc1cccc(Cl)c1C[N@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000770374309 622626322 /nfs/dbraw/zinc/62/63/22/622626322.db2.gz LDASYKSYUJFNBL-DYVFJYSZSA-N 2 2 320.864 3.494 20 10 DGCDLP Oc1cccc(Cl)c1C[NH+]1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000770374309 622626328 /nfs/dbraw/zinc/62/63/28/622626328.db2.gz LDASYKSYUJFNBL-DYVFJYSZSA-N 2 2 320.864 3.494 20 10 DGCDLP Oc1cccc(Cl)c1C[NH+]1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000770374309 622626332 /nfs/dbraw/zinc/62/63/32/622626332.db2.gz LDASYKSYUJFNBL-DYVFJYSZSA-N 2 2 320.864 3.494 20 10 DGCDLP C[NH+](C)Cc1ccc(C[N@H+](C)Cc2ccc(F)c(F)c2O)cc1 ZINC000877525186 623923409 /nfs/dbraw/zinc/92/34/09/623923409.db2.gz UIAMYFMEIATZKM-UHFFFAOYSA-N 2 2 320.383 3.364 20 10 DGCDLP C[NH+](C)Cc1ccc(C[N@@H+](C)Cc2ccc(F)c(F)c2O)cc1 ZINC000877525186 623923413 /nfs/dbraw/zinc/92/34/13/623923413.db2.gz UIAMYFMEIATZKM-UHFFFAOYSA-N 2 2 320.383 3.364 20 10 DGCDLP CC1([NH+]2CCCCC2)CC[NH+](Cc2cc(F)ccc2O)CC1 ZINC000877794644 624036599 /nfs/dbraw/zinc/03/65/99/624036599.db2.gz OEISENVKZUQDPM-UHFFFAOYSA-N 2 2 306.425 3.372 20 10 DGCDLP CC(C)[N@@H+]1CC[C@@H](C[NH2+]Cc2cc(Cl)cc(F)c2O)C1 ZINC000809735665 626943402 /nfs/dbraw/zinc/94/34/02/626943402.db2.gz NXBAMZVBVXGOFB-NSHDSACASA-N 2 2 300.805 3.005 20 10 DGCDLP CC(C)[N@H+]1CC[C@@H](C[NH2+]Cc2cc(Cl)cc(F)c2O)C1 ZINC000809735665 626943405 /nfs/dbraw/zinc/94/34/05/626943405.db2.gz NXBAMZVBVXGOFB-NSHDSACASA-N 2 2 300.805 3.005 20 10 DGCDLP CC(C)[N@@H+]1CC[C@H](C[NH2+]Cc2cc(Cl)cc(F)c2O)C1 ZINC000809735664 626943621 /nfs/dbraw/zinc/94/36/21/626943621.db2.gz NXBAMZVBVXGOFB-LLVKDONJSA-N 2 2 300.805 3.005 20 10 DGCDLP CC(C)[N@H+]1CC[C@H](C[NH2+]Cc2cc(Cl)cc(F)c2O)C1 ZINC000809735664 626943622 /nfs/dbraw/zinc/94/36/22/626943622.db2.gz NXBAMZVBVXGOFB-LLVKDONJSA-N 2 2 300.805 3.005 20 10 DGCDLP C[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2Cc2c(O)ccc(Cl)c2F)C1 ZINC000809767492 626948944 /nfs/dbraw/zinc/94/89/44/626948944.db2.gz MTDJHSJZKAGEMF-SMDDNHRTSA-N 2 2 312.816 3.101 20 10 DGCDLP C[N@H+]1CC[C@@H]2[C@@H](CCC[NH+]2Cc2c(O)ccc(Cl)c2F)C1 ZINC000809767492 626948949 /nfs/dbraw/zinc/94/89/49/626948949.db2.gz MTDJHSJZKAGEMF-SMDDNHRTSA-N 2 2 312.816 3.101 20 10 DGCDLP C[NH+]1CC[C@@H]2[C@@H](CCC[N@@H+]2Cc2c(O)ccc(Cl)c2F)C1 ZINC000809767492 626948952 /nfs/dbraw/zinc/94/89/52/626948952.db2.gz MTDJHSJZKAGEMF-SMDDNHRTSA-N 2 2 312.816 3.101 20 10 DGCDLP C[NH+]1CC[C@@H]2[C@@H](CCC[N@H+]2Cc2c(O)ccc(Cl)c2F)C1 ZINC000809767492 626948957 /nfs/dbraw/zinc/94/89/57/626948957.db2.gz MTDJHSJZKAGEMF-SMDDNHRTSA-N 2 2 312.816 3.101 20 10 DGCDLP Cc1cc(C)c([C@H](C)[NH2+]CCc2cn3c([nH+]2)CCCC3)c(O)c1 ZINC000815558408 627685079 /nfs/dbraw/zinc/68/50/79/627685079.db2.gz BVZWVCUVFUOMEC-HNNXBMFYSA-N 2 2 313.445 3.435 20 10 DGCDLP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2cc(Cl)c(F)cc2O)[C@H](C)C1 ZINC000816514724 627799834 /nfs/dbraw/zinc/79/98/34/627799834.db2.gz FXVVOTZUBYVTHP-IAQYHMDHSA-N 2 2 314.832 3.347 20 10 DGCDLP CC[N@H+]1CC[C@@H]([NH+](C)Cc2cc(Cl)c(F)cc2O)[C@H](C)C1 ZINC000816514724 627799839 /nfs/dbraw/zinc/79/98/39/627799839.db2.gz FXVVOTZUBYVTHP-IAQYHMDHSA-N 2 2 314.832 3.347 20 10 DGCDLP CC[NH+]1CC[C@@H]([N@H+](C)Cc2cc(Cl)c(F)cc2O)[C@H](C)C1 ZINC000816514724 627799842 /nfs/dbraw/zinc/79/98/42/627799842.db2.gz FXVVOTZUBYVTHP-IAQYHMDHSA-N 2 2 314.832 3.347 20 10 DGCDLP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2cc(Cl)c(F)cc2O)[C@H](C)C1 ZINC000816514724 627799847 /nfs/dbraw/zinc/79/98/47/627799847.db2.gz FXVVOTZUBYVTHP-IAQYHMDHSA-N 2 2 314.832 3.347 20 10 DGCDLP CC[N@@H+]1CC[C@H]([NH+](C)Cc2cc(Cl)c(F)cc2O)[C@@H](C)C1 ZINC000816514725 627800047 /nfs/dbraw/zinc/80/00/47/627800047.db2.gz FXVVOTZUBYVTHP-NHYWBVRUSA-N 2 2 314.832 3.347 20 10 DGCDLP CC[N@H+]1CC[C@H]([NH+](C)Cc2cc(Cl)c(F)cc2O)[C@@H](C)C1 ZINC000816514725 627800051 /nfs/dbraw/zinc/80/00/51/627800051.db2.gz FXVVOTZUBYVTHP-NHYWBVRUSA-N 2 2 314.832 3.347 20 10 DGCDLP CC[NH+]1CC[C@H]([N@H+](C)Cc2cc(Cl)c(F)cc2O)[C@@H](C)C1 ZINC000816514725 627800055 /nfs/dbraw/zinc/80/00/55/627800055.db2.gz FXVVOTZUBYVTHP-NHYWBVRUSA-N 2 2 314.832 3.347 20 10 DGCDLP CC[NH+]1CC[C@H]([N@@H+](C)Cc2cc(Cl)c(F)cc2O)[C@@H](C)C1 ZINC000816514725 627800058 /nfs/dbraw/zinc/80/00/58/627800058.db2.gz FXVVOTZUBYVTHP-NHYWBVRUSA-N 2 2 314.832 3.347 20 10 DGCDLP CC(=O)c1cc(Cl)cc(C[N@@H+]2C[C@H](C[NH3+])[C@H](C)C[C@H]2C)c1O ZINC000817880391 627952621 /nfs/dbraw/zinc/95/26/21/627952621.db2.gz RNAHNRIXWXZKJN-GYSYKLTISA-N 2 2 324.852 3.053 20 10 DGCDLP CC(=O)c1cc(Cl)cc(C[N@H+]2C[C@H](C[NH3+])[C@H](C)C[C@H]2C)c1O ZINC000817880391 627952626 /nfs/dbraw/zinc/95/26/26/627952626.db2.gz RNAHNRIXWXZKJN-GYSYKLTISA-N 2 2 324.852 3.053 20 10 DGCDLP C[C@H](Cc1cccs1)[NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000817939069 627967223 /nfs/dbraw/zinc/96/72/23/627967223.db2.gz YLZMUOQPXMPCND-DYVFJYSZSA-N 2 2 303.475 3.035 20 10 DGCDLP Cc1cc([C@H](C)[NH2+]C[C@H]([NH3+])c2ccc(N(C)C)cc2)c(C)o1 ZINC000817939216 627967395 /nfs/dbraw/zinc/96/73/95/627967395.db2.gz AMMIEAOHFFGXKI-UGSOOPFHSA-N 2 2 301.434 3.313 20 10 DGCDLP Cc1ccsc1[C@@H](C)[NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000817938954 627967839 /nfs/dbraw/zinc/96/78/39/627967839.db2.gz WFFPNQSMCIZVLV-CZUORRHYSA-N 2 2 303.475 3.473 20 10 DGCDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+][C@H](C2CC2)C2CCCC2)cc1 ZINC000817940873 627968546 /nfs/dbraw/zinc/96/85/46/627968546.db2.gz LTNCDPAEQNGLAX-OALUTQOASA-N 2 2 301.478 3.311 20 10 DGCDLP C[C@@H]([NH2+][C@H]1CC[NH2+][C@H](C)C1)c1cc(Cl)c(Cl)cc1O ZINC000817971803 627980064 /nfs/dbraw/zinc/98/00/64/627980064.db2.gz QDQJFYTXGFMRHY-BBBLOLIVSA-N 2 2 303.233 3.490 20 10 DGCDLP C[C@H](CCC[NH3+])[NH2+][C@H](C)c1cc(Br)c(F)cc1O ZINC000817977933 627981590 /nfs/dbraw/zinc/98/15/90/627981590.db2.gz RSJUTCAHTCRBAE-RKDXNWHRSA-N 2 2 319.218 3.072 20 10 DGCDLP CC[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)c1cccc(Cl)c1O ZINC000817987341 627984098 /nfs/dbraw/zinc/98/40/98/627984098.db2.gz SUUWCANCBHPJEL-IATRGZMQSA-N 2 2 308.853 3.474 20 10 DGCDLP Cc1cc(O)c(C[NH+]2CCC(n3cc[nH+]c3)CC2)cc1Cl ZINC000824639432 628679487 /nfs/dbraw/zinc/67/94/87/628679487.db2.gz LLODMCGZEKOFIG-UHFFFAOYSA-N 2 2 305.809 3.388 20 10 DGCDLP Cc1cc(O)c(C[NH+]2CC[C@@]3(C2)CCC[N@@H+](C)C3)cc1Cl ZINC000826016379 628820299 /nfs/dbraw/zinc/82/02/99/628820299.db2.gz IMOMJDUYBQRFGW-KRWDZBQOSA-N 2 2 308.853 3.272 20 10 DGCDLP Cc1cc(O)c(C[NH+]2CC[C@@]3(C2)CCC[N@H+](C)C3)cc1Cl ZINC000826016379 628820300 /nfs/dbraw/zinc/82/03/00/628820300.db2.gz IMOMJDUYBQRFGW-KRWDZBQOSA-N 2 2 308.853 3.272 20 10 DGCDLP Cc1cc(O)c(C[N@H+]2CC[C@@]3(C2)CCC[NH+](C)C3)cc1Cl ZINC000826016379 628820302 /nfs/dbraw/zinc/82/03/02/628820302.db2.gz IMOMJDUYBQRFGW-KRWDZBQOSA-N 2 2 308.853 3.272 20 10 DGCDLP Cc1cc(O)c(C[N@@H+]2CC[C@@]3(C2)CCC[NH+](C)C3)cc1Cl ZINC000826016379 628820305 /nfs/dbraw/zinc/82/03/05/628820305.db2.gz IMOMJDUYBQRFGW-KRWDZBQOSA-N 2 2 308.853 3.272 20 10 DGCDLP Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@@H]1C[N@@H+](C2CC2)C[C@H]1C ZINC000840893873 630373762 /nfs/dbraw/zinc/37/37/62/630373762.db2.gz NNWVPLKOMUJRQN-GQIGUUNPSA-N 2 2 315.505 3.064 20 10 DGCDLP Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@@H]1C[N@H+](C2CC2)C[C@H]1C ZINC000840893873 630373766 /nfs/dbraw/zinc/37/37/66/630373766.db2.gz NNWVPLKOMUJRQN-GQIGUUNPSA-N 2 2 315.505 3.064 20 10 DGCDLP Cc1cc(N(C)C)ccc1C[NH2+]CCCCNc1cccc[nH+]1 ZINC000840932393 630379880 /nfs/dbraw/zinc/37/98/80/630379880.db2.gz PZDGAWAXFCXEDN-UHFFFAOYSA-N 2 2 312.461 3.438 20 10 DGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+]Cc2cnc3ccccc3c2)cc1 ZINC000841044926 630401245 /nfs/dbraw/zinc/40/12/45/630401245.db2.gz FYHJJOXTZDIMAD-LJQANCHMSA-N 2 2 320.440 3.090 20 10 DGCDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+]C[C@@H]2C[C@H]2c2ccccc2)cc1 ZINC000841044425 630401278 /nfs/dbraw/zinc/40/12/78/630401278.db2.gz WPMKKFQICLDUQG-IHPCNDPISA-N 2 2 309.457 3.146 20 10 DGCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+]Cc2ccc3cnccc3c2)cc1 ZINC000841043233 630401444 /nfs/dbraw/zinc/40/14/44/630401444.db2.gz PLGOBXSFZGUCOH-HXUWFJFHSA-N 2 2 320.440 3.090 20 10 DGCDLP CC[C@H](Cc1ccccc1)[NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000841046149 630401755 /nfs/dbraw/zinc/40/17/55/630401755.db2.gz WZKXDEPBCVRUFZ-UYAOXDASSA-N 2 2 311.473 3.363 20 10 DGCDLP C[C@@H](CCc1ccsc1)[NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000841046138 630401873 /nfs/dbraw/zinc/40/18/73/630401873.db2.gz WWMNZHAFQCMIFE-KSSFIOAISA-N 2 2 317.502 3.425 20 10 DGCDLP Oc1ccc(Cl)c(F)c1C[N@@H+]1CCCC[C@@H]1[C@H]1CC[NH2+]C1 ZINC000841085716 630406292 /nfs/dbraw/zinc/40/62/92/630406292.db2.gz BJIFPAYFKQCFMY-SMDDNHRTSA-N 2 2 312.816 3.149 20 10 DGCDLP Oc1ccc(Cl)c(F)c1C[N@H+]1CCCC[C@@H]1[C@H]1CC[NH2+]C1 ZINC000841085716 630406295 /nfs/dbraw/zinc/40/62/95/630406295.db2.gz BJIFPAYFKQCFMY-SMDDNHRTSA-N 2 2 312.816 3.149 20 10 DGCDLP [NH3+]Cc1ccc2c(c1)CCCN2Cc1ccc(-n2cc[nH+]c2)cc1 ZINC000843057902 630610003 /nfs/dbraw/zinc/61/00/03/630610003.db2.gz XJAGYEXCMSLGCB-UHFFFAOYSA-N 2 2 318.424 3.284 20 10 DGCDLP [NH3+]CC[N@H+](CCc1ccccc1)Cc1cc(Cl)ccc1O ZINC000843123057 630615952 /nfs/dbraw/zinc/61/59/52/630615952.db2.gz YPNMJHXQZYJYCZ-UHFFFAOYSA-N 2 2 304.821 3.049 20 10 DGCDLP [NH3+]CC[N@@H+](CCc1ccccc1)Cc1cc(Cl)ccc1O ZINC000843123057 630615953 /nfs/dbraw/zinc/61/59/53/630615953.db2.gz YPNMJHXQZYJYCZ-UHFFFAOYSA-N 2 2 304.821 3.049 20 10 DGCDLP COc1cccc([C@H](C)[NH2+][C@@H](Cn2cc[nH+]c2)C(C)(C)C)c1O ZINC000846144934 631211857 /nfs/dbraw/zinc/21/18/57/631211857.db2.gz ODWLNABXYFYLIZ-BBRMVZONSA-N 2 2 317.433 3.363 20 10 DGCDLP C[C@H]([NH2+][C@H]1CCC[N@@H+]2CCCC[C@@H]12)c1ccc(N(C)C)cc1 ZINC000848568697 631696639 /nfs/dbraw/zinc/69/66/39/631696639.db2.gz OQBMUPNFLMXWMB-SNRMKQJTSA-N 2 2 301.478 3.420 20 10 DGCDLP C[C@H]([NH2+][C@H]1CCC[N@H+]2CCCC[C@@H]12)c1ccc(N(C)C)cc1 ZINC000848568697 631696644 /nfs/dbraw/zinc/69/66/44/631696644.db2.gz OQBMUPNFLMXWMB-SNRMKQJTSA-N 2 2 301.478 3.420 20 10 DGCDLP C[C@H]([NH2+][C@H]1CCC[N@@H+]2CCCC[C@H]12)c1ccc(N(C)C)cc1 ZINC000848568698 631696905 /nfs/dbraw/zinc/69/69/05/631696905.db2.gz OQBMUPNFLMXWMB-ZYSHUDEJSA-N 2 2 301.478 3.420 20 10 DGCDLP C[C@H]([NH2+][C@H]1CCC[N@H+]2CCCC[C@H]12)c1ccc(N(C)C)cc1 ZINC000848568698 631696909 /nfs/dbraw/zinc/69/69/09/631696909.db2.gz OQBMUPNFLMXWMB-ZYSHUDEJSA-N 2 2 301.478 3.420 20 10 DGCDLP CN(C)c1ccc(/C=C\C[NH2+][C@@H]2CCC[N@@H+]3CCCC[C@@H]23)cc1 ZINC000848574126 631699898 /nfs/dbraw/zinc/69/98/98/631699898.db2.gz AAJHLSQTOZKVGQ-GWUCSLHKSA-N 2 2 313.489 3.372 20 10 DGCDLP CN(C)c1ccc(/C=C\C[NH2+][C@@H]2CCC[N@H+]3CCCC[C@@H]23)cc1 ZINC000848574126 631699902 /nfs/dbraw/zinc/69/99/02/631699902.db2.gz AAJHLSQTOZKVGQ-GWUCSLHKSA-N 2 2 313.489 3.372 20 10 DGCDLP Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2[NH2+][C@@H]1Cc2ccccc2[C@H]1[NH3+] ZINC001336077222 1178990254 /nfs/dbraw/zinc/99/02/54/1178990254.db2.gz HZMQZVOXDMFSHC-DKIXSGTJSA-N 2 2 308.425 3.463 20 10 DGCDLP CCCn1cc[nH+]c1CCC[N@H+](C)Cc1cc(F)c(F)cc1O ZINC001652394119 1195591636 /nfs/dbraw/zinc/59/16/36/1195591636.db2.gz PLWPUJAVKZCMNS-UHFFFAOYSA-N 2 2 323.387 3.342 20 10 DGCDLP CCCn1cc[nH+]c1CCC[N@@H+](C)Cc1cc(F)c(F)cc1O ZINC001652394119 1195591639 /nfs/dbraw/zinc/59/16/39/1195591639.db2.gz PLWPUJAVKZCMNS-UHFFFAOYSA-N 2 2 323.387 3.342 20 10 DGCDLP Cc1ccc(C[NH2+][C@@H](Cn2cc[nH+]c2)c2ccccc2)c(O)c1 ZINC001658789200 1196301228 /nfs/dbraw/zinc/30/12/28/1196301228.db2.gz YLMORHGTJFCTBA-SFHVURJKSA-N 2 2 307.397 3.428 20 10 DGCDLP C[NH+](C)CC[C@@H]([NH2+]Cc1ccc(Cl)cc1O)c1cccnc1 ZINC001660741970 1196517884 /nfs/dbraw/zinc/51/78/84/1196517884.db2.gz FXSSQZKJUKDCTO-MRXNPFEDSA-N 2 2 319.836 3.223 20 10 DGCDLP